data_5kx2_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 5kx2 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo . . . . . 0 N--CA 1.446 -1.306 0 N-CA-C 112.808 0.272 . . . . 0.0 112.808 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.1 t -108.35 132.2 56.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -177.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 27.2 m -106.93 128.49 54.37 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -113.59 101.38 9.28 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 72.2 m -92.16 99.65 12.41 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.405 0.621 . . . . 0.0 110.472 178.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.9 m -109.96 165.98 5.34 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.009 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -127.22 137.57 52.93 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.489 178.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.0 mt . . . . . 0 C--N 1.291 -1.948 0 N-CA-C 105.094 -2.188 . . . . 0.0 105.094 175.882 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo . . . . . 0 CA--C 1.539 0.734 0 CA-C-O 120.896 0.29 . . . . 0.0 112.59 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.3 m -105.35 124.82 50.18 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-O 121.261 0.553 . . . . 0.0 111.047 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.7 t -101.32 137.17 29.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 -133.94 139.7 46.29 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.003 0.43 . . . . 0.0 110.353 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 72.6 m -110.01 105.36 14.46 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 177.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 18.9 m -91.06 126.21 36.08 Favored 'General case' 0 N--CA 1.422 -1.827 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 25.6 t -98.56 127.23 51.32 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.029 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.4 mmm180 . . . . . 0 C--N 1.297 -1.716 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 178.586 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo . . . . . 0 N--CA 1.444 -1.43 0 CA-C-O 120.482 0.117 . . . . 0.0 112.21 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.1 t -111.6 128.86 67.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 O-C-N 121.669 -0.645 . . . . 0.0 111.376 -176.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.5 m -92.19 116.07 28.63 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . 0.548 ' CD1' ' HD3' ' A' ' 17' ' ' ARG . 92.8 m95 -102.62 113.04 26.08 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.397 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 72.7 m -106.65 111.11 23.5 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.2 t -116.65 126.8 74.28 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.0 ptt180 -85.49 102.72 13.73 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-O 121.905 0.859 . . . . 0.0 109.863 178.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.8 mt . . . . . 0 C--N 1.295 -1.783 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 179.474 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 N--CA 1.449 -1.134 0 CA-C-O 120.957 0.315 . . . . 0.0 112.087 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.0 p -108.16 109.94 21.46 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-O 121.311 0.577 . . . . 0.0 111.675 -176.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.5 t -85.38 119.16 33.49 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 175.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 71.1 ttt180 -107.19 111.93 24.57 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.07 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 87.2 m -103.95 91.71 4.09 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.565 0.698 . . . . 0.0 109.838 176.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.3 m -111.76 128.21 56.03 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.217 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 27.4 m -81.79 140.92 15.8 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 CA-C-O 121.586 0.707 . . . . 0.0 111.861 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.548 ' HD3' ' CD1' ' A' ' 4' ' ' TRP . 70.1 mtp180 . . . . . 0 C--N 1.292 -1.902 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 175.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo . . . . . 0 N--CA 1.444 -1.388 0 N-CA-C 113.353 0.482 . . . . 0.0 113.353 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.83 119.5 62.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 O-C-N 121.544 -0.722 . . . . 0.0 111.069 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 34.6 m -93.58 112.52 24.42 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 176.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -93.51 111.02 22.59 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 65.7 m -105.75 106.24 16.65 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-O 121.22 0.533 . . . . 0.0 109.789 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.1 p -98.9 142.43 14.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -117.53 128.76 55.28 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 121.22 0.533 . . . . 0.0 112.367 -174.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.6 mt . . . . . 0 C--N 1.297 -1.683 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 176.254 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo . . . . . 0 CA--C 1.536 0.611 0 N-CA-C 112.473 0.143 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.9 m -101.25 115.97 31.72 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 121.426 0.632 . . . . 0.0 110.941 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.2 t -105.39 129.45 58.24 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.522 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 93.6 mtt180 -112.49 115.07 28.07 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -98.91 103.77 15.76 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-O 121.432 0.634 . . . . 0.0 110.187 176.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.5 m -106.77 119.98 40.79 Favored 'General case' 0 C--N 1.298 -1.652 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.409 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 10.8 p -92.71 134.02 32.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 CA-C-O 121.475 0.655 . . . . 0.0 111.56 -176.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 . . . . . 0 C--N 1.3 -1.548 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 174.844 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 CA--C 1.548 1.184 0 N-CA-C 113.079 0.376 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 25.7 t -108.33 136.9 42.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 O-C-N 121.95 -0.469 . . . . 0.0 110.303 -177.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.5 m -114.48 121.69 44.3 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -110.35 100.85 9.64 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 77.3 m -90.89 105.03 17.54 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.332 0.587 . . . . 0.0 109.545 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.1 m -103.06 153.69 5.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -118.19 121.17 39.81 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 121.789 0.804 . . . . 0.0 111.528 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 60.6 mt . . . . . 0 C--N 1.301 -1.543 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 178.352 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo . . . . . 0 N--CA 1.449 -1.123 0 N-CA-C 112.44 0.131 . . . . 0.0 112.44 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.0 m -104.76 121.05 42.8 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 121.088 0.47 . . . . 0.0 110.415 -177.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.3 p -94.59 136.2 26.54 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.774 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -129.52 127.89 41.7 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 76.9 m -104.89 102.36 11.89 Favored 'General case' 0 C--N 1.294 -1.827 0 CA-C-O 121.762 0.792 . . . . 0.0 111.346 -176.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.1 p -89.58 112.42 23.62 Favored 'General case' 0 N--CA 1.424 -1.744 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.945 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.7 t -91.02 128.6 42.72 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.198 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 . . . . . 0 C--N 1.296 -1.725 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.689 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo . . . . . 0 CA--C 1.539 0.774 0 N-CA-C 113.088 0.38 . . . . 0.0 113.088 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.7 t -111.61 147.43 15.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -177.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 28.8 m -128.0 134.49 49.26 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -118.33 112.63 20.29 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.9 m -105.69 118.94 37.86 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 120.917 0.389 . . . . 0.0 110.656 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.1 m -127.68 138.03 55.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.487 ' HA ' ' HA ' ' A' ' 12' ' ' VAL . 44.7 ttp85 -97.07 113.07 24.59 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-O 121.166 0.508 . . . . 0.0 110.799 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 46.5 mm . . . . . 0 C--N 1.296 -1.757 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 179.365 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo . . . . . 0 CA--C 1.543 0.94 0 N-CA-C 112.678 0.222 . . . . 0.0 112.678 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 p -126.21 121.45 32.78 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -177.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.487 ' HA ' ' HA ' ' A' ' 7' ' ' ARG . 7.1 p -95.57 128.36 46.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.097 0.475 . . . . 0.0 110.232 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.1 mtm180 -112.86 127.94 56.32 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 90.9 m -106.35 107.53 18.59 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.0 m -88.86 114.72 25.79 Favored 'General case' 0 N--CA 1.412 -2.368 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 -178.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.9 p -90.72 115.95 31.01 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.816 0 CA-C-O 121.461 0.648 . . . . 0.0 109.974 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 . . . . . 0 C--N 1.3 -1.58 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 179.907 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo . . . . . 0 N--CA 1.439 -1.727 0 N-CA-C 112.295 0.075 . . . . 0.0 112.295 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.9 t -116.74 126.5 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.637 -174.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 49.1 m -99.05 108.64 21.35 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 175.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 78.5 m95 -89.94 106.57 18.56 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 74.6 m -105.08 111.86 24.79 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 121.56 0.695 . . . . 0.0 112.119 -178.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -105.3 140.45 23.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 175.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -116.54 126.99 54.12 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.608 -0.837 . . . . 0.0 111.506 -177.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.3 mp . . . . . 0 C--N 1.293 -1.865 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 177.086 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo . . . . . 0 N--CA 1.457 -0.635 0 N-CA-C 113.015 0.352 . . . . 0.0 113.015 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.2 m -101.45 126.64 48.26 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 120.867 0.365 . . . . 0.0 110.079 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 35.2 m -107.48 140.12 26.89 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 CA-C-O 120.971 0.415 . . . . 0.0 109.884 178.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -122.79 105.46 10.06 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 176.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 88.3 m -104.68 110.06 22.23 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.595 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.3 m -102.38 114.79 29.28 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.75 112.49 26.78 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.862 0 CA-C-O 122.272 1.034 . . . . 0.0 111.096 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 . . . . . 0 C--N 1.297 -1.711 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.26 -178.636 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo . . . . . 0 N--CA 1.443 -1.483 0 CA-C-O 120.62 0.175 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.3 t -113.24 129.98 68.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 121.666 -0.646 . . . . 0.0 111.103 -176.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 58.0 m -100.18 114.82 28.52 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.686 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -104.09 117.08 33.4 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 80.7 m -103.53 111.18 23.52 Favored 'General case' 0 C--N 1.298 -1.65 0 C-N-CA 119.603 -0.839 . . . . 0.0 111.43 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p -104.03 135.08 43.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.193 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -90.09 121.14 31.88 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-O 121.218 0.533 . . . . 0.0 110.491 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.6 mt . . . . . 0 C--N 1.297 -1.682 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.507 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo . . . . . 0 N--CA 1.453 -0.873 0 CA-C-O 120.774 0.239 . . . . 0.0 112.648 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.7 p -114.53 130.82 56.79 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -174.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.0 t -103.71 121.8 55.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -105.13 122.65 46.33 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.187 -176.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 87.5 m -94.85 104.28 16.18 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.727 0.775 . . . . 0.0 110.491 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.1 p -89.84 109.58 20.57 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.646 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.7 t -86.33 115.84 28.13 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 . . . . . 0 C--N 1.29 -1.999 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 179.367 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 CA--C 1.545 1.045 0 CA-C-O 121.342 0.476 . . . . 0.0 112.192 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.7 t -94.97 130.16 44.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 53.1 m -130.13 105.33 7.87 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-O 121.25 0.548 . . . . 0.0 110.936 -178.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -91.64 102.74 15.38 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.152 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 75.1 m -94.35 100.86 12.81 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-O 121.339 0.59 . . . . 0.0 109.412 177.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.0 p -106.42 131.28 56.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.807 -177.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -78.39 109.97 13.02 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.519 0.676 . . . . 0.0 110.657 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.3 tt . . . . . 0 C--N 1.292 -1.906 0 CA-C-N 114.433 -1.258 . . . . 0.0 107.731 177.75 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo . . . . . 0 N--CA 1.457 -0.638 0 CA-C-O 121.13 0.387 . . . . 0.0 112.116 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.4 p -119.15 164.48 15.51 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 122.17 -0.331 . . . . 0.0 111.332 -176.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.7 t -119.19 124.19 72.65 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -105.74 109.98 22.12 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 73.6 m -92.08 107.86 19.52 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 121.69 0.757 . . . . 0.0 110.294 177.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.4 m -90.91 111.87 23.49 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 114.746 -1.116 . . . . 0.0 108.167 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.5 t -97.38 110.88 26.06 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 CA-C-O 121.241 0.543 . . . . 0.0 110.192 -176.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 32.8 mmt180 . . . . . 0 C--N 1.303 -1.42 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 175.868 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo . . . . . 0 N--CA 1.444 -1.405 0 CA-C-O 120.666 0.194 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.5 t -108.01 122.31 62.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -175.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 17.1 m -102.47 110.75 22.79 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 77.9 m95 -91.37 121.43 33.08 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 71.5 m -110.73 100.46 9.22 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 121.366 0.603 . . . . 0.0 110.871 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.6 p -99.63 126.59 52.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.549 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.451 ' HA ' ' HA ' ' A' ' 12' ' ' VAL . 40.0 ttm180 -91.04 114.75 27.36 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 120.884 0.373 . . . . 0.0 111.322 -176.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 63.9 mt . . . . . 0 C--N 1.302 -1.489 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 174.716 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo . . . . . 0 N--CA 1.456 -0.683 0 CA-C-O 120.93 0.304 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.3 p -114.19 116.54 29.23 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -176.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.451 ' HA ' ' HA ' ' A' ' 7' ' ' ARG . 7.5 p -92.79 130.67 41.54 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.948 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 174.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -105.28 111.1 23.71 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 92.0 m -96.58 99.43 11.06 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.539 0.685 . . . . 0.0 110.153 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.4 m -96.13 116.77 29.49 Favored 'General case' 0 N--CA 1.416 -2.141 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.5 p -85.27 114.55 25.5 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 CA-C-O 121.864 0.84 . . . . 0.0 110.264 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 . . . . . 0 C--N 1.3 -1.564 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 178.738 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo . . . . . 0 CA--C 1.542 0.894 0 CA-C-O 121.01 0.338 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 50.6 t -109.86 141.1 26.1 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -178.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 40.4 m -130.19 128.7 42.24 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.747 -0.595 . . . . 0.0 110.71 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -115.73 142.94 46.08 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.3 m -121.37 126.18 48.78 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 121.15 0.5 . . . . 0.0 110.441 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 55.0 t -99.26 124.84 52.8 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -100.68 118.74 37.41 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.51 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 39.7 mt . . . . . 0 C--N 1.304 -1.402 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 178.547 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo . . . . . 0 CA--C 1.54 0.802 0 CA-C-O 121.339 0.474 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.4 m -91.64 129.52 37.6 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.429 -178.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.78 123.92 55.49 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-O 121.467 0.651 . . . . 0.0 109.573 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -115.25 114.14 24.82 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.828 -0.623 . . . . 0.0 109.807 -177.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 85.7 m -100.65 113.55 26.5 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 121.622 0.725 . . . . 0.0 109.965 177.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.4 m -101.33 128.36 47.53 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.744 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 31.3 m -89.5 133.79 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.532 0 CA-C-O 121.489 0.661 . . . . 0.0 110.736 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 . . . . . 0 C--N 1.286 -2.18 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 175.881 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo . . . . . 0 N--CA 1.447 -1.229 0 N-CA-C 113.686 0.61 . . . . 0.0 113.686 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 37.9 t -115.78 127.94 73.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 C-N-CA 119.707 -0.797 . . . . 0.0 111.805 -175.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.2 m -93.1 110.3 21.79 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -96.89 99.49 11.05 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 78.1 m -91.34 109.86 21.14 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.4 m -101.92 138.89 24.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.581 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -109.74 134.25 52.21 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.943 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 55.7 mt . . . . . 0 C--N 1.302 -1.498 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 176.869 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo . . . . . 0 N--CA 1.452 -0.955 0 CA-C-O 121.168 0.403 . . . . 0.0 111.748 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 m -94.36 133.65 37.7 Favored 'General case' 0 N--CA 1.423 -1.794 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.336 -176.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -129.22 122.42 56.05 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -119.99 113.89 21.2 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.072 -177.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 81.7 m -92.73 101.7 14.1 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 121.929 0.871 . . . . 0.0 110.296 177.007 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.9 m -100.28 110.25 22.49 Favored 'General case' 0 N--CA 1.414 -2.266 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.172 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -89.45 121.26 39.4 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 CA-C-O 121.847 0.832 . . . . 0.0 110.994 -176.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 . . . . . 0 C--N 1.296 -1.755 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.54 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo . . . . . 0 N--CA 1.448 -1.164 0 N-CA-C 112.918 0.315 . . . . 0.0 112.918 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.6 t -105.55 122.9 59.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.977 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.5 m -85.04 117.74 24.18 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -105.88 100.37 9.93 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 120.888 0.375 . . . . 0.0 110.995 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 71.2 m -90.0 99.96 12.87 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-O 121.573 0.702 . . . . 0.0 109.412 177.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 30.8 m -99.76 147.11 7.71 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.405 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -102.5 122.15 43.77 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.07 -176.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 C--N 1.309 -1.169 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 176.074 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo . . . . . 0 CA--C 1.546 1.09 0 N-CA-C 113.46 0.523 . . . . 0.0 113.46 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.4 m -116.2 126.45 53.65 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.257 0.551 . . . . 0.0 111.951 -174.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.8 t -91.45 130.42 40.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -116.11 111.33 20.11 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 85.0 m -94.01 97.36 10.28 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.762 0.792 . . . . 0.0 110.761 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 34.7 m -89.81 134.08 34.38 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 114.577 -1.192 . . . . 0.0 108.337 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 m -98.15 118.92 45.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 C-N-CA 120.071 -0.652 . . . . 0.0 111.289 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 . . . . . 0 C--N 1.299 -1.592 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.045 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo . . . . . 0 N--CA 1.442 -1.547 0 N-CA-C 113.082 0.378 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.3 t -119.46 140.01 44.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 O-C-N 121.876 -0.515 . . . . 0.0 111.11 -175.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.3 m -104.03 103.66 13.51 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 176.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -90.74 116.17 28.39 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.932 -177.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 73.8 m -98.23 101.19 12.57 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.2 m -99.18 131.54 46.27 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.336 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -104.17 98.73 8.5 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-O 122.077 0.941 . . . . 0.0 110.264 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.3 mt . . . . . 0 C--N 1.293 -1.877 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -179.216 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 N--CA 1.438 -1.786 0 CA-C-O 120.757 0.232 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.7 m -113.7 120.78 42.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 121.267 0.556 . . . . 0.0 110.441 -179.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.4 t -107.28 109.3 27.68 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.823 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -104.95 115.34 30.11 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.362 -178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.8 m -96.82 90.09 5.13 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-O 121.589 0.709 . . . . 0.0 109.166 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.3 m -95.42 127.08 41.17 Favored 'General case' 0 N--CA 1.424 -1.738 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.604 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.4 p -83.02 114.56 24.04 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.617 0 CA-C-O 121.882 0.849 . . . . 0.0 109.399 177.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 . . . . . 0 C--N 1.288 -2.099 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 179.068 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 N--CA 1.448 -1.175 0 N-CA-C 113.009 0.35 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.73 124.92 68.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 O-C-N 121.819 -0.55 . . . . 0.0 111.348 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.1 m -100.66 113.09 25.66 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -99.3 106.38 18.49 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 76.1 m -94.45 105.5 17.47 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.6 m -99.17 157.75 3.69 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.685 -179.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.6 ptp85 -114.85 134.92 54.74 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 121.728 0.775 . . . . 0.0 111.836 -176.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--N 1.291 -1.965 0 N-CA-C 104.441 -2.429 . . . . 0.0 104.441 171.942 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo . . . . . 0 CA--C 1.535 0.561 0 N-CA-C 113.291 0.458 . . . . 0.0 113.291 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.3 m -106.12 133.59 50.59 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.2 m -110.34 143.53 20.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.4 ttt180 -121.49 112.36 18.42 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 71.9 m -89.12 104.98 17.48 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-O 121.732 0.777 . . . . 0.0 110.124 177.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.9 m -99.39 111.47 23.83 Favored 'General case' 0 N--CA 1.418 -2.058 0 CA-C-N 114.527 -1.215 . . . . 0.0 108.509 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.7 p -91.51 122.5 42.98 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.284 0 CA-C-O 121.564 0.697 . . . . 0.0 109.956 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 . . . . . 0 C--N 1.289 -2.043 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 179.78 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo . . . . . 0 CA--C 1.541 0.84 0 CA-C-O 121.041 0.351 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.0 t -107.82 126.72 64.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -176.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 39.8 m -114.21 116.08 28.48 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -96.02 100.79 12.42 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 72.5 m -93.34 105.66 17.71 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.461 0.648 . . . . 0.0 109.864 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -107.58 135.13 47.2 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.019 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -91.19 127.37 36.59 Favored 'General case' 0 C--N 1.298 -1.649 0 C-N-CA 119.938 -0.705 . . . . 0.0 110.054 178.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.5 mt . . . . . 0 C--N 1.293 -1.887 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 176.976 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo . . . . . 0 N--CA 1.446 -1.27 0 N-CA-C 112.764 0.255 . . . . 0.0 112.764 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.4 m -108.55 126.54 53.04 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.6 p -101.4 124.66 55.28 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.053 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 176.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -106.47 114.68 28.94 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 -178.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 88.5 m -99.86 98.62 9.39 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-O 121.462 0.649 . . . . 0.0 109.878 177.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.5 m -89.96 114.18 25.96 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.162 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.2 t -93.29 119.33 40.86 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.52 -176.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 . . . . . 0 C--N 1.295 -1.779 0 N-CA-C 107.389 -1.338 . . . . 0.0 107.389 176.099 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo . . . . . 0 N--CA 1.438 -1.772 0 N-CA-C 113.614 0.582 . . . . 0.0 113.614 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.7 t -117.04 129.13 74.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 119.923 -0.711 . . . . 0.0 112.206 -174.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.6 m -95.27 107.67 19.78 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 81.7 m95 -98.87 111.51 23.88 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 88.6 m -102.69 99.71 9.71 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 175.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -100.52 130.4 49.85 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.21 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -94.88 100.82 12.63 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.615 177.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.4 mt . . . . . 0 C--N 1.289 -2.053 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 178.492 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo . . . . . 0 N--CA 1.442 -1.539 0 N-CA-C 112.854 0.29 . . . . 0.0 112.854 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 p -111.93 156.1 22.63 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 122.28 -0.263 . . . . 0.0 111.301 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.7 p -125.58 138.25 55.03 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.547 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -119.48 117.95 29.79 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 175.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 99.9 m -102.36 96.29 6.85 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-O 121.391 0.615 . . . . 0.0 109.572 176.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.8 p -98.79 117.92 34.36 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.732 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.1 t -87.71 103.52 13.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 . . . . . 0 C--N 1.289 -2.031 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 -179.292 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 N--CA 1.443 -1.448 0 N-CA-C 112.733 0.244 . . . . 0.0 112.733 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.3 t -116.41 128.89 73.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 122.218 -0.301 . . . . 0.0 110.626 -175.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.4 m -104.34 119.71 39.57 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-O 121.048 0.451 . . . . 0.0 109.834 177.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -101.53 126.03 48.27 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 97.9 m -110.25 116.14 30.96 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 41.1 t -116.56 134.37 60.23 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -92.97 99.38 12.02 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 176.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.8 mt . . . . . 0 C--N 1.294 -1.829 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.671 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo . . . . . 0 N--CA 1.449 -1.116 0 CA-C-O 120.954 0.314 . . . . 0.0 111.776 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.7 m -98.21 119.97 37.81 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-O 121.247 0.546 . . . . 0.0 111.665 -172.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 49.7 t -86.78 110.76 20.66 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -114.98 134.11 55.46 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.755 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.3 m -116.12 125.28 52.14 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-O 121.208 0.527 . . . . 0.0 110.165 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.4 t -115.35 132.26 56.67 Favored 'General case' 0 N--CA 1.416 -2.159 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -96.58 119.26 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 CA-C-O 122.092 0.948 . . . . 0.0 110.825 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 20.0 mmm180 . . . . . 0 C--N 1.289 -2.052 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.19 179.252 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo . . . . . 0 N--CA 1.449 -1.113 0 N-CA-C 113.211 0.427 . . . . 0.0 113.211 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 32.4 t -113.37 130.85 66.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 CA-C-O 121.186 0.517 . . . . 0.0 111.083 -174.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 m -94.05 131.31 39.68 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . 0.416 ' CD1' ' HD3' ' A' ' 17' ' ' ARG . 95.4 m95 -118.32 103.58 9.93 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-O 121.196 0.522 . . . . 0.0 109.705 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 86.3 m -102.6 122.41 44.34 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.6 -179.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.5 m -114.13 130.08 68.97 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 173.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 50.0 ttp180 -90.44 96.57 10.72 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.994 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 43.5 mm . . . . . 0 C--N 1.299 -1.589 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 179.452 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo . . . . . 0 N--CA 1.44 -1.662 0 CA-C-O 121.163 0.401 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.0 m -103.19 123.31 46.47 Favored 'General case' 0 N--CA 1.424 -1.746 0 CA-C-O 121.203 0.525 . . . . 0.0 110.91 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.6 m -83.85 104.86 12.77 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.856 0 CA-C-O 121.907 0.86 . . . . 0.0 109.274 175.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -86.75 100.64 12.64 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.8 m -100.65 110.11 22.22 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.142 -176.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.7 t -102.16 150.89 22.82 Favored 'General case' 0 N--CA 1.414 -2.236 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 175.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.3 p -116.47 131.96 67.52 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.253 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.541 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.416 ' HD3' ' CD1' ' A' ' 4' ' ' TRP . 73.8 mtp180 . . . . . 0 N--CA 1.428 -1.559 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 176.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo . . . . . 0 N--CA 1.443 -1.448 0 CA-C-O 121.002 0.334 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.9 t -116.61 118.91 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.398 0 CA-C-O 121.502 0.668 . . . . 0.0 110.796 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 59.0 m -108.64 131.64 54.69 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 177.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 87.0 m95 -116.26 108.6 16.31 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 70.9 m -97.56 99.9 11.3 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.9 m -99.01 140.5 18.39 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.206 -178.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -104.58 101.97 11.6 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.392 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.5 mt . . . . . 0 C--N 1.302 -1.461 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -178.98 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 N--CA 1.454 -0.829 0 CA-C-O 120.8 0.25 . . . . 0.0 112.408 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 p -127.53 116.48 20.45 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -176.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 18.7 m -95.07 150.31 4.18 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 174.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.409 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 47.5 ttp180 -137.61 118.98 14.7 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 -179.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 96.7 m -100.92 101.0 11.71 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.586 176.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.8 t -93.14 119.84 32.78 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-O 121.382 0.61 . . . . 0.0 109.425 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 51.7 t -96.26 105.44 17.07 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.9 mtm180 . . . . . 0 C--N 1.295 -1.789 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.199 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo . . . . . 0 CA--C 1.544 1.016 0 CA-C-O 120.839 0.266 . . . . 0.0 112.62 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.8 t -92.73 142.71 12.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-O 120.838 0.351 . . . . 0.0 110.186 -173.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.7 m -127.38 126.55 42.67 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -112.04 118.92 36.74 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 94.0 m -101.41 99.29 9.61 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 121.998 0.904 . . . . 0.0 110.449 177.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 45.7 t -101.08 113.72 38.04 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.136 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.6 ptt-85 -86.07 110.31 19.43 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.855 0.836 . . . . 0.0 109.533 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 78.5 mt . . . . . 0 C--N 1.287 -2.125 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 178.486 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo . . . . . 0 CA--C 1.54 0.785 0 CA-C-O 120.828 0.262 . . . . 0.0 112.64 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.7 m -101.67 110.03 21.93 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 121.359 0.6 . . . . 0.0 111.855 -174.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 51.6 t -85.26 99.29 7.14 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.218 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 173.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.7 tpm_? -89.15 95.41 10.3 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -176.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 94.5 m -91.56 92.97 8.73 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.176 0.513 . . . . 0.0 109.703 176.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.9 t -91.32 138.96 31.18 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.571 -178.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.1 p -106.76 132.15 54.8 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.749 0 CA-C-O 121.232 0.539 . . . . 0.0 109.938 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 . . . . . 0 C--N 1.296 -1.737 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 177.965 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo . . . . . 0 N--CA 1.446 -1.306 0 N-CA-C 112.808 0.272 . . . . 0.0 112.808 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.1 t -108.35 132.2 56.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -177.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 27.2 m -106.93 128.49 54.37 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -113.59 101.38 9.28 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 72.2 m -92.16 99.65 12.41 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.405 0.621 . . . . 0.0 110.472 178.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.9 m -109.96 165.98 5.34 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.009 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -127.22 137.57 52.93 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.489 178.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.0 mt -112.01 105.15 18.23 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.948 0 N-CA-C 105.094 -2.188 . . . . 0.0 105.094 175.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -88.42 -1.17 6.8 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.553 2.169 . . . . 0.0 112.59 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.3 m -105.35 124.82 50.18 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-O 121.261 0.553 . . . . 0.0 111.047 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.7 t -101.32 137.17 29.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 -133.94 139.7 46.29 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.003 0.43 . . . . 0.0 110.353 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 72.6 m -110.01 105.36 14.46 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 177.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 18.9 m -91.06 126.21 36.08 Favored 'General case' 0 N--CA 1.422 -1.827 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 25.6 t -98.56 127.23 51.32 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.029 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.4 mmm180 -116.47 95.57 5.12 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo . . . . . 0 N--CA 1.444 -1.43 0 CA-C-O 120.482 0.117 . . . . 0.0 112.21 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.1 t -111.6 128.86 67.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 O-C-N 121.669 -0.645 . . . . 0.0 111.376 -176.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.5 m -92.19 116.07 28.63 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . 0.548 ' CD1' ' HD3' ' A' ' 17' ' ' ARG . 92.8 m95 -102.62 113.04 26.08 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.397 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 72.7 m -106.65 111.11 23.5 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.2 t -116.65 126.8 74.28 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.0 ptt180 -85.49 102.72 13.73 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-O 121.905 0.859 . . . . 0.0 109.863 178.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.8 mt -98.97 103.01 14.15 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.783 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -89.98 0.69 5.55 Favored 'Trans proline' 0 N--CA 1.449 -1.134 0 C-N-CA 122.367 2.045 . . . . 0.0 112.087 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.0 p -108.16 109.94 21.46 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-O 121.311 0.577 . . . . 0.0 111.675 -176.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.5 t -85.38 119.16 33.49 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 175.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 71.1 ttt180 -107.19 111.93 24.57 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.07 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 87.2 m -103.95 91.71 4.09 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.565 0.698 . . . . 0.0 109.838 176.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.3 m -111.76 128.21 56.03 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.217 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 27.4 m -81.79 140.92 15.8 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 CA-C-O 121.586 0.707 . . . . 0.0 111.861 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.548 ' HD3' ' CD1' ' A' ' 4' ' ' TRP . 70.1 mtp180 -126.08 102.68 7.34 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 175.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo . . . . . 0 N--CA 1.444 -1.388 0 N-CA-C 113.353 0.482 . . . . 0.0 113.353 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.83 119.5 62.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 O-C-N 121.544 -0.722 . . . . 0.0 111.069 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 34.6 m -93.58 112.52 24.42 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 176.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -93.51 111.02 22.59 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 65.7 m -105.75 106.24 16.65 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-O 121.22 0.533 . . . . 0.0 109.789 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.1 p -98.9 142.43 14.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -117.53 128.76 55.28 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 121.22 0.533 . . . . 0.0 112.367 -174.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.6 mt -122.37 99.16 6.51 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 176.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -83.73 -5.12 10.73 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 122.421 2.081 . . . . 0.0 112.473 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.9 m -101.25 115.97 31.72 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 121.426 0.632 . . . . 0.0 110.941 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.2 t -105.39 129.45 58.24 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.522 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 93.6 mtt180 -112.49 115.07 28.07 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -98.91 103.77 15.76 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-O 121.432 0.634 . . . . 0.0 110.187 176.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.5 m -106.77 119.98 40.79 Favored 'General case' 0 C--N 1.298 -1.652 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.409 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 10.8 p -92.71 134.02 32.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 CA-C-O 121.475 0.655 . . . . 0.0 111.56 -176.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -120.17 96.1 5.02 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 174.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 CA--C 1.548 1.184 0 N-CA-C 113.079 0.376 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 25.7 t -108.33 136.9 42.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 O-C-N 121.95 -0.469 . . . . 0.0 110.303 -177.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.5 m -114.48 121.69 44.3 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -110.35 100.85 9.64 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 77.3 m -90.89 105.03 17.54 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.332 0.587 . . . . 0.0 109.545 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.1 m -103.06 153.69 5.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -118.19 121.17 39.81 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 121.789 0.804 . . . . 0.0 111.528 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 60.6 mt -105.51 102.06 13.3 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 178.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -94.96 3.97 2.5 Favored 'Trans proline' 0 N--CA 1.449 -1.123 0 C-N-CA 122.381 2.054 . . . . 0.0 112.44 177.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.0 m -104.76 121.05 42.8 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 121.088 0.47 . . . . 0.0 110.415 -177.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.3 p -94.59 136.2 26.54 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.774 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -129.52 127.89 41.7 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 76.9 m -104.89 102.36 11.89 Favored 'General case' 0 C--N 1.294 -1.827 0 CA-C-O 121.762 0.792 . . . . 0.0 111.346 -176.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.1 p -89.58 112.42 23.62 Favored 'General case' 0 N--CA 1.424 -1.744 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.945 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.7 t -91.02 128.6 42.72 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.198 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 -120.74 98.97 6.27 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo . . . . . 0 CA--C 1.539 0.774 0 N-CA-C 113.088 0.38 . . . . 0.0 113.088 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.7 t -111.61 147.43 15.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -177.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 28.8 m -128.0 134.49 49.26 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -118.33 112.63 20.29 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.9 m -105.69 118.94 37.86 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 120.917 0.389 . . . . 0.0 110.656 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.1 m -127.68 138.03 55.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.487 ' HA ' ' HA ' ' A' ' 12' ' ' VAL . 44.7 ttp85 -97.07 113.07 24.59 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-O 121.166 0.508 . . . . 0.0 110.799 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 46.5 mm -101.91 107.5 21.77 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.757 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -90.55 11.09 2.76 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.339 2.026 . . . . 0.0 112.678 179.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 p -126.21 121.45 32.78 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -177.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.487 ' HA ' ' HA ' ' A' ' 7' ' ' ARG . 7.1 p -95.57 128.36 46.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.097 0.475 . . . . 0.0 110.232 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.1 mtm180 -112.86 127.94 56.32 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 90.9 m -106.35 107.53 18.59 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.0 m -88.86 114.72 25.79 Favored 'General case' 0 N--CA 1.412 -2.368 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 -178.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.9 p -90.72 115.95 31.01 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.816 0 CA-C-O 121.461 0.648 . . . . 0.0 109.974 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -118.27 93.12 4.01 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo . . . . . 0 N--CA 1.439 -1.727 0 N-CA-C 112.295 0.075 . . . . 0.0 112.295 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.9 t -116.74 126.5 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.637 -174.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 49.1 m -99.05 108.64 21.35 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 175.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 78.5 m95 -89.94 106.57 18.56 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 74.6 m -105.08 111.86 24.79 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 121.56 0.695 . . . . 0.0 112.119 -178.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -105.3 140.45 23.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 175.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -116.54 126.99 54.12 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.608 -0.837 . . . . 0.0 111.506 -177.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.3 mp -107.55 91.28 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 177.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -84.43 -1.06 9.62 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.606 2.204 . . . . 0.0 113.015 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.2 m -101.45 126.64 48.26 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 120.867 0.365 . . . . 0.0 110.079 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 35.2 m -107.48 140.12 26.89 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 CA-C-O 120.971 0.415 . . . . 0.0 109.884 178.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -122.79 105.46 10.06 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 176.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 88.3 m -104.68 110.06 22.23 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.595 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.3 m -102.38 114.79 29.28 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.75 112.49 26.78 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.862 0 CA-C-O 122.272 1.034 . . . . 0.0 111.096 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -120.23 115.8 24.33 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.26 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo . . . . . 0 N--CA 1.443 -1.483 0 CA-C-O 120.62 0.175 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.3 t -113.24 129.98 68.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 121.666 -0.646 . . . . 0.0 111.103 -176.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 58.0 m -100.18 114.82 28.52 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.686 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -104.09 117.08 33.4 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 80.7 m -103.53 111.18 23.52 Favored 'General case' 0 C--N 1.298 -1.65 0 C-N-CA 119.603 -0.839 . . . . 0.0 111.43 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p -104.03 135.08 43.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.193 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -90.09 121.14 31.88 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-O 121.218 0.533 . . . . 0.0 110.491 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.6 mt -117.62 94.66 3.21 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -84.85 -8.25 9.23 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.197 1.932 . . . . 0.0 112.648 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.7 p -114.53 130.82 56.79 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -174.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.0 t -103.71 121.8 55.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -105.13 122.65 46.33 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.187 -176.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 87.5 m -94.85 104.28 16.18 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.727 0.775 . . . . 0.0 110.491 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.1 p -89.84 109.58 20.57 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.646 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.7 t -86.33 115.84 28.13 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -110.31 102.24 10.91 Favored 'General case' 0 C--N 1.29 -1.999 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 CA--C 1.545 1.045 0 CA-C-O 121.342 0.476 . . . . 0.0 112.192 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.7 t -94.97 130.16 44.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 53.1 m -130.13 105.33 7.87 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-O 121.25 0.548 . . . . 0.0 110.936 -178.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -91.64 102.74 15.38 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.152 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 75.1 m -94.35 100.86 12.81 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-O 121.339 0.59 . . . . 0.0 109.412 177.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.0 p -106.42 131.28 56.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.807 -177.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -78.39 109.97 13.02 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.519 0.676 . . . . 0.0 110.657 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.3 tt -105.52 107.47 22.71 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.906 0 CA-C-N 114.433 -1.258 . . . . 0.0 107.731 177.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -91.43 6.4 3.64 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.604 2.203 . . . . 0.0 112.116 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.4 p -119.15 164.48 15.51 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 122.17 -0.331 . . . . 0.0 111.332 -176.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.7 t -119.19 124.19 72.65 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -105.74 109.98 22.12 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 73.6 m -92.08 107.86 19.52 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 121.69 0.757 . . . . 0.0 110.294 177.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.4 m -90.91 111.87 23.49 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 114.746 -1.116 . . . . 0.0 108.167 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.5 t -97.38 110.88 26.06 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 CA-C-O 121.241 0.543 . . . . 0.0 110.192 -176.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 32.8 mmt180 -110.98 92.73 4.16 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo . . . . . 0 N--CA 1.444 -1.405 0 CA-C-O 120.666 0.194 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.5 t -108.01 122.31 62.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -175.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 17.1 m -102.47 110.75 22.79 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 77.9 m95 -91.37 121.43 33.08 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 71.5 m -110.73 100.46 9.22 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 121.366 0.603 . . . . 0.0 110.871 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.6 p -99.63 126.59 52.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.549 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.451 ' HA ' ' HA ' ' A' ' 12' ' ' VAL . 40.0 ttm180 -91.04 114.75 27.36 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 120.884 0.373 . . . . 0.0 111.322 -176.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 63.9 mt -109.35 98.62 7.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 174.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -85.0 -6.75 9.45 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.666 2.244 . . . . 0.0 112.543 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.3 p -114.19 116.54 29.23 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -176.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.451 ' HA ' ' HA ' ' A' ' 7' ' ' ARG . 7.5 p -92.79 130.67 41.54 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.948 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 174.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -105.28 111.1 23.71 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 92.0 m -96.58 99.43 11.06 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.539 0.685 . . . . 0.0 110.153 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.4 m -96.13 116.77 29.49 Favored 'General case' 0 N--CA 1.416 -2.141 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.5 p -85.27 114.55 25.5 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 CA-C-O 121.864 0.84 . . . . 0.0 110.264 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -110.11 99.28 8.39 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo . . . . . 0 CA--C 1.542 0.894 0 CA-C-O 121.01 0.338 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 50.6 t -109.86 141.1 26.1 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -178.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 40.4 m -130.19 128.7 42.24 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.747 -0.595 . . . . 0.0 110.71 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -115.73 142.94 46.08 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.3 m -121.37 126.18 48.78 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 121.15 0.5 . . . . 0.0 110.441 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 55.0 t -99.26 124.84 52.8 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -100.68 118.74 37.41 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.51 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 39.7 mt -128.65 89.42 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.402 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -87.34 -6.13 7.24 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.33 2.02 . . . . 0.0 111.546 176.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.4 m -91.64 129.52 37.6 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.429 -178.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.78 123.92 55.49 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-O 121.467 0.651 . . . . 0.0 109.573 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -115.25 114.14 24.82 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.828 -0.623 . . . . 0.0 109.807 -177.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 85.7 m -100.65 113.55 26.5 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 121.622 0.725 . . . . 0.0 109.965 177.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.4 m -101.33 128.36 47.53 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.744 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 31.3 m -89.5 133.79 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.532 0 CA-C-O 121.489 0.661 . . . . 0.0 110.736 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -125.46 81.55 1.98 Allowed 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 175.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo . . . . . 0 N--CA 1.447 -1.229 0 N-CA-C 113.686 0.61 . . . . 0.0 113.686 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 37.9 t -115.78 127.94 73.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 C-N-CA 119.707 -0.797 . . . . 0.0 111.805 -175.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.2 m -93.1 110.3 21.79 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -96.89 99.49 11.05 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 78.1 m -91.34 109.86 21.14 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.4 m -101.92 138.89 24.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.581 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -109.74 134.25 52.21 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.943 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 55.7 mt -138.73 96.9 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 176.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -87.01 -4.14 7.95 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.223 1.949 . . . . 0.0 111.748 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 m -94.36 133.65 37.7 Favored 'General case' 0 N--CA 1.423 -1.794 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.336 -176.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -129.22 122.42 56.05 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -119.99 113.89 21.2 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.072 -177.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 81.7 m -92.73 101.7 14.1 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 121.929 0.871 . . . . 0.0 110.296 177.007 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.9 m -100.28 110.25 22.49 Favored 'General case' 0 N--CA 1.414 -2.266 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.172 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -89.45 121.26 39.4 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 CA-C-O 121.847 0.832 . . . . 0.0 110.994 -176.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -115.03 102.52 10.03 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo . . . . . 0 N--CA 1.448 -1.164 0 N-CA-C 112.918 0.315 . . . . 0.0 112.918 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.6 t -105.55 122.9 59.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.977 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.5 m -85.04 117.74 24.18 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -105.88 100.37 9.93 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 120.888 0.375 . . . . 0.0 110.995 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 71.2 m -90.0 99.96 12.87 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-O 121.573 0.702 . . . . 0.0 109.412 177.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 30.8 m -99.76 147.11 7.71 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.405 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -102.5 122.15 43.77 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.07 -176.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.7 mp -120.02 98.35 6.13 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 176.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -87.27 -2.8 7.82 Favored 'Trans proline' 0 CA--C 1.546 1.09 0 C-N-CA 122.379 2.053 . . . . 0.0 113.46 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.4 m -116.2 126.45 53.65 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.257 0.551 . . . . 0.0 111.951 -174.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.8 t -91.45 130.42 40.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -116.11 111.33 20.11 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 85.0 m -94.01 97.36 10.28 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.762 0.792 . . . . 0.0 110.761 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 34.7 m -89.81 134.08 34.38 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 114.577 -1.192 . . . . 0.0 108.337 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 m -98.15 118.92 45.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 C-N-CA 120.071 -0.652 . . . . 0.0 111.289 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -113.85 102.06 9.86 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo . . . . . 0 N--CA 1.442 -1.547 0 N-CA-C 113.082 0.378 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.3 t -119.46 140.01 44.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 O-C-N 121.876 -0.515 . . . . 0.0 111.11 -175.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.3 m -104.03 103.66 13.51 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 176.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -90.74 116.17 28.39 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.932 -177.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 73.8 m -98.23 101.19 12.57 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.2 m -99.18 131.54 46.27 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.336 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -104.17 98.73 8.5 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-O 122.077 0.941 . . . . 0.0 110.264 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.3 mt -106.0 106.02 19.8 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.877 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -91.49 14.97 1.78 Allowed 'Trans proline' 0 N--CA 1.438 -1.786 0 C-N-CA 122.454 2.102 . . . . 0.0 111.98 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.7 m -113.7 120.78 42.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 121.267 0.556 . . . . 0.0 110.441 -179.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.4 t -107.28 109.3 27.68 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.823 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -104.95 115.34 30.11 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.362 -178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.8 m -96.82 90.09 5.13 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-O 121.589 0.709 . . . . 0.0 109.166 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.3 m -95.42 127.08 41.17 Favored 'General case' 0 N--CA 1.424 -1.738 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.604 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.4 p -83.02 114.56 24.04 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.617 0 CA-C-O 121.882 0.849 . . . . 0.0 109.399 177.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 -116.91 116.77 28.06 Favored 'General case' 0 C--N 1.288 -2.099 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 N--CA 1.448 -1.175 0 N-CA-C 113.009 0.35 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.73 124.92 68.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 O-C-N 121.819 -0.55 . . . . 0.0 111.348 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.1 m -100.66 113.09 25.66 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -99.3 106.38 18.49 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 76.1 m -94.45 105.5 17.47 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.6 m -99.17 157.75 3.69 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.685 -179.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.6 ptp85 -114.85 134.92 54.74 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 121.728 0.775 . . . . 0.0 111.836 -176.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.5 mp -118.65 88.75 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.965 0 N-CA-C 104.441 -2.429 . . . . 0.0 104.441 171.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -81.86 -6.67 12.37 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 122.757 2.304 . . . . 0.0 113.291 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.3 m -106.12 133.59 50.59 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.2 m -110.34 143.53 20.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.4 ttt180 -121.49 112.36 18.42 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 71.9 m -89.12 104.98 17.48 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-O 121.732 0.777 . . . . 0.0 110.124 177.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.9 m -99.39 111.47 23.83 Favored 'General case' 0 N--CA 1.418 -2.058 0 CA-C-N 114.527 -1.215 . . . . 0.0 108.509 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.7 p -91.51 122.5 42.98 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.284 0 CA-C-O 121.564 0.697 . . . . 0.0 109.956 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -117.4 100.34 7.6 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo . . . . . 0 CA--C 1.541 0.84 0 CA-C-O 121.041 0.351 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.0 t -107.82 126.72 64.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -176.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 39.8 m -114.21 116.08 28.48 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -96.02 100.79 12.42 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 72.5 m -93.34 105.66 17.71 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.461 0.648 . . . . 0.0 109.864 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -107.58 135.13 47.2 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.019 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -91.19 127.37 36.59 Favored 'General case' 0 C--N 1.298 -1.649 0 C-N-CA 119.938 -0.705 . . . . 0.0 110.054 178.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.5 mt -119.83 89.65 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.887 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 176.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -87.83 1.06 6.94 Favored 'Trans proline' 0 N--CA 1.446 -1.27 0 C-N-CA 122.347 2.031 . . . . 0.0 112.764 178.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.4 m -108.55 126.54 53.04 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.6 p -101.4 124.66 55.28 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.053 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 176.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -106.47 114.68 28.94 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 -178.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 88.5 m -99.86 98.62 9.39 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-O 121.462 0.649 . . . . 0.0 109.878 177.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.5 m -89.96 114.18 25.96 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.162 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.2 t -93.29 119.33 40.86 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.52 -176.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -118.09 96.77 5.48 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 107.389 -1.338 . . . . 0.0 107.389 176.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo . . . . . 0 N--CA 1.438 -1.772 0 N-CA-C 113.614 0.582 . . . . 0.0 113.614 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.7 t -117.04 129.13 74.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 119.923 -0.711 . . . . 0.0 112.206 -174.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.6 m -95.27 107.67 19.78 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 81.7 m95 -98.87 111.51 23.88 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 88.6 m -102.69 99.71 9.71 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 175.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -100.52 130.4 49.85 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.21 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -94.88 100.82 12.63 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.615 177.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.4 mt -94.42 109.27 21.89 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.053 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 178.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -97.36 9.75 1.21 Allowed 'Trans proline' 0 N--CA 1.442 -1.539 0 C-N-CA 122.739 2.293 . . . . 0.0 112.854 176.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 p -111.93 156.1 22.63 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 122.28 -0.263 . . . . 0.0 111.301 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.7 p -125.58 138.25 55.03 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.547 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -119.48 117.95 29.79 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 175.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 99.9 m -102.36 96.29 6.85 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-O 121.391 0.615 . . . . 0.0 109.572 176.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.8 p -98.79 117.92 34.36 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.732 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.1 t -87.71 103.52 13.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -100.22 104.12 15.61 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 N--CA 1.443 -1.448 0 N-CA-C 112.733 0.244 . . . . 0.0 112.733 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.3 t -116.41 128.89 73.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 122.218 -0.301 . . . . 0.0 110.626 -175.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.4 m -104.34 119.71 39.57 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-O 121.048 0.451 . . . . 0.0 109.834 177.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -101.53 126.03 48.27 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 97.9 m -110.25 116.14 30.96 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 41.1 t -116.56 134.37 60.23 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -92.97 99.38 12.02 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 176.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.8 mt -92.09 111.47 24.25 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.829 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -98.2 1.11 1.32 Allowed 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 122.439 2.093 . . . . 0.0 111.776 174.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.7 m -98.21 119.97 37.81 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-O 121.247 0.546 . . . . 0.0 111.665 -172.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 49.7 t -86.78 110.76 20.66 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -114.98 134.11 55.46 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.755 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.3 m -116.12 125.28 52.14 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-O 121.208 0.527 . . . . 0.0 110.165 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.4 t -115.35 132.26 56.67 Favored 'General case' 0 N--CA 1.416 -2.159 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -96.58 119.26 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 CA-C-O 122.092 0.948 . . . . 0.0 110.825 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 20.0 mmm180 -115.38 100.34 8.03 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.19 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo . . . . . 0 N--CA 1.449 -1.113 0 N-CA-C 113.211 0.427 . . . . 0.0 113.211 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 32.4 t -113.37 130.85 66.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 CA-C-O 121.186 0.517 . . . . 0.0 111.083 -174.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 m -94.05 131.31 39.68 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . 0.416 ' CD1' ' HD3' ' A' ' 17' ' ' ARG . 95.4 m95 -118.32 103.58 9.93 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-O 121.196 0.522 . . . . 0.0 109.705 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 86.3 m -102.6 122.41 44.34 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.6 -179.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.5 m -114.13 130.08 68.97 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 173.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 50.0 ttp180 -90.44 96.57 10.72 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.994 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 43.5 mm -90.32 113.31 26.15 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -100.5 5.65 0.72 Allowed 'Trans proline' 0 N--CA 1.44 -1.662 0 C-N-CA 122.705 2.27 . . . . 0.0 111.298 175.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.0 m -103.19 123.31 46.47 Favored 'General case' 0 N--CA 1.424 -1.746 0 CA-C-O 121.203 0.525 . . . . 0.0 110.91 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.6 m -83.85 104.86 12.77 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.856 0 CA-C-O 121.907 0.86 . . . . 0.0 109.274 175.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -86.75 100.64 12.64 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.8 m -100.65 110.11 22.22 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.142 -176.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.7 t -102.16 150.89 22.82 Favored 'General case' 0 N--CA 1.414 -2.236 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 175.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.3 p -116.47 131.96 67.52 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.253 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.541 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.416 ' HD3' ' CD1' ' A' ' 4' ' ' TRP . 73.8 mtp180 -119.04 102.92 9.1 Favored 'General case' 0 N--CA 1.428 -1.559 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 176.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo . . . . . 0 N--CA 1.443 -1.448 0 CA-C-O 121.002 0.334 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.9 t -116.61 118.91 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.398 0 CA-C-O 121.502 0.668 . . . . 0.0 110.796 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 59.0 m -108.64 131.64 54.69 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 177.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 87.0 m95 -116.26 108.6 16.31 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 70.9 m -97.56 99.9 11.3 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.9 m -99.01 140.5 18.39 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.206 -178.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -104.58 101.97 11.6 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.392 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.5 mt -108.12 101.29 12.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -94.44 7.73 2.27 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.853 2.368 . . . . 0.0 112.408 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 p -127.53 116.48 20.45 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -176.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 18.7 m -95.07 150.31 4.18 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 174.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.409 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 47.5 ttp180 -137.61 118.98 14.7 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 -179.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 96.7 m -100.92 101.0 11.71 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.586 176.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.8 t -93.14 119.84 32.78 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-O 121.382 0.61 . . . . 0.0 109.425 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 51.7 t -96.26 105.44 17.07 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.9 mtm180 -118.73 104.04 10.22 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo . . . . . 0 CA--C 1.544 1.016 0 CA-C-O 120.839 0.266 . . . . 0.0 112.62 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.8 t -92.73 142.71 12.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-O 120.838 0.351 . . . . 0.0 110.186 -173.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.7 m -127.38 126.55 42.67 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -112.04 118.92 36.74 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 94.0 m -101.41 99.29 9.61 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 121.998 0.904 . . . . 0.0 110.449 177.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 45.7 t -101.08 113.72 38.04 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.136 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.6 ptt-85 -86.07 110.31 19.43 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.855 0.836 . . . . 0.0 109.533 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 78.5 mt -107.86 100.69 11.25 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.125 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -88.75 -4.43 6.3 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.733 2.288 . . . . 0.0 112.64 177.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.7 m -101.67 110.03 21.93 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 121.359 0.6 . . . . 0.0 111.855 -174.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 51.6 t -85.26 99.29 7.14 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.218 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 173.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.7 tpm_? -89.15 95.41 10.3 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -176.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 94.5 m -91.56 92.97 8.73 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.176 0.513 . . . . 0.0 109.703 176.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.9 t -91.32 138.96 31.18 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.571 -178.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.1 p -106.76 132.15 54.8 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.749 0 CA-C-O 121.232 0.539 . . . . 0.0 109.938 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -128.14 100.42 5.85 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo . . . . . 0 N--CA 1.446 -1.306 0 N-CA-C 112.808 0.272 . . . . 0.0 112.808 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.1 t -108.35 132.2 56.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -177.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 27.2 m -106.93 128.49 54.37 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -113.59 101.38 9.28 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 72.2 m -92.16 99.65 12.41 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.405 0.621 . . . . 0.0 110.472 178.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.9 m -109.96 165.98 5.34 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.009 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -127.22 137.57 52.93 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.489 178.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.0 mt . . . . . 0 C--N 1.291 -1.948 0 N-CA-C 105.094 -2.188 . . . . 0.0 105.094 175.882 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo . . . . . 0 CA--C 1.539 0.734 0 CA-C-O 120.896 0.29 . . . . 0.0 112.59 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.3 m -105.35 124.82 50.18 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-O 121.261 0.553 . . . . 0.0 111.047 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.7 t -101.32 137.17 29.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 -133.94 139.7 46.29 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.003 0.43 . . . . 0.0 110.353 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 72.6 m -110.01 105.36 14.46 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 177.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 18.9 m -91.06 126.21 36.08 Favored 'General case' 0 N--CA 1.422 -1.827 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 25.6 t -98.56 127.23 51.32 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.029 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.4 mmm180 . . . . . 0 C--N 1.297 -1.716 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 178.586 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo . . . . . 0 N--CA 1.444 -1.43 0 CA-C-O 120.482 0.117 . . . . 0.0 112.21 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.1 t -111.6 128.86 67.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 O-C-N 121.669 -0.645 . . . . 0.0 111.376 -176.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.5 m -92.19 116.07 28.63 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' TRP . . . . . 0.55 ' CD1' ' HD3' ' A' ' 17' ' ' ARG . 92.8 m95 -102.62 113.04 26.08 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.397 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 72.7 m -106.65 111.11 23.5 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.24 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.2 t -116.65 126.8 74.28 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.0 ptt180 -85.49 102.72 13.73 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-O 121.905 0.859 . . . . 0.0 109.863 178.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.8 mt . . . . . 0 C--N 1.295 -1.783 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 179.474 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 N--CA 1.449 -1.134 0 CA-C-O 120.957 0.315 . . . . 0.0 112.087 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.0 p -108.16 109.94 21.46 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-O 121.311 0.577 . . . . 0.0 111.675 -176.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.5 t -85.38 119.16 33.49 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 175.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.411 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 71.1 ttt180 -107.19 111.93 24.57 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.07 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 87.2 m -103.95 91.71 4.09 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.565 0.698 . . . . 0.0 109.838 176.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.3 m -111.76 128.21 56.03 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.217 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 27.4 m -81.79 140.92 15.8 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 CA-C-O 121.586 0.707 . . . . 0.0 111.861 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.55 ' HD3' ' CD1' ' A' ' 4' ' ' TRP . 70.1 mtp180 . . . . . 0 C--N 1.292 -1.902 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 175.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo . . . . . 0 N--CA 1.444 -1.388 0 N-CA-C 113.353 0.482 . . . . 0.0 113.353 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.83 119.5 62.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 O-C-N 121.544 -0.722 . . . . 0.0 111.069 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 34.6 m -93.58 112.52 24.42 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 176.477 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -93.51 111.02 22.59 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.525 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 65.7 m -105.75 106.24 16.65 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-O 121.22 0.533 . . . . 0.0 109.789 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.1 p -98.9 142.43 14.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -117.53 128.76 55.28 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 121.22 0.533 . . . . 0.0 112.367 -174.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.6 mt . . . . . 0 C--N 1.297 -1.683 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 176.254 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo . . . . . 0 CA--C 1.536 0.611 0 N-CA-C 112.473 0.143 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.9 m -101.25 115.97 31.72 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 121.426 0.632 . . . . 0.0 110.941 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.2 t -105.39 129.45 58.24 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 93.6 mtt180 -112.49 115.07 28.07 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -98.91 103.77 15.76 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-O 121.432 0.634 . . . . 0.0 110.187 176.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.5 m -106.77 119.98 40.79 Favored 'General case' 0 C--N 1.298 -1.652 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.442 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 10.8 p -92.71 134.02 32.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 CA-C-O 121.475 0.655 . . . . 0.0 111.56 -176.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 . . . . . 0 C--N 1.3 -1.548 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 174.844 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 CA--C 1.548 1.184 0 N-CA-C 113.079 0.376 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 25.7 t -108.33 136.9 42.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 O-C-N 121.95 -0.469 . . . . 0.0 110.303 -177.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.5 m -114.48 121.69 44.3 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -110.35 100.85 9.64 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 77.3 m -90.89 105.03 17.54 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.332 0.587 . . . . 0.0 109.545 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.1 m -103.06 153.69 5.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -118.19 121.17 39.81 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 121.789 0.804 . . . . 0.0 111.528 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 60.6 mt . . . . . 0 C--N 1.301 -1.543 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 178.352 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo . . . . . 0 N--CA 1.449 -1.123 0 N-CA-C 112.44 0.131 . . . . 0.0 112.44 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.0 m -104.76 121.05 42.8 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 121.088 0.47 . . . . 0.0 110.415 -177.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.3 p -94.59 136.2 26.54 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.774 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -129.52 127.89 41.7 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 76.9 m -104.89 102.36 11.89 Favored 'General case' 0 C--N 1.294 -1.827 0 CA-C-O 121.762 0.792 . . . . 0.0 111.346 -176.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.1 p -89.58 112.42 23.62 Favored 'General case' 0 N--CA 1.424 -1.744 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.945 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.7 t -91.02 128.6 42.72 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.198 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 . . . . . 0 C--N 1.296 -1.725 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.689 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo . . . . . 0 CA--C 1.539 0.774 0 N-CA-C 113.088 0.38 . . . . 0.0 113.088 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.7 t -111.61 147.43 15.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -177.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 28.8 m -128.0 134.49 49.26 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -118.33 112.63 20.29 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.9 m -105.69 118.94 37.86 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 120.917 0.389 . . . . 0.0 110.656 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.1 m -127.68 138.03 55.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.544 ' HA ' ' HA ' ' A' ' 12' ' ' VAL . 44.7 ttp85 -97.07 113.07 24.59 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-O 121.166 0.508 . . . . 0.0 110.799 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 46.5 mm . . . . . 0 C--N 1.296 -1.757 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 179.365 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo . . . . . 0 CA--C 1.543 0.94 0 N-CA-C 112.678 0.222 . . . . 0.0 112.678 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 p -126.21 121.45 32.78 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -177.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.544 ' HA ' ' HA ' ' A' ' 7' ' ' ARG . 7.1 p -95.57 128.36 46.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.097 0.475 . . . . 0.0 110.232 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.1 mtm180 -112.86 127.94 56.32 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 90.9 m -106.35 107.53 18.59 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.0 m -88.86 114.72 25.79 Favored 'General case' 0 N--CA 1.412 -2.368 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 -178.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.9 p -90.72 115.95 31.01 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.816 0 CA-C-O 121.461 0.648 . . . . 0.0 109.974 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 . . . . . 0 C--N 1.3 -1.58 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 179.907 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo . . . . . 0 N--CA 1.439 -1.727 0 N-CA-C 112.295 0.075 . . . . 0.0 112.295 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.9 t -116.74 126.5 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.637 -174.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 49.1 m -99.05 108.64 21.35 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 175.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 78.5 m95 -89.94 106.57 18.56 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 74.6 m -105.08 111.86 24.79 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 121.56 0.695 . . . . 0.0 112.119 -178.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -105.3 140.45 23.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 175.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -116.54 126.99 54.12 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.608 -0.837 . . . . 0.0 111.506 -177.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.3 mp . . . . . 0 C--N 1.293 -1.865 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 177.086 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo . . . . . 0 N--CA 1.457 -0.635 0 N-CA-C 113.015 0.352 . . . . 0.0 113.015 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.2 m -101.45 126.64 48.26 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 120.867 0.365 . . . . 0.0 110.079 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 35.2 m -107.48 140.12 26.89 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 CA-C-O 120.971 0.415 . . . . 0.0 109.884 178.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -122.79 105.46 10.06 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 176.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 88.3 m -104.68 110.06 22.23 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.595 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.3 m -102.38 114.79 29.28 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 7.4 p -93.75 112.49 26.78 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.862 0 CA-C-O 122.272 1.034 . . . . 0.0 111.096 -178.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 . . . . . 0 C--N 1.297 -1.711 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.26 -178.636 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo . . . . . 0 N--CA 1.443 -1.483 0 CA-C-O 120.62 0.175 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.3 t -113.24 129.98 68.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 121.666 -0.646 . . . . 0.0 111.103 -176.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 58.0 m -100.18 114.82 28.52 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.686 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -104.09 117.08 33.4 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 80.7 m -103.53 111.18 23.52 Favored 'General case' 0 C--N 1.298 -1.65 0 C-N-CA 119.603 -0.839 . . . . 0.0 111.43 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p -104.03 135.08 43.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.193 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -90.09 121.14 31.88 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-O 121.218 0.533 . . . . 0.0 110.491 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.6 mt . . . . . 0 C--N 1.297 -1.682 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.507 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo . . . . . 0 N--CA 1.453 -0.873 0 CA-C-O 120.774 0.239 . . . . 0.0 112.648 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.7 p -114.53 130.82 56.79 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -174.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.0 t -103.71 121.8 55.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -105.13 122.65 46.33 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.187 -176.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 87.5 m -94.85 104.28 16.18 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.727 0.775 . . . . 0.0 110.491 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.1 p -89.84 109.58 20.57 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.646 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.7 t -86.33 115.84 28.13 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 . . . . . 0 C--N 1.29 -1.999 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 179.367 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 CA--C 1.545 1.045 0 CA-C-O 121.342 0.476 . . . . 0.0 112.192 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.7 t -94.97 130.16 44.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 53.1 m -130.13 105.33 7.87 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-O 121.25 0.548 . . . . 0.0 110.936 -178.285 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -91.64 102.74 15.38 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.152 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 75.1 m -94.35 100.86 12.81 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-O 121.339 0.59 . . . . 0.0 109.412 177.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.0 p -106.42 131.28 56.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.807 -177.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -78.39 109.97 13.02 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.519 0.676 . . . . 0.0 110.657 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.3 tt . . . . . 0 C--N 1.292 -1.906 0 CA-C-N 114.433 -1.258 . . . . 0.0 107.731 177.75 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo . . . . . 0 N--CA 1.457 -0.638 0 CA-C-O 121.13 0.387 . . . . 0.0 112.116 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.4 p -119.15 164.48 15.51 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 122.17 -0.331 . . . . 0.0 111.332 -176.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.7 t -119.19 124.19 72.65 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -105.74 109.98 22.12 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 73.6 m -92.08 107.86 19.52 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 121.69 0.757 . . . . 0.0 110.294 177.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.4 m -90.91 111.87 23.49 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 114.746 -1.116 . . . . 0.0 108.167 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.5 t -97.38 110.88 26.06 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 CA-C-O 121.241 0.543 . . . . 0.0 110.192 -176.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 32.8 mmt180 . . . . . 0 C--N 1.303 -1.42 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 175.868 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo . . . . . 0 N--CA 1.444 -1.405 0 CA-C-O 120.666 0.194 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.5 t -108.01 122.31 62.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -175.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 17.1 m -102.47 110.75 22.79 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 77.9 m95 -91.37 121.43 33.08 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 71.5 m -110.73 100.46 9.22 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 121.366 0.603 . . . . 0.0 110.871 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.6 p -99.63 126.59 52.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.549 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.529 ' HA ' ' HA ' ' A' ' 12' ' ' VAL . 40.0 ttm180 -91.04 114.75 27.36 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 120.884 0.373 . . . . 0.0 111.322 -176.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 63.9 mt . . . . . 0 C--N 1.302 -1.489 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 174.716 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo . . . . . 0 N--CA 1.456 -0.683 0 CA-C-O 120.93 0.304 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.3 p -114.19 116.54 29.23 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -176.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.529 ' HA ' ' HA ' ' A' ' 7' ' ' ARG . 7.5 p -92.79 130.67 41.54 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.948 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 174.204 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -105.28 111.1 23.71 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 92.0 m -96.58 99.43 11.06 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.539 0.685 . . . . 0.0 110.153 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.4 m -96.13 116.77 29.49 Favored 'General case' 0 N--CA 1.416 -2.141 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.407 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 13.5 p -85.27 114.55 25.5 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 CA-C-O 121.864 0.84 . . . . 0.0 110.264 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 . . . . . 0 C--N 1.3 -1.564 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 178.738 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo . . . . . 0 CA--C 1.542 0.894 0 CA-C-O 121.01 0.338 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 50.6 t -109.86 141.1 26.1 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -178.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 40.4 m -130.19 128.7 42.24 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.747 -0.595 . . . . 0.0 110.71 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -115.73 142.94 46.08 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.3 m -121.37 126.18 48.78 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 121.15 0.5 . . . . 0.0 110.441 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 55.0 t -99.26 124.84 52.8 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -100.68 118.74 37.41 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.51 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 39.7 mt . . . . . 0 C--N 1.304 -1.402 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 178.547 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo . . . . . 0 CA--C 1.54 0.802 0 CA-C-O 121.339 0.474 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.4 m -91.64 129.52 37.6 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.429 -178.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.78 123.92 55.49 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-O 121.467 0.651 . . . . 0.0 109.573 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -115.25 114.14 24.82 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.828 -0.623 . . . . 0.0 109.807 -177.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 85.7 m -100.65 113.55 26.5 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 121.622 0.725 . . . . 0.0 109.965 177.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.4 m -101.33 128.36 47.53 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.744 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 31.3 m -89.5 133.79 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.532 0 CA-C-O 121.489 0.661 . . . . 0.0 110.736 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 . . . . . 0 C--N 1.286 -2.18 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 175.881 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo . . . . . 0 N--CA 1.447 -1.229 0 N-CA-C 113.686 0.61 . . . . 0.0 113.686 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 37.9 t -115.78 127.94 73.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 C-N-CA 119.707 -0.797 . . . . 0.0 111.805 -175.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 29.2 m -93.1 110.3 21.79 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.043 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -96.89 99.49 11.05 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 78.1 m -91.34 109.86 21.14 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.4 m -101.92 138.89 24.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.581 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -109.74 134.25 52.21 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.943 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 55.7 mt . . . . . 0 C--N 1.302 -1.498 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 176.869 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo . . . . . 0 N--CA 1.452 -0.955 0 CA-C-O 121.168 0.403 . . . . 0.0 111.748 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 m -94.36 133.65 37.7 Favored 'General case' 0 N--CA 1.423 -1.794 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.336 -176.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -129.22 122.42 56.05 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -119.99 113.89 21.2 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.072 -177.024 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 81.7 m -92.73 101.7 14.1 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 121.929 0.871 . . . . 0.0 110.296 177.007 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.9 m -100.28 110.25 22.49 Favored 'General case' 0 N--CA 1.414 -2.266 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.172 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 7.2 p -89.45 121.26 39.4 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 CA-C-O 121.847 0.832 . . . . 0.0 110.994 -176.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 . . . . . 0 C--N 1.296 -1.755 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.54 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo . . . . . 0 N--CA 1.448 -1.164 0 N-CA-C 112.918 0.315 . . . . 0.0 112.918 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.6 t -105.55 122.9 59.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.977 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.5 m -85.04 117.74 24.18 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -105.88 100.37 9.93 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 120.888 0.375 . . . . 0.0 110.995 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 71.2 m -90.0 99.96 12.87 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-O 121.573 0.702 . . . . 0.0 109.412 177.517 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 30.8 m -99.76 147.11 7.71 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.405 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -102.5 122.15 43.77 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.07 -176.068 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 C--N 1.309 -1.169 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 176.074 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo . . . . . 0 CA--C 1.546 1.09 0 N-CA-C 113.46 0.523 . . . . 0.0 113.46 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.4 m -116.2 126.45 53.65 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.257 0.551 . . . . 0.0 111.951 -174.34 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.8 t -91.45 130.42 40.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -116.11 111.33 20.11 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 85.0 m -94.01 97.36 10.28 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.762 0.792 . . . . 0.0 110.761 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 34.7 m -89.81 134.08 34.38 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 114.577 -1.192 . . . . 0.0 108.337 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 m -98.15 118.92 45.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 C-N-CA 120.071 -0.652 . . . . 0.0 111.289 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 . . . . . 0 C--N 1.299 -1.592 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.045 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo . . . . . 0 N--CA 1.442 -1.547 0 N-CA-C 113.082 0.378 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.3 t -119.46 140.01 44.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 O-C-N 121.876 -0.515 . . . . 0.0 111.11 -175.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.3 m -104.03 103.66 13.51 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 176.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -90.74 116.17 28.39 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.932 -177.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 73.8 m -98.23 101.19 12.57 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.26 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.2 m -99.18 131.54 46.27 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.336 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -104.17 98.73 8.5 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-O 122.077 0.941 . . . . 0.0 110.264 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.3 mt . . . . . 0 C--N 1.293 -1.877 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -179.216 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 N--CA 1.438 -1.786 0 CA-C-O 120.757 0.232 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.7 m -113.7 120.78 42.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 121.267 0.556 . . . . 0.0 110.441 -179.189 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.4 t -107.28 109.3 27.68 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.823 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -104.95 115.34 30.11 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.362 -178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 71.8 m -96.82 90.09 5.13 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-O 121.589 0.709 . . . . 0.0 109.166 176.24 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.3 m -95.42 127.08 41.17 Favored 'General case' 0 N--CA 1.424 -1.738 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.604 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.4 p -83.02 114.56 24.04 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.617 0 CA-C-O 121.882 0.849 . . . . 0.0 109.399 177.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 . . . . . 0 C--N 1.288 -2.099 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 179.068 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 N--CA 1.448 -1.175 0 N-CA-C 113.009 0.35 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.73 124.92 68.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 O-C-N 121.819 -0.55 . . . . 0.0 111.348 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 19.1 m -100.66 113.09 25.66 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.521 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -99.3 106.38 18.49 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 76.1 m -94.45 105.5 17.47 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.828 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.6 m -99.17 157.75 3.69 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.685 -179.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.6 ptp85 -114.85 134.92 54.74 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 121.728 0.775 . . . . 0.0 111.836 -176.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--N 1.291 -1.965 0 N-CA-C 104.441 -2.429 . . . . 0.0 104.441 171.942 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo . . . . . 0 CA--C 1.535 0.561 0 N-CA-C 113.291 0.458 . . . . 0.0 113.291 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.3 m -106.12 133.59 50.59 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.2 m -110.34 143.53 20.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.4 ttt180 -121.49 112.36 18.42 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 71.9 m -89.12 104.98 17.48 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-O 121.732 0.777 . . . . 0.0 110.124 177.018 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.9 m -99.39 111.47 23.83 Favored 'General case' 0 N--CA 1.418 -2.058 0 CA-C-N 114.527 -1.215 . . . . 0.0 108.509 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.437 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 8.7 p -91.51 122.5 42.98 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.284 0 CA-C-O 121.564 0.697 . . . . 0.0 109.956 -179.015 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 . . . . . 0 C--N 1.289 -2.043 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 179.78 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo . . . . . 0 CA--C 1.541 0.84 0 CA-C-O 121.041 0.351 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.0 t -107.82 126.72 64.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -176.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 39.8 m -114.21 116.08 28.48 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -96.02 100.79 12.42 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 72.5 m -93.34 105.66 17.71 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.461 0.648 . . . . 0.0 109.864 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -107.58 135.13 47.2 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.019 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -91.19 127.37 36.59 Favored 'General case' 0 C--N 1.298 -1.649 0 C-N-CA 119.938 -0.705 . . . . 0.0 110.054 178.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.5 mt . . . . . 0 C--N 1.293 -1.887 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 176.976 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo . . . . . 0 N--CA 1.446 -1.27 0 N-CA-C 112.764 0.255 . . . . 0.0 112.764 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.4 m -108.55 126.54 53.04 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.6 p -101.4 124.66 55.28 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.053 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 176.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -106.47 114.68 28.94 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 -178.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 88.5 m -99.86 98.62 9.39 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-O 121.462 0.649 . . . . 0.0 109.878 177.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.5 m -89.96 114.18 25.96 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.162 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.2 t -93.29 119.33 40.86 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.52 -176.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 . . . . . 0 C--N 1.295 -1.779 0 N-CA-C 107.389 -1.338 . . . . 0.0 107.389 176.099 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo . . . . . 0 N--CA 1.438 -1.772 0 N-CA-C 113.614 0.582 . . . . 0.0 113.614 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.7 t -117.04 129.13 74.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 119.923 -0.711 . . . . 0.0 112.206 -174.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.6 m -95.27 107.67 19.78 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 81.7 m95 -98.87 111.51 23.88 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 88.6 m -102.69 99.71 9.71 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 175.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -100.52 130.4 49.85 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.21 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -94.88 100.82 12.63 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.615 177.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.4 mt . . . . . 0 C--N 1.289 -2.053 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 178.492 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo . . . . . 0 N--CA 1.442 -1.539 0 N-CA-C 112.854 0.29 . . . . 0.0 112.854 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 p -111.93 156.1 22.63 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 122.28 -0.263 . . . . 0.0 111.301 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.7 p -125.58 138.25 55.03 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.547 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -119.48 117.95 29.79 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 175.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 99.9 m -102.36 96.29 6.85 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-O 121.391 0.615 . . . . 0.0 109.572 176.048 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.8 p -98.79 117.92 34.36 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.732 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.1 t -87.71 103.52 13.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 . . . . . 0 C--N 1.289 -2.031 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 -179.292 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 N--CA 1.443 -1.448 0 N-CA-C 112.733 0.244 . . . . 0.0 112.733 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.3 t -116.41 128.89 73.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 122.218 -0.301 . . . . 0.0 110.626 -175.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.4 m -104.34 119.71 39.57 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-O 121.048 0.451 . . . . 0.0 109.834 177.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -101.53 126.03 48.27 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 97.9 m -110.25 116.14 30.96 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.038 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 41.1 t -116.56 134.37 60.23 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -92.97 99.38 12.02 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 176.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.8 mt . . . . . 0 C--N 1.294 -1.829 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.671 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo . . . . . 0 N--CA 1.449 -1.116 0 CA-C-O 120.954 0.314 . . . . 0.0 111.776 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.7 m -98.21 119.97 37.81 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-O 121.247 0.546 . . . . 0.0 111.665 -172.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 49.7 t -86.78 110.76 20.66 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -114.98 134.11 55.46 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.755 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.3 m -116.12 125.28 52.14 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-O 121.208 0.527 . . . . 0.0 110.165 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.4 t -115.35 132.26 56.67 Favored 'General case' 0 N--CA 1.416 -2.159 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -96.58 119.26 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 CA-C-O 122.092 0.948 . . . . 0.0 110.825 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 20.0 mmm180 . . . . . 0 C--N 1.289 -2.052 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.19 179.252 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo . . . . . 0 N--CA 1.449 -1.113 0 N-CA-C 113.211 0.427 . . . . 0.0 113.211 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 32.4 t -113.37 130.85 66.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 CA-C-O 121.186 0.517 . . . . 0.0 111.083 -174.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 m -94.05 131.31 39.68 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' TRP . . . . . 0.419 ' CD1' ' HD3' ' A' ' 17' ' ' ARG . 95.4 m95 -118.32 103.58 9.93 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-O 121.196 0.522 . . . . 0.0 109.705 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 86.3 m -102.6 122.41 44.34 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.6 -179.251 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.5 m -114.13 130.08 68.97 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 173.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 50.0 ttp180 -90.44 96.57 10.72 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.994 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 43.5 mm . . . . . 0 C--N 1.299 -1.589 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 179.452 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo . . . . . 0 N--CA 1.44 -1.662 0 CA-C-O 121.163 0.401 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.0 m -103.19 123.31 46.47 Favored 'General case' 0 N--CA 1.424 -1.746 0 CA-C-O 121.203 0.525 . . . . 0.0 110.91 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.6 m -83.85 104.86 12.77 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.856 0 CA-C-O 121.907 0.86 . . . . 0.0 109.274 175.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -86.75 100.64 12.64 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 77.8 m -100.65 110.11 22.22 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.142 -176.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.7 t -102.16 150.89 22.82 Favored 'General case' 0 N--CA 1.414 -2.236 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 175.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.3 p -116.47 131.96 67.52 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.253 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.541 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.419 ' HD3' ' CD1' ' A' ' 4' ' ' TRP . 73.8 mtp180 . . . . . 0 N--CA 1.428 -1.559 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 176.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo . . . . . 0 N--CA 1.443 -1.448 0 CA-C-O 121.002 0.334 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.9 t -116.61 118.91 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.398 0 CA-C-O 121.502 0.668 . . . . 0.0 110.796 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 59.0 m -108.64 131.64 54.69 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 177.14 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 87.0 m95 -116.26 108.6 16.31 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 70.9 m -97.56 99.9 11.3 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.278 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.9 m -99.01 140.5 18.39 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.206 -178.104 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -104.58 101.97 11.6 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.392 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.5 mt . . . . . 0 C--N 1.302 -1.461 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -178.98 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 N--CA 1.454 -0.829 0 CA-C-O 120.8 0.25 . . . . 0.0 112.408 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 p -127.53 116.48 20.45 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -176.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 18.7 m -95.07 150.31 4.18 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 174.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -137.61 118.98 14.7 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 -179.269 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 96.7 m -100.92 101.0 11.71 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.586 176.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.8 t -93.14 119.84 32.78 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-O 121.382 0.61 . . . . 0.0 109.425 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 51.7 t -96.26 105.44 17.07 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.9 mtm180 . . . . . 0 C--N 1.295 -1.789 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.199 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo . . . . . 0 CA--C 1.544 1.016 0 CA-C-O 120.839 0.266 . . . . 0.0 112.62 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.8 t -92.73 142.71 12.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-O 120.838 0.351 . . . . 0.0 110.186 -173.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.7 m -127.38 126.55 42.67 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -112.04 118.92 36.74 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 94.0 m -101.41 99.29 9.61 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 121.998 0.904 . . . . 0.0 110.449 177.248 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 45.7 t -101.08 113.72 38.04 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.136 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.6 ptt-85 -86.07 110.31 19.43 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.855 0.836 . . . . 0.0 109.533 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 78.5 mt . . . . . 0 C--N 1.287 -2.125 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 178.486 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo . . . . . 0 CA--C 1.54 0.785 0 CA-C-O 120.828 0.262 . . . . 0.0 112.64 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.7 m -101.67 110.03 21.93 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 121.359 0.6 . . . . 0.0 111.855 -174.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 51.6 t -85.26 99.29 7.14 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.218 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 173.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.7 tpm_? -89.15 95.41 10.3 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -176.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 94.5 m -91.56 92.97 8.73 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.176 0.513 . . . . 0.0 109.703 176.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.9 t -91.32 138.96 31.18 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.571 -178.237 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.1 p -106.76 132.15 54.8 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.749 0 CA-C-O 121.232 0.539 . . . . 0.0 109.938 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 . . . . . 0 C--N 1.296 -1.737 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 177.965 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo . . . . . 0 N--CA 1.446 -1.306 0 N-CA-C 112.808 0.272 . . . . 0.0 112.808 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.1 t -108.35 132.2 56.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -177.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 27.2 m -106.93 128.49 54.37 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -113.59 101.38 9.28 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 72.2 m -92.16 99.65 12.41 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.405 0.621 . . . . 0.0 110.472 178.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.9 m -109.96 165.98 5.34 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.009 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -127.22 137.57 52.93 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.489 178.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.0 mt -112.01 105.15 18.23 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.948 0 N-CA-C 105.094 -2.188 . . . . 0.0 105.094 175.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -88.42 -1.17 6.8 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.553 2.169 . . . . 0.0 112.59 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.3 m -105.35 124.82 50.18 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-O 121.261 0.553 . . . . 0.0 111.047 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.7 t -101.32 137.17 29.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 -133.94 139.7 46.29 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.003 0.43 . . . . 0.0 110.353 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 72.6 m -110.01 105.36 14.46 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 177.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 18.9 m -91.06 126.21 36.08 Favored 'General case' 0 N--CA 1.422 -1.827 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 25.6 t -98.56 127.23 51.32 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.029 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.4 mmm180 -116.47 95.57 5.12 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo . . . . . 0 N--CA 1.444 -1.43 0 CA-C-O 120.482 0.117 . . . . 0.0 112.21 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.1 t -111.6 128.86 67.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 O-C-N 121.669 -0.645 . . . . 0.0 111.376 -176.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.5 m -92.19 116.07 28.63 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.55 ' CD1' ' HD3' ' A' ' 17' ' ' ARG . 92.8 m95 -102.62 113.04 26.08 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.397 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 72.7 m -106.65 111.11 23.5 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.24 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.2 t -116.65 126.8 74.28 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.0 ptt180 -85.49 102.72 13.73 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-O 121.905 0.859 . . . . 0.0 109.863 178.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.8 mt -98.97 103.01 14.15 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.783 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -89.98 0.69 5.55 Favored 'Trans proline' 0 N--CA 1.449 -1.134 0 C-N-CA 122.367 2.045 . . . . 0.0 112.087 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.0 p -108.16 109.94 21.46 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-O 121.311 0.577 . . . . 0.0 111.675 -176.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.5 t -85.38 119.16 33.49 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 175.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.411 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 71.1 ttt180 -107.19 111.93 24.57 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.07 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 87.2 m -103.95 91.71 4.09 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.565 0.698 . . . . 0.0 109.838 176.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.3 m -111.76 128.21 56.03 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.217 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 27.4 m -81.79 140.92 15.8 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 CA-C-O 121.586 0.707 . . . . 0.0 111.861 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.55 ' HD3' ' CD1' ' A' ' 4' ' ' TRP . 70.1 mtp180 -126.08 102.68 7.34 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 175.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo . . . . . 0 N--CA 1.444 -1.388 0 N-CA-C 113.353 0.482 . . . . 0.0 113.353 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.83 119.5 62.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 O-C-N 121.544 -0.722 . . . . 0.0 111.069 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 34.6 m -93.58 112.52 24.42 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 176.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -93.51 111.02 22.59 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.525 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 65.7 m -105.75 106.24 16.65 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-O 121.22 0.533 . . . . 0.0 109.789 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.1 p -98.9 142.43 14.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -117.53 128.76 55.28 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 121.22 0.533 . . . . 0.0 112.367 -174.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.6 mt -122.37 99.16 6.51 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 176.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -83.73 -5.12 10.73 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 122.421 2.081 . . . . 0.0 112.473 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.9 m -101.25 115.97 31.72 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 121.426 0.632 . . . . 0.0 110.941 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.2 t -105.39 129.45 58.24 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 93.6 mtt180 -112.49 115.07 28.07 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -98.91 103.77 15.76 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-O 121.432 0.634 . . . . 0.0 110.187 176.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.5 m -106.77 119.98 40.79 Favored 'General case' 0 C--N 1.298 -1.652 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.442 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 10.8 p -92.71 134.02 32.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 CA-C-O 121.475 0.655 . . . . 0.0 111.56 -176.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -120.17 96.1 5.02 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 174.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 CA--C 1.548 1.184 0 N-CA-C 113.079 0.376 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 25.7 t -108.33 136.9 42.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 O-C-N 121.95 -0.469 . . . . 0.0 110.303 -177.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.5 m -114.48 121.69 44.3 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -110.35 100.85 9.64 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 77.3 m -90.89 105.03 17.54 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.332 0.587 . . . . 0.0 109.545 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.1 m -103.06 153.69 5.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -118.19 121.17 39.81 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 121.789 0.804 . . . . 0.0 111.528 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 60.6 mt -105.51 102.06 13.3 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 178.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -94.96 3.97 2.5 Favored 'Trans proline' 0 N--CA 1.449 -1.123 0 C-N-CA 122.381 2.054 . . . . 0.0 112.44 177.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.0 m -104.76 121.05 42.8 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 121.088 0.47 . . . . 0.0 110.415 -177.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.3 p -94.59 136.2 26.54 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.774 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -129.52 127.89 41.7 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 76.9 m -104.89 102.36 11.89 Favored 'General case' 0 C--N 1.294 -1.827 0 CA-C-O 121.762 0.792 . . . . 0.0 111.346 -176.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.1 p -89.58 112.42 23.62 Favored 'General case' 0 N--CA 1.424 -1.744 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.945 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.7 t -91.02 128.6 42.72 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.198 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 -120.74 98.97 6.27 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo . . . . . 0 CA--C 1.539 0.774 0 N-CA-C 113.088 0.38 . . . . 0.0 113.088 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.7 t -111.61 147.43 15.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -177.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 28.8 m -128.0 134.49 49.26 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -118.33 112.63 20.29 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.9 m -105.69 118.94 37.86 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 120.917 0.389 . . . . 0.0 110.656 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.1 m -127.68 138.03 55.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.544 ' HA ' ' HA ' ' A' ' 12' ' ' VAL . 44.7 ttp85 -97.07 113.07 24.59 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-O 121.166 0.508 . . . . 0.0 110.799 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 46.5 mm -101.91 107.5 21.77 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.757 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -90.55 11.09 2.76 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.339 2.026 . . . . 0.0 112.678 179.031 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 p -126.21 121.45 32.78 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -177.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.544 ' HA ' ' HA ' ' A' ' 7' ' ' ARG . 7.1 p -95.57 128.36 46.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.097 0.475 . . . . 0.0 110.232 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.1 mtm180 -112.86 127.94 56.32 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 90.9 m -106.35 107.53 18.59 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.0 m -88.86 114.72 25.79 Favored 'General case' 0 N--CA 1.412 -2.368 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 -178.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.9 p -90.72 115.95 31.01 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.816 0 CA-C-O 121.461 0.648 . . . . 0.0 109.974 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -118.27 93.12 4.01 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo . . . . . 0 N--CA 1.439 -1.727 0 N-CA-C 112.295 0.075 . . . . 0.0 112.295 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.9 t -116.74 126.5 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.637 -174.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 49.1 m -99.05 108.64 21.35 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 175.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 78.5 m95 -89.94 106.57 18.56 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 74.6 m -105.08 111.86 24.79 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 121.56 0.695 . . . . 0.0 112.119 -178.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -105.3 140.45 23.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 175.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -116.54 126.99 54.12 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.608 -0.837 . . . . 0.0 111.506 -177.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.3 mp -107.55 91.28 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 177.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -84.43 -1.06 9.62 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.606 2.204 . . . . 0.0 113.015 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.2 m -101.45 126.64 48.26 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 120.867 0.365 . . . . 0.0 110.079 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 35.2 m -107.48 140.12 26.89 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 CA-C-O 120.971 0.415 . . . . 0.0 109.884 178.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -122.79 105.46 10.06 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 176.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 88.3 m -104.68 110.06 22.23 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.595 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.3 m -102.38 114.79 29.28 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 7.4 p -93.75 112.49 26.78 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.862 0 CA-C-O 122.272 1.034 . . . . 0.0 111.096 -178.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -120.23 115.8 24.33 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.26 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo . . . . . 0 N--CA 1.443 -1.483 0 CA-C-O 120.62 0.175 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.3 t -113.24 129.98 68.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 121.666 -0.646 . . . . 0.0 111.103 -176.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 58.0 m -100.18 114.82 28.52 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.686 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -104.09 117.08 33.4 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 80.7 m -103.53 111.18 23.52 Favored 'General case' 0 C--N 1.298 -1.65 0 C-N-CA 119.603 -0.839 . . . . 0.0 111.43 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p -104.03 135.08 43.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.193 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -90.09 121.14 31.88 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-O 121.218 0.533 . . . . 0.0 110.491 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.6 mt -117.62 94.66 3.21 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -84.85 -8.25 9.23 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.197 1.932 . . . . 0.0 112.648 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.7 p -114.53 130.82 56.79 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -174.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.0 t -103.71 121.8 55.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -105.13 122.65 46.33 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.187 -176.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 87.5 m -94.85 104.28 16.18 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.727 0.775 . . . . 0.0 110.491 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.1 p -89.84 109.58 20.57 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.646 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.7 t -86.33 115.84 28.13 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -110.31 102.24 10.91 Favored 'General case' 0 C--N 1.29 -1.999 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 CA--C 1.545 1.045 0 CA-C-O 121.342 0.476 . . . . 0.0 112.192 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.7 t -94.97 130.16 44.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 53.1 m -130.13 105.33 7.87 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-O 121.25 0.548 . . . . 0.0 110.936 -178.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -91.64 102.74 15.38 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.152 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 75.1 m -94.35 100.86 12.81 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-O 121.339 0.59 . . . . 0.0 109.412 177.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.0 p -106.42 131.28 56.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.807 -177.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -78.39 109.97 13.02 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.519 0.676 . . . . 0.0 110.657 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.3 tt -105.52 107.47 22.71 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.906 0 CA-C-N 114.433 -1.258 . . . . 0.0 107.731 177.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -91.43 6.4 3.64 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.604 2.203 . . . . 0.0 112.116 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.4 p -119.15 164.48 15.51 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 122.17 -0.331 . . . . 0.0 111.332 -176.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.7 t -119.19 124.19 72.65 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -105.74 109.98 22.12 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 73.6 m -92.08 107.86 19.52 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 121.69 0.757 . . . . 0.0 110.294 177.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.4 m -90.91 111.87 23.49 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 114.746 -1.116 . . . . 0.0 108.167 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.5 t -97.38 110.88 26.06 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 CA-C-O 121.241 0.543 . . . . 0.0 110.192 -176.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 32.8 mmt180 -110.98 92.73 4.16 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo . . . . . 0 N--CA 1.444 -1.405 0 CA-C-O 120.666 0.194 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.5 t -108.01 122.31 62.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -175.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 17.1 m -102.47 110.75 22.79 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 77.9 m95 -91.37 121.43 33.08 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 71.5 m -110.73 100.46 9.22 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 121.366 0.603 . . . . 0.0 110.871 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.6 p -99.63 126.59 52.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.549 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.529 ' HA ' ' HA ' ' A' ' 12' ' ' VAL . 40.0 ttm180 -91.04 114.75 27.36 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 120.884 0.373 . . . . 0.0 111.322 -176.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 63.9 mt -109.35 98.62 7.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 174.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -85.0 -6.75 9.45 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.666 2.244 . . . . 0.0 112.543 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.3 p -114.19 116.54 29.23 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -176.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.529 ' HA ' ' HA ' ' A' ' 7' ' ' ARG . 7.5 p -92.79 130.67 41.54 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.948 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 174.204 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -105.28 111.1 23.71 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 92.0 m -96.58 99.43 11.06 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.539 0.685 . . . . 0.0 110.153 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.4 m -96.13 116.77 29.49 Favored 'General case' 0 N--CA 1.416 -2.141 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.407 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 13.5 p -85.27 114.55 25.5 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 CA-C-O 121.864 0.84 . . . . 0.0 110.264 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -110.11 99.28 8.39 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo . . . . . 0 CA--C 1.542 0.894 0 CA-C-O 121.01 0.338 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 50.6 t -109.86 141.1 26.1 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -178.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 40.4 m -130.19 128.7 42.24 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.747 -0.595 . . . . 0.0 110.71 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -115.73 142.94 46.08 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.3 m -121.37 126.18 48.78 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 121.15 0.5 . . . . 0.0 110.441 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 55.0 t -99.26 124.84 52.8 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -100.68 118.74 37.41 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.51 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 39.7 mt -128.65 89.42 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.402 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -87.34 -6.13 7.24 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.33 2.02 . . . . 0.0 111.546 176.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.4 m -91.64 129.52 37.6 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.429 -178.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.78 123.92 55.49 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-O 121.467 0.651 . . . . 0.0 109.573 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -115.25 114.14 24.82 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.828 -0.623 . . . . 0.0 109.807 -177.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 85.7 m -100.65 113.55 26.5 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 121.622 0.725 . . . . 0.0 109.965 177.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.4 m -101.33 128.36 47.53 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.744 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 31.3 m -89.5 133.79 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.532 0 CA-C-O 121.489 0.661 . . . . 0.0 110.736 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -125.46 81.55 1.98 Allowed 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 175.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo . . . . . 0 N--CA 1.447 -1.229 0 N-CA-C 113.686 0.61 . . . . 0.0 113.686 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 37.9 t -115.78 127.94 73.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 C-N-CA 119.707 -0.797 . . . . 0.0 111.805 -175.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 29.2 m -93.1 110.3 21.79 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -96.89 99.49 11.05 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 78.1 m -91.34 109.86 21.14 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.4 m -101.92 138.89 24.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.581 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -109.74 134.25 52.21 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.943 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 55.7 mt -138.73 96.9 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 176.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -87.01 -4.14 7.95 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.223 1.949 . . . . 0.0 111.748 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 m -94.36 133.65 37.7 Favored 'General case' 0 N--CA 1.423 -1.794 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.336 -176.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -129.22 122.42 56.05 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -119.99 113.89 21.2 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.072 -177.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 81.7 m -92.73 101.7 14.1 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 121.929 0.871 . . . . 0.0 110.296 177.007 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.9 m -100.28 110.25 22.49 Favored 'General case' 0 N--CA 1.414 -2.266 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.172 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 7.2 p -89.45 121.26 39.4 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 CA-C-O 121.847 0.832 . . . . 0.0 110.994 -176.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -115.03 102.52 10.03 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo . . . . . 0 N--CA 1.448 -1.164 0 N-CA-C 112.918 0.315 . . . . 0.0 112.918 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.6 t -105.55 122.9 59.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.977 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.5 m -85.04 117.74 24.18 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -105.88 100.37 9.93 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 120.888 0.375 . . . . 0.0 110.995 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 71.2 m -90.0 99.96 12.87 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-O 121.573 0.702 . . . . 0.0 109.412 177.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 30.8 m -99.76 147.11 7.71 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.405 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -102.5 122.15 43.77 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.07 -176.068 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.7 mp -120.02 98.35 6.13 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 176.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -87.27 -2.8 7.82 Favored 'Trans proline' 0 CA--C 1.546 1.09 0 C-N-CA 122.379 2.053 . . . . 0.0 113.46 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.4 m -116.2 126.45 53.65 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.257 0.551 . . . . 0.0 111.951 -174.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.8 t -91.45 130.42 40.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -116.11 111.33 20.11 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 85.0 m -94.01 97.36 10.28 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.762 0.792 . . . . 0.0 110.761 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 34.7 m -89.81 134.08 34.38 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 114.577 -1.192 . . . . 0.0 108.337 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 m -98.15 118.92 45.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 C-N-CA 120.071 -0.652 . . . . 0.0 111.289 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -113.85 102.06 9.86 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo . . . . . 0 N--CA 1.442 -1.547 0 N-CA-C 113.082 0.378 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.3 t -119.46 140.01 44.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 O-C-N 121.876 -0.515 . . . . 0.0 111.11 -175.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.3 m -104.03 103.66 13.51 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 176.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -90.74 116.17 28.39 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.932 -177.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 73.8 m -98.23 101.19 12.57 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.26 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.2 m -99.18 131.54 46.27 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.336 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -104.17 98.73 8.5 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-O 122.077 0.941 . . . . 0.0 110.264 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.3 mt -106.0 106.02 19.8 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.877 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -91.49 14.97 1.78 Allowed 'Trans proline' 0 N--CA 1.438 -1.786 0 C-N-CA 122.454 2.102 . . . . 0.0 111.98 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.7 m -113.7 120.78 42.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 121.267 0.556 . . . . 0.0 110.441 -179.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.4 t -107.28 109.3 27.68 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.823 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -104.95 115.34 30.11 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.362 -178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 71.8 m -96.82 90.09 5.13 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-O 121.589 0.709 . . . . 0.0 109.166 176.24 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.3 m -95.42 127.08 41.17 Favored 'General case' 0 N--CA 1.424 -1.738 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.604 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.4 p -83.02 114.56 24.04 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.617 0 CA-C-O 121.882 0.849 . . . . 0.0 109.399 177.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 -116.91 116.77 28.06 Favored 'General case' 0 C--N 1.288 -2.099 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 N--CA 1.448 -1.175 0 N-CA-C 113.009 0.35 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.73 124.92 68.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 O-C-N 121.819 -0.55 . . . . 0.0 111.348 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 19.1 m -100.66 113.09 25.66 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.521 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -99.3 106.38 18.49 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 76.1 m -94.45 105.5 17.47 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.6 m -99.17 157.75 3.69 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.685 -179.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.6 ptp85 -114.85 134.92 54.74 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 121.728 0.775 . . . . 0.0 111.836 -176.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.5 mp -118.65 88.75 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.965 0 N-CA-C 104.441 -2.429 . . . . 0.0 104.441 171.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -81.86 -6.67 12.37 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 122.757 2.304 . . . . 0.0 113.291 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.3 m -106.12 133.59 50.59 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.2 m -110.34 143.53 20.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.4 ttt180 -121.49 112.36 18.42 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 71.9 m -89.12 104.98 17.48 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-O 121.732 0.777 . . . . 0.0 110.124 177.018 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.9 m -99.39 111.47 23.83 Favored 'General case' 0 N--CA 1.418 -2.058 0 CA-C-N 114.527 -1.215 . . . . 0.0 108.509 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.437 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 8.7 p -91.51 122.5 42.98 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.284 0 CA-C-O 121.564 0.697 . . . . 0.0 109.956 -179.015 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -117.4 100.34 7.6 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo . . . . . 0 CA--C 1.541 0.84 0 CA-C-O 121.041 0.351 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.0 t -107.82 126.72 64.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -176.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 39.8 m -114.21 116.08 28.48 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -96.02 100.79 12.42 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 72.5 m -93.34 105.66 17.71 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.461 0.648 . . . . 0.0 109.864 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -107.58 135.13 47.2 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.019 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -91.19 127.37 36.59 Favored 'General case' 0 C--N 1.298 -1.649 0 C-N-CA 119.938 -0.705 . . . . 0.0 110.054 178.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.5 mt -119.83 89.65 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.887 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 176.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -87.83 1.06 6.94 Favored 'Trans proline' 0 N--CA 1.446 -1.27 0 C-N-CA 122.347 2.031 . . . . 0.0 112.764 178.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.4 m -108.55 126.54 53.04 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.6 p -101.4 124.66 55.28 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.053 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 176.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -106.47 114.68 28.94 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 -178.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 88.5 m -99.86 98.62 9.39 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-O 121.462 0.649 . . . . 0.0 109.878 177.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.5 m -89.96 114.18 25.96 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.162 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.2 t -93.29 119.33 40.86 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.52 -176.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -118.09 96.77 5.48 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 107.389 -1.338 . . . . 0.0 107.389 176.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo . . . . . 0 N--CA 1.438 -1.772 0 N-CA-C 113.614 0.582 . . . . 0.0 113.614 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.7 t -117.04 129.13 74.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 119.923 -0.711 . . . . 0.0 112.206 -174.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.6 m -95.27 107.67 19.78 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 81.7 m95 -98.87 111.51 23.88 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 88.6 m -102.69 99.71 9.71 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 175.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -100.52 130.4 49.85 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.21 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -94.88 100.82 12.63 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.615 177.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.4 mt -94.42 109.27 21.89 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.053 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 178.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -97.36 9.75 1.21 Allowed 'Trans proline' 0 N--CA 1.442 -1.539 0 C-N-CA 122.739 2.293 . . . . 0.0 112.854 176.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 p -111.93 156.1 22.63 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 122.28 -0.263 . . . . 0.0 111.301 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.7 p -125.58 138.25 55.03 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.547 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -119.48 117.95 29.79 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 175.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 99.9 m -102.36 96.29 6.85 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-O 121.391 0.615 . . . . 0.0 109.572 176.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.8 p -98.79 117.92 34.36 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.732 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.1 t -87.71 103.52 13.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -100.22 104.12 15.61 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 N--CA 1.443 -1.448 0 N-CA-C 112.733 0.244 . . . . 0.0 112.733 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.3 t -116.41 128.89 73.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 122.218 -0.301 . . . . 0.0 110.626 -175.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.4 m -104.34 119.71 39.57 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-O 121.048 0.451 . . . . 0.0 109.834 177.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -101.53 126.03 48.27 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 97.9 m -110.25 116.14 30.96 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 41.1 t -116.56 134.37 60.23 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -92.97 99.38 12.02 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 176.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.8 mt -92.09 111.47 24.25 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.829 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -98.2 1.11 1.32 Allowed 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 122.439 2.093 . . . . 0.0 111.776 174.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.7 m -98.21 119.97 37.81 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-O 121.247 0.546 . . . . 0.0 111.665 -172.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 49.7 t -86.78 110.76 20.66 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -114.98 134.11 55.46 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.755 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.3 m -116.12 125.28 52.14 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-O 121.208 0.527 . . . . 0.0 110.165 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.4 t -115.35 132.26 56.67 Favored 'General case' 0 N--CA 1.416 -2.159 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -96.58 119.26 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 CA-C-O 122.092 0.948 . . . . 0.0 110.825 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 20.0 mmm180 -115.38 100.34 8.03 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.19 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo . . . . . 0 N--CA 1.449 -1.113 0 N-CA-C 113.211 0.427 . . . . 0.0 113.211 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 32.4 t -113.37 130.85 66.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 CA-C-O 121.186 0.517 . . . . 0.0 111.083 -174.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 m -94.05 131.31 39.68 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' TRP . . . . . 0.419 ' CD1' ' HD3' ' A' ' 17' ' ' ARG . 95.4 m95 -118.32 103.58 9.93 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-O 121.196 0.522 . . . . 0.0 109.705 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 86.3 m -102.6 122.41 44.34 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.6 -179.251 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.5 m -114.13 130.08 68.97 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 173.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 50.0 ttp180 -90.44 96.57 10.72 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.994 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 43.5 mm -90.32 113.31 26.15 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -100.5 5.65 0.72 Allowed 'Trans proline' 0 N--CA 1.44 -1.662 0 C-N-CA 122.705 2.27 . . . . 0.0 111.298 175.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.0 m -103.19 123.31 46.47 Favored 'General case' 0 N--CA 1.424 -1.746 0 CA-C-O 121.203 0.525 . . . . 0.0 110.91 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.6 m -83.85 104.86 12.77 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.856 0 CA-C-O 121.907 0.86 . . . . 0.0 109.274 175.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -86.75 100.64 12.64 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 77.8 m -100.65 110.11 22.22 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.142 -176.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.7 t -102.16 150.89 22.82 Favored 'General case' 0 N--CA 1.414 -2.236 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 175.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.3 p -116.47 131.96 67.52 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.253 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.541 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.419 ' HD3' ' CD1' ' A' ' 4' ' ' TRP . 73.8 mtp180 -119.04 102.92 9.1 Favored 'General case' 0 N--CA 1.428 -1.559 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 176.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo . . . . . 0 N--CA 1.443 -1.448 0 CA-C-O 121.002 0.334 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.9 t -116.61 118.91 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.398 0 CA-C-O 121.502 0.668 . . . . 0.0 110.796 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 59.0 m -108.64 131.64 54.69 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 177.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 87.0 m95 -116.26 108.6 16.31 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 70.9 m -97.56 99.9 11.3 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.9 m -99.01 140.5 18.39 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.206 -178.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -104.58 101.97 11.6 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.392 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.5 mt -108.12 101.29 12.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -94.44 7.73 2.27 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.853 2.368 . . . . 0.0 112.408 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 p -127.53 116.48 20.45 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -176.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 18.7 m -95.07 150.31 4.18 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 174.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -137.61 118.98 14.7 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 -179.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 96.7 m -100.92 101.0 11.71 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.586 176.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.8 t -93.14 119.84 32.78 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-O 121.382 0.61 . . . . 0.0 109.425 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 51.7 t -96.26 105.44 17.07 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.409 ' HA ' ' HD2' ' A' ' 18' ' ' DPR . 52.9 mtm180 -118.73 104.04 10.22 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.199 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' DPR . . . . . 0.409 ' HD2' ' HA ' ' A' ' 17' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo . . . . . 0 CA--C 1.544 1.016 0 CA-C-O 120.839 0.266 . . . . 0.0 112.62 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.8 t -92.73 142.71 12.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-O 120.838 0.351 . . . . 0.0 110.186 -173.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.7 m -127.38 126.55 42.67 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -112.04 118.92 36.74 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 94.0 m -101.41 99.29 9.61 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 121.998 0.904 . . . . 0.0 110.449 177.248 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 45.7 t -101.08 113.72 38.04 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.136 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.6 ptt-85 -86.07 110.31 19.43 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.855 0.836 . . . . 0.0 109.533 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 78.5 mt -107.86 100.69 11.25 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.125 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -88.75 -4.43 6.3 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.733 2.288 . . . . 0.0 112.64 177.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.7 m -101.67 110.03 21.93 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 121.359 0.6 . . . . 0.0 111.855 -174.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 51.6 t -85.26 99.29 7.14 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.218 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 173.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.7 tpm_? -89.15 95.41 10.3 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -176.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 94.5 m -91.56 92.97 8.73 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.176 0.513 . . . . 0.0 109.703 176.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.9 t -91.32 138.96 31.18 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.571 -178.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.1 p -106.76 132.15 54.8 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.749 0 CA-C-O 121.232 0.539 . . . . 0.0 109.938 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -128.14 100.42 5.85 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo . . . . . 0 N--CA 1.446 -1.306 0 N-CA-C 112.808 0.272 . . . . 0.0 112.808 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.1 t -108.35 132.2 56.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -177.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 27.2 m -106.93 128.49 54.37 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -113.59 101.38 9.28 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 72.2 m -92.16 99.65 12.41 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.405 0.621 . . . . 0.0 110.472 178.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.9 m -109.96 165.98 5.34 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.009 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -127.22 137.57 52.93 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.489 178.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.0 mt . . . . . 0 C--N 1.291 -1.948 0 N-CA-C 105.094 -2.188 . . . . 0.0 105.094 175.882 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo . . . . . 0 CA--C 1.539 0.734 0 CA-C-O 120.896 0.29 . . . . 0.0 112.59 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.3 m -105.35 124.82 50.18 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-O 121.261 0.553 . . . . 0.0 111.047 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.7 t -101.32 137.17 29.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 -133.94 139.7 46.29 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.003 0.43 . . . . 0.0 110.353 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 72.6 m -110.01 105.36 14.46 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 177.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 18.9 m -91.06 126.21 36.08 Favored 'General case' 0 N--CA 1.422 -1.827 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 25.6 t -98.56 127.23 51.32 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.029 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.4 mmm180 . . . . . 0 C--N 1.297 -1.716 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 178.586 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo . . . . . 0 N--CA 1.444 -1.43 0 CA-C-O 120.482 0.117 . . . . 0.0 112.21 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.1 t -111.6 128.86 67.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 O-C-N 121.669 -0.645 . . . . 0.0 111.376 -176.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.5 m -92.19 116.07 28.63 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . 0.55 ' CD1' ' HD3' ' A' ' 17' ' ' ARG . 92.8 m95 -102.62 113.04 26.08 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.397 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 72.7 m -106.65 111.11 23.5 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.2 t -116.65 126.8 74.28 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.0 ptt180 -85.49 102.72 13.73 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-O 121.905 0.859 . . . . 0.0 109.863 178.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.8 mt . . . . . 0 C--N 1.295 -1.783 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 179.474 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 N--CA 1.449 -1.134 0 CA-C-O 120.957 0.315 . . . . 0.0 112.087 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.0 p -108.16 109.94 21.46 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-O 121.311 0.577 . . . . 0.0 111.675 -176.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.5 t -85.38 119.16 33.49 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 175.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.411 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 71.1 ttt180 -107.19 111.93 24.57 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.07 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 87.2 m -103.95 91.71 4.09 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.565 0.698 . . . . 0.0 109.838 176.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.3 m -111.76 128.21 56.03 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.217 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 27.4 m -81.79 140.92 15.8 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 CA-C-O 121.586 0.707 . . . . 0.0 111.861 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.55 ' HD3' ' CD1' ' A' ' 4' ' ' TRP . 70.1 mtp180 . . . . . 0 C--N 1.292 -1.902 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 175.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo . . . . . 0 N--CA 1.444 -1.388 0 N-CA-C 113.353 0.482 . . . . 0.0 113.353 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.83 119.5 62.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 O-C-N 121.544 -0.722 . . . . 0.0 111.069 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 34.6 m -93.58 112.52 24.42 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 176.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -93.51 111.02 22.59 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.525 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 65.7 m -105.75 106.24 16.65 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-O 121.22 0.533 . . . . 0.0 109.789 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.1 p -98.9 142.43 14.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -117.53 128.76 55.28 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 121.22 0.533 . . . . 0.0 112.367 -174.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.6 mt . . . . . 0 C--N 1.297 -1.683 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 176.254 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo . . . . . 0 CA--C 1.536 0.611 0 N-CA-C 112.473 0.143 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.9 m -101.25 115.97 31.72 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 121.426 0.632 . . . . 0.0 110.941 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.2 t -105.39 129.45 58.24 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 93.6 mtt180 -112.49 115.07 28.07 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -98.91 103.77 15.76 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-O 121.432 0.634 . . . . 0.0 110.187 176.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.5 m -106.77 119.98 40.79 Favored 'General case' 0 C--N 1.298 -1.652 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.442 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 10.8 p -92.71 134.02 32.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 CA-C-O 121.475 0.655 . . . . 0.0 111.56 -176.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 . . . . . 0 C--N 1.3 -1.548 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 174.844 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 CA--C 1.548 1.184 0 N-CA-C 113.079 0.376 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 25.7 t -108.33 136.9 42.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 O-C-N 121.95 -0.469 . . . . 0.0 110.303 -177.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.5 m -114.48 121.69 44.3 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -110.35 100.85 9.64 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 77.3 m -90.89 105.03 17.54 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.332 0.587 . . . . 0.0 109.545 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.1 m -103.06 153.69 5.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -118.19 121.17 39.81 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 121.789 0.804 . . . . 0.0 111.528 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 60.6 mt . . . . . 0 C--N 1.301 -1.543 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 178.352 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo . . . . . 0 N--CA 1.449 -1.123 0 N-CA-C 112.44 0.131 . . . . 0.0 112.44 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.0 m -104.76 121.05 42.8 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 121.088 0.47 . . . . 0.0 110.415 -177.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.3 p -94.59 136.2 26.54 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.774 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -129.52 127.89 41.7 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 76.9 m -104.89 102.36 11.89 Favored 'General case' 0 C--N 1.294 -1.827 0 CA-C-O 121.762 0.792 . . . . 0.0 111.346 -176.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.1 p -89.58 112.42 23.62 Favored 'General case' 0 N--CA 1.424 -1.744 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.945 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.7 t -91.02 128.6 42.72 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.198 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 . . . . . 0 C--N 1.296 -1.725 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.689 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo . . . . . 0 CA--C 1.539 0.774 0 N-CA-C 113.088 0.38 . . . . 0.0 113.088 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.7 t -111.61 147.43 15.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -177.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 28.8 m -128.0 134.49 49.26 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -118.33 112.63 20.29 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.9 m -105.69 118.94 37.86 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 120.917 0.389 . . . . 0.0 110.656 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.1 m -127.68 138.03 55.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.544 ' HA ' ' HA ' ' A' ' 12' ' ' VAL . 44.7 ttp85 -97.07 113.07 24.59 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-O 121.166 0.508 . . . . 0.0 110.799 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 46.5 mm . . . . . 0 C--N 1.296 -1.757 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 179.365 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo . . . . . 0 CA--C 1.543 0.94 0 N-CA-C 112.678 0.222 . . . . 0.0 112.678 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 p -126.21 121.45 32.78 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -177.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.544 ' HA ' ' HA ' ' A' ' 7' ' ' ARG . 7.1 p -95.57 128.36 46.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.097 0.475 . . . . 0.0 110.232 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.1 mtm180 -112.86 127.94 56.32 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 90.9 m -106.35 107.53 18.59 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.0 m -88.86 114.72 25.79 Favored 'General case' 0 N--CA 1.412 -2.368 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 -178.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.9 p -90.72 115.95 31.01 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.816 0 CA-C-O 121.461 0.648 . . . . 0.0 109.974 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 . . . . . 0 C--N 1.3 -1.58 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 179.907 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo . . . . . 0 N--CA 1.439 -1.727 0 N-CA-C 112.295 0.075 . . . . 0.0 112.295 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.9 t -116.74 126.5 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.637 -174.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 49.1 m -99.05 108.64 21.35 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 175.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 78.5 m95 -89.94 106.57 18.56 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 74.6 m -105.08 111.86 24.79 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 121.56 0.695 . . . . 0.0 112.119 -178.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -105.3 140.45 23.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 175.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -116.54 126.99 54.12 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.608 -0.837 . . . . 0.0 111.506 -177.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.3 mp . . . . . 0 C--N 1.293 -1.865 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 177.086 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo . . . . . 0 N--CA 1.457 -0.635 0 N-CA-C 113.015 0.352 . . . . 0.0 113.015 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.2 m -101.45 126.64 48.26 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 120.867 0.365 . . . . 0.0 110.079 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 35.2 m -107.48 140.12 26.89 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 CA-C-O 120.971 0.415 . . . . 0.0 109.884 178.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -122.79 105.46 10.06 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 176.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 88.3 m -104.68 110.06 22.23 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.595 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.3 m -102.38 114.79 29.28 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 7.4 p -93.75 112.49 26.78 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.862 0 CA-C-O 122.272 1.034 . . . . 0.0 111.096 -178.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 . . . . . 0 C--N 1.297 -1.711 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.26 -178.636 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo . . . . . 0 N--CA 1.443 -1.483 0 CA-C-O 120.62 0.175 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.3 t -113.24 129.98 68.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 121.666 -0.646 . . . . 0.0 111.103 -176.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 58.0 m -100.18 114.82 28.52 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.686 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -104.09 117.08 33.4 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 80.7 m -103.53 111.18 23.52 Favored 'General case' 0 C--N 1.298 -1.65 0 C-N-CA 119.603 -0.839 . . . . 0.0 111.43 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p -104.03 135.08 43.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.193 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -90.09 121.14 31.88 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-O 121.218 0.533 . . . . 0.0 110.491 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.6 mt . . . . . 0 C--N 1.297 -1.682 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.507 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo . . . . . 0 N--CA 1.453 -0.873 0 CA-C-O 120.774 0.239 . . . . 0.0 112.648 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.7 p -114.53 130.82 56.79 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -174.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.0 t -103.71 121.8 55.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -105.13 122.65 46.33 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.187 -176.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 87.5 m -94.85 104.28 16.18 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.727 0.775 . . . . 0.0 110.491 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.1 p -89.84 109.58 20.57 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.646 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.7 t -86.33 115.84 28.13 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 . . . . . 0 C--N 1.29 -1.999 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 179.367 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 CA--C 1.545 1.045 0 CA-C-O 121.342 0.476 . . . . 0.0 112.192 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.7 t -94.97 130.16 44.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 53.1 m -130.13 105.33 7.87 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-O 121.25 0.548 . . . . 0.0 110.936 -178.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -91.64 102.74 15.38 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.152 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 75.1 m -94.35 100.86 12.81 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-O 121.339 0.59 . . . . 0.0 109.412 177.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.0 p -106.42 131.28 56.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.807 -177.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -78.39 109.97 13.02 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.519 0.676 . . . . 0.0 110.657 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.3 tt . . . . . 0 C--N 1.292 -1.906 0 CA-C-N 114.433 -1.258 . . . . 0.0 107.731 177.75 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo . . . . . 0 N--CA 1.457 -0.638 0 CA-C-O 121.13 0.387 . . . . 0.0 112.116 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.4 p -119.15 164.48 15.51 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 122.17 -0.331 . . . . 0.0 111.332 -176.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.7 t -119.19 124.19 72.65 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -105.74 109.98 22.12 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 73.6 m -92.08 107.86 19.52 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 121.69 0.757 . . . . 0.0 110.294 177.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.4 m -90.91 111.87 23.49 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 114.746 -1.116 . . . . 0.0 108.167 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.5 t -97.38 110.88 26.06 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 CA-C-O 121.241 0.543 . . . . 0.0 110.192 -176.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 32.8 mmt180 . . . . . 0 C--N 1.303 -1.42 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 175.868 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo . . . . . 0 N--CA 1.444 -1.405 0 CA-C-O 120.666 0.194 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.5 t -108.01 122.31 62.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -175.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 17.1 m -102.47 110.75 22.79 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 77.9 m95 -91.37 121.43 33.08 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 71.5 m -110.73 100.46 9.22 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 121.366 0.603 . . . . 0.0 110.871 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.6 p -99.63 126.59 52.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.549 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.529 ' HA ' ' HA ' ' A' ' 12' ' ' VAL . 40.0 ttm180 -91.04 114.75 27.36 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 120.884 0.373 . . . . 0.0 111.322 -176.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 63.9 mt . . . . . 0 C--N 1.302 -1.489 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 174.716 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo . . . . . 0 N--CA 1.456 -0.683 0 CA-C-O 120.93 0.304 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.3 p -114.19 116.54 29.23 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -176.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.529 ' HA ' ' HA ' ' A' ' 7' ' ' ARG . 7.5 p -92.79 130.67 41.54 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.948 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 174.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -105.28 111.1 23.71 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 92.0 m -96.58 99.43 11.06 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.539 0.685 . . . . 0.0 110.153 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.4 m -96.13 116.77 29.49 Favored 'General case' 0 N--CA 1.416 -2.141 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.407 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 13.5 p -85.27 114.55 25.5 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 CA-C-O 121.864 0.84 . . . . 0.0 110.264 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 . . . . . 0 C--N 1.3 -1.564 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 178.738 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo . . . . . 0 CA--C 1.542 0.894 0 CA-C-O 121.01 0.338 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 50.6 t -109.86 141.1 26.1 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -178.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 40.4 m -130.19 128.7 42.24 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.747 -0.595 . . . . 0.0 110.71 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -115.73 142.94 46.08 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.3 m -121.37 126.18 48.78 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 121.15 0.5 . . . . 0.0 110.441 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 55.0 t -99.26 124.84 52.8 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -100.68 118.74 37.41 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.51 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 39.7 mt . . . . . 0 C--N 1.304 -1.402 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 178.547 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo . . . . . 0 CA--C 1.54 0.802 0 CA-C-O 121.339 0.474 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.4 m -91.64 129.52 37.6 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.429 -178.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.78 123.92 55.49 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-O 121.467 0.651 . . . . 0.0 109.573 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -115.25 114.14 24.82 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.828 -0.623 . . . . 0.0 109.807 -177.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 85.7 m -100.65 113.55 26.5 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 121.622 0.725 . . . . 0.0 109.965 177.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.4 m -101.33 128.36 47.53 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.744 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 31.3 m -89.5 133.79 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.532 0 CA-C-O 121.489 0.661 . . . . 0.0 110.736 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 . . . . . 0 C--N 1.286 -2.18 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 175.881 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo . . . . . 0 N--CA 1.447 -1.229 0 N-CA-C 113.686 0.61 . . . . 0.0 113.686 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 37.9 t -115.78 127.94 73.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 C-N-CA 119.707 -0.797 . . . . 0.0 111.805 -175.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 29.2 m -93.1 110.3 21.79 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -96.89 99.49 11.05 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 78.1 m -91.34 109.86 21.14 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.4 m -101.92 138.89 24.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.581 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -109.74 134.25 52.21 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.943 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 55.7 mt . . . . . 0 C--N 1.302 -1.498 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 176.869 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo . . . . . 0 N--CA 1.452 -0.955 0 CA-C-O 121.168 0.403 . . . . 0.0 111.748 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 m -94.36 133.65 37.7 Favored 'General case' 0 N--CA 1.423 -1.794 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.336 -176.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -129.22 122.42 56.05 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -119.99 113.89 21.2 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.072 -177.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 81.7 m -92.73 101.7 14.1 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 121.929 0.871 . . . . 0.0 110.296 177.007 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.9 m -100.28 110.25 22.49 Favored 'General case' 0 N--CA 1.414 -2.266 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.172 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 7.2 p -89.45 121.26 39.4 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 CA-C-O 121.847 0.832 . . . . 0.0 110.994 -176.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 . . . . . 0 C--N 1.296 -1.755 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.54 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo . . . . . 0 N--CA 1.448 -1.164 0 N-CA-C 112.918 0.315 . . . . 0.0 112.918 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.6 t -105.55 122.9 59.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.977 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.5 m -85.04 117.74 24.18 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -105.88 100.37 9.93 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 120.888 0.375 . . . . 0.0 110.995 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 71.2 m -90.0 99.96 12.87 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-O 121.573 0.702 . . . . 0.0 109.412 177.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 30.8 m -99.76 147.11 7.71 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.405 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -102.5 122.15 43.77 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.07 -176.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 C--N 1.309 -1.169 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 176.074 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo . . . . . 0 CA--C 1.546 1.09 0 N-CA-C 113.46 0.523 . . . . 0.0 113.46 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.4 m -116.2 126.45 53.65 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.257 0.551 . . . . 0.0 111.951 -174.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.8 t -91.45 130.42 40.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -116.11 111.33 20.11 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 85.0 m -94.01 97.36 10.28 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.762 0.792 . . . . 0.0 110.761 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 34.7 m -89.81 134.08 34.38 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 114.577 -1.192 . . . . 0.0 108.337 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 m -98.15 118.92 45.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 C-N-CA 120.071 -0.652 . . . . 0.0 111.289 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 . . . . . 0 C--N 1.299 -1.592 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.045 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo . . . . . 0 N--CA 1.442 -1.547 0 N-CA-C 113.082 0.378 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.3 t -119.46 140.01 44.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 O-C-N 121.876 -0.515 . . . . 0.0 111.11 -175.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.3 m -104.03 103.66 13.51 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 176.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -90.74 116.17 28.39 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.932 -177.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 73.8 m -98.23 101.19 12.57 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.2 m -99.18 131.54 46.27 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.336 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -104.17 98.73 8.5 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-O 122.077 0.941 . . . . 0.0 110.264 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.3 mt . . . . . 0 C--N 1.293 -1.877 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -179.216 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 N--CA 1.438 -1.786 0 CA-C-O 120.757 0.232 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.7 m -113.7 120.78 42.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 121.267 0.556 . . . . 0.0 110.441 -179.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.4 t -107.28 109.3 27.68 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.823 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -104.95 115.34 30.11 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.362 -178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 71.8 m -96.82 90.09 5.13 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-O 121.589 0.709 . . . . 0.0 109.166 176.24 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.3 m -95.42 127.08 41.17 Favored 'General case' 0 N--CA 1.424 -1.738 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.604 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.4 p -83.02 114.56 24.04 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.617 0 CA-C-O 121.882 0.849 . . . . 0.0 109.399 177.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 . . . . . 0 C--N 1.288 -2.099 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 179.068 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 N--CA 1.448 -1.175 0 N-CA-C 113.009 0.35 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.73 124.92 68.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 O-C-N 121.819 -0.55 . . . . 0.0 111.348 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 19.1 m -100.66 113.09 25.66 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -99.3 106.38 18.49 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 76.1 m -94.45 105.5 17.47 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.6 m -99.17 157.75 3.69 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.685 -179.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.6 ptp85 -114.85 134.92 54.74 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 121.728 0.775 . . . . 0.0 111.836 -176.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--N 1.291 -1.965 0 N-CA-C 104.441 -2.429 . . . . 0.0 104.441 171.942 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo . . . . . 0 CA--C 1.535 0.561 0 N-CA-C 113.291 0.458 . . . . 0.0 113.291 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.3 m -106.12 133.59 50.59 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.2 m -110.34 143.53 20.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.4 ttt180 -121.49 112.36 18.42 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 71.9 m -89.12 104.98 17.48 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-O 121.732 0.777 . . . . 0.0 110.124 177.018 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.9 m -99.39 111.47 23.83 Favored 'General case' 0 N--CA 1.418 -2.058 0 CA-C-N 114.527 -1.215 . . . . 0.0 108.509 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.437 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 8.7 p -91.51 122.5 42.98 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.284 0 CA-C-O 121.564 0.697 . . . . 0.0 109.956 -179.015 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 . . . . . 0 C--N 1.289 -2.043 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 179.78 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo . . . . . 0 CA--C 1.541 0.84 0 CA-C-O 121.041 0.351 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.0 t -107.82 126.72 64.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -176.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 39.8 m -114.21 116.08 28.48 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -96.02 100.79 12.42 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 72.5 m -93.34 105.66 17.71 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.461 0.648 . . . . 0.0 109.864 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -107.58 135.13 47.2 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.019 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -91.19 127.37 36.59 Favored 'General case' 0 C--N 1.298 -1.649 0 C-N-CA 119.938 -0.705 . . . . 0.0 110.054 178.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.5 mt . . . . . 0 C--N 1.293 -1.887 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 176.976 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo . . . . . 0 N--CA 1.446 -1.27 0 N-CA-C 112.764 0.255 . . . . 0.0 112.764 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.4 m -108.55 126.54 53.04 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.6 p -101.4 124.66 55.28 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.053 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 176.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -106.47 114.68 28.94 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 -178.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 88.5 m -99.86 98.62 9.39 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-O 121.462 0.649 . . . . 0.0 109.878 177.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.5 m -89.96 114.18 25.96 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.162 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.2 t -93.29 119.33 40.86 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.52 -176.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 . . . . . 0 C--N 1.295 -1.779 0 N-CA-C 107.389 -1.338 . . . . 0.0 107.389 176.099 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo . . . . . 0 N--CA 1.438 -1.772 0 N-CA-C 113.614 0.582 . . . . 0.0 113.614 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.7 t -117.04 129.13 74.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 119.923 -0.711 . . . . 0.0 112.206 -174.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.6 m -95.27 107.67 19.78 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 81.7 m95 -98.87 111.51 23.88 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 88.6 m -102.69 99.71 9.71 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 175.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -100.52 130.4 49.85 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.21 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -94.88 100.82 12.63 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.615 177.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.4 mt . . . . . 0 C--N 1.289 -2.053 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 178.492 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo . . . . . 0 N--CA 1.442 -1.539 0 N-CA-C 112.854 0.29 . . . . 0.0 112.854 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 p -111.93 156.1 22.63 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 122.28 -0.263 . . . . 0.0 111.301 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.7 p -125.58 138.25 55.03 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.547 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -119.48 117.95 29.79 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 175.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 99.9 m -102.36 96.29 6.85 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-O 121.391 0.615 . . . . 0.0 109.572 176.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.8 p -98.79 117.92 34.36 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.732 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.1 t -87.71 103.52 13.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 . . . . . 0 C--N 1.289 -2.031 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 -179.292 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 N--CA 1.443 -1.448 0 N-CA-C 112.733 0.244 . . . . 0.0 112.733 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.3 t -116.41 128.89 73.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 122.218 -0.301 . . . . 0.0 110.626 -175.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.4 m -104.34 119.71 39.57 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-O 121.048 0.451 . . . . 0.0 109.834 177.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -101.53 126.03 48.27 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 97.9 m -110.25 116.14 30.96 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 41.1 t -116.56 134.37 60.23 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -92.97 99.38 12.02 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 176.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.8 mt . . . . . 0 C--N 1.294 -1.829 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.671 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo . . . . . 0 N--CA 1.449 -1.116 0 CA-C-O 120.954 0.314 . . . . 0.0 111.776 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.7 m -98.21 119.97 37.81 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-O 121.247 0.546 . . . . 0.0 111.665 -172.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 49.7 t -86.78 110.76 20.66 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -114.98 134.11 55.46 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.755 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.3 m -116.12 125.28 52.14 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-O 121.208 0.527 . . . . 0.0 110.165 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.4 t -115.35 132.26 56.67 Favored 'General case' 0 N--CA 1.416 -2.159 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -96.58 119.26 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 CA-C-O 122.092 0.948 . . . . 0.0 110.825 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 20.0 mmm180 . . . . . 0 C--N 1.289 -2.052 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.19 179.252 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo . . . . . 0 N--CA 1.449 -1.113 0 N-CA-C 113.211 0.427 . . . . 0.0 113.211 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 32.4 t -113.37 130.85 66.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 CA-C-O 121.186 0.517 . . . . 0.0 111.083 -174.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 m -94.05 131.31 39.68 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . 0.419 ' CD1' ' HD3' ' A' ' 17' ' ' ARG . 95.4 m95 -118.32 103.58 9.93 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-O 121.196 0.522 . . . . 0.0 109.705 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 86.3 m -102.6 122.41 44.34 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.6 -179.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.5 m -114.13 130.08 68.97 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 173.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 50.0 ttp180 -90.44 96.57 10.72 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.994 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 43.5 mm . . . . . 0 C--N 1.299 -1.589 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 179.452 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo . . . . . 0 N--CA 1.44 -1.662 0 CA-C-O 121.163 0.401 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.0 m -103.19 123.31 46.47 Favored 'General case' 0 N--CA 1.424 -1.746 0 CA-C-O 121.203 0.525 . . . . 0.0 110.91 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.6 m -83.85 104.86 12.77 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.856 0 CA-C-O 121.907 0.86 . . . . 0.0 109.274 175.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -86.75 100.64 12.64 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 77.8 m -100.65 110.11 22.22 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.142 -176.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.7 t -102.16 150.89 22.82 Favored 'General case' 0 N--CA 1.414 -2.236 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 175.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.3 p -116.47 131.96 67.52 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.253 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.541 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.419 ' HD3' ' CD1' ' A' ' 4' ' ' TRP . 73.8 mtp180 . . . . . 0 N--CA 1.428 -1.559 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 176.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo . . . . . 0 N--CA 1.443 -1.448 0 CA-C-O 121.002 0.334 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.9 t -116.61 118.91 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.398 0 CA-C-O 121.502 0.668 . . . . 0.0 110.796 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 59.0 m -108.64 131.64 54.69 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 177.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 87.0 m95 -116.26 108.6 16.31 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 70.9 m -97.56 99.9 11.3 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.9 m -99.01 140.5 18.39 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.206 -178.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -104.58 101.97 11.6 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.392 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.5 mt . . . . . 0 C--N 1.302 -1.461 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -178.98 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 N--CA 1.454 -0.829 0 CA-C-O 120.8 0.25 . . . . 0.0 112.408 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 p -127.53 116.48 20.45 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -176.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 18.7 m -95.07 150.31 4.18 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 174.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -137.61 118.98 14.7 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 -179.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 96.7 m -100.92 101.0 11.71 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.586 176.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.8 t -93.14 119.84 32.78 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-O 121.382 0.61 . . . . 0.0 109.425 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 51.7 t -96.26 105.44 17.07 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.9 mtm180 . . . . . 0 C--N 1.295 -1.789 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.199 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo . . . . . 0 CA--C 1.544 1.016 0 CA-C-O 120.839 0.266 . . . . 0.0 112.62 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.8 t -92.73 142.71 12.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-O 120.838 0.351 . . . . 0.0 110.186 -173.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.7 m -127.38 126.55 42.67 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -112.04 118.92 36.74 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 94.0 m -101.41 99.29 9.61 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 121.998 0.904 . . . . 0.0 110.449 177.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 45.7 t -101.08 113.72 38.04 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.136 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.6 ptt-85 -86.07 110.31 19.43 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.855 0.836 . . . . 0.0 109.533 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 78.5 mt . . . . . 0 C--N 1.287 -2.125 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 178.486 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo . . . . . 0 CA--C 1.54 0.785 0 CA-C-O 120.828 0.262 . . . . 0.0 112.64 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.7 m -101.67 110.03 21.93 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 121.359 0.6 . . . . 0.0 111.855 -174.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 51.6 t -85.26 99.29 7.14 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.218 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 173.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.7 tpm_? -89.15 95.41 10.3 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -176.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 94.5 m -91.56 92.97 8.73 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.176 0.513 . . . . 0.0 109.703 176.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.9 t -91.32 138.96 31.18 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.571 -178.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.1 p -106.76 132.15 54.8 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.749 0 CA-C-O 121.232 0.539 . . . . 0.0 109.938 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 . . . . . 0 C--N 1.296 -1.737 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 177.965 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo . . . . . 0 N--CA 1.446 -1.306 0 N-CA-C 112.808 0.272 . . . . 0.0 112.808 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.1 t -108.35 132.2 56.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 -177.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 27.2 m -106.93 128.49 54.37 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -113.59 101.38 9.28 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 72.2 m -92.16 99.65 12.41 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.405 0.621 . . . . 0.0 110.472 178.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.9 m -109.96 165.98 5.34 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.009 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -127.22 137.57 52.93 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.489 178.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.0 mt -112.01 105.15 18.23 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.948 0 N-CA-C 105.094 -2.188 . . . . 0.0 105.094 175.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -88.42 -1.17 6.8 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.553 2.169 . . . . 0.0 112.59 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.3 m -105.35 124.82 50.18 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-O 121.261 0.553 . . . . 0.0 111.047 -175.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.7 t -101.32 137.17 29.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 -133.94 139.7 46.29 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.003 0.43 . . . . 0.0 110.353 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 72.6 m -110.01 105.36 14.46 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 177.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 18.9 m -91.06 126.21 36.08 Favored 'General case' 0 N--CA 1.422 -1.827 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 25.6 t -98.56 127.23 51.32 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.029 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.4 mmm180 -116.47 95.57 5.12 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo . . . . . 0 N--CA 1.444 -1.43 0 CA-C-O 120.482 0.117 . . . . 0.0 112.21 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.1 t -111.6 128.86 67.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 O-C-N 121.669 -0.645 . . . . 0.0 111.376 -176.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.5 m -92.19 116.07 28.63 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.55 ' CD1' ' HD3' ' A' ' 17' ' ' ARG . 92.8 m95 -102.62 113.04 26.08 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.397 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 72.7 m -106.65 111.11 23.5 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.2 t -116.65 126.8 74.28 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 N-CA-C 108.469 -0.938 . . . . 0.0 108.469 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.0 ptt180 -85.49 102.72 13.73 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-O 121.905 0.859 . . . . 0.0 109.863 178.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.8 mt -98.97 103.01 14.15 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.783 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -89.98 0.69 5.55 Favored 'Trans proline' 0 N--CA 1.449 -1.134 0 C-N-CA 122.367 2.045 . . . . 0.0 112.087 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.0 p -108.16 109.94 21.46 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-O 121.311 0.577 . . . . 0.0 111.675 -176.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.5 t -85.38 119.16 33.49 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 175.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.411 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 71.1 ttt180 -107.19 111.93 24.57 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.07 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 87.2 m -103.95 91.71 4.09 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.565 0.698 . . . . 0.0 109.838 176.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.3 m -111.76 128.21 56.03 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.217 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 27.4 m -81.79 140.92 15.8 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 CA-C-O 121.586 0.707 . . . . 0.0 111.861 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.55 ' HD3' ' CD1' ' A' ' 4' ' ' TRP . 70.1 mtp180 -126.08 102.68 7.34 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 175.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo . . . . . 0 N--CA 1.444 -1.388 0 N-CA-C 113.353 0.482 . . . . 0.0 113.353 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 40.3 t -116.83 119.5 62.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 O-C-N 121.544 -0.722 . . . . 0.0 111.069 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 34.6 m -93.58 112.52 24.42 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 176.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -93.51 111.02 22.59 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.525 ' HA ' ' O ' ' A' ' 13' ' ' ARG . 65.7 m -105.75 106.24 16.65 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-O 121.22 0.533 . . . . 0.0 109.789 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.1 p -98.9 142.43 14.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.367 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -117.53 128.76 55.28 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-O 121.22 0.533 . . . . 0.0 112.367 -174.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.6 mt -122.37 99.16 6.51 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 176.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -83.73 -5.12 10.73 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 122.421 2.081 . . . . 0.0 112.473 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.9 m -101.25 115.97 31.72 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 121.426 0.632 . . . . 0.0 110.941 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 61.2 t -105.39 129.45 58.24 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.525 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 93.6 mtt180 -112.49 115.07 28.07 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.1 m -98.91 103.77 15.76 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-O 121.432 0.634 . . . . 0.0 110.187 176.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.5 m -106.77 119.98 40.79 Favored 'General case' 0 C--N 1.298 -1.652 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.442 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 10.8 p -92.71 134.02 32.06 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.738 0 CA-C-O 121.475 0.655 . . . . 0.0 111.56 -176.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -120.17 96.1 5.02 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 174.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 CA--C 1.548 1.184 0 N-CA-C 113.079 0.376 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 25.7 t -108.33 136.9 42.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 O-C-N 121.95 -0.469 . . . . 0.0 110.303 -177.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.5 m -114.48 121.69 44.3 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -110.35 100.85 9.64 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 77.3 m -90.89 105.03 17.54 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.332 0.587 . . . . 0.0 109.545 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.1 m -103.06 153.69 5.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -118.19 121.17 39.81 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 121.789 0.804 . . . . 0.0 111.528 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 60.6 mt -105.51 102.06 13.3 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 178.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -94.96 3.97 2.5 Favored 'Trans proline' 0 N--CA 1.449 -1.123 0 C-N-CA 122.381 2.054 . . . . 0.0 112.44 177.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.0 m -104.76 121.05 42.8 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 121.088 0.47 . . . . 0.0 110.415 -177.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.3 p -94.59 136.2 26.54 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.774 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 177.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -129.52 127.89 41.7 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 76.9 m -104.89 102.36 11.89 Favored 'General case' 0 C--N 1.294 -1.827 0 CA-C-O 121.762 0.792 . . . . 0.0 111.346 -176.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.1 p -89.58 112.42 23.62 Favored 'General case' 0 N--CA 1.424 -1.744 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.945 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.7 t -91.02 128.6 42.72 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.198 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 -120.74 98.97 6.27 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo . . . . . 0 CA--C 1.539 0.774 0 N-CA-C 113.088 0.38 . . . . 0.0 113.088 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.7 t -111.61 147.43 15.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -177.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 28.8 m -128.0 134.49 49.26 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -118.33 112.63 20.29 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.9 m -105.69 118.94 37.86 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 120.917 0.389 . . . . 0.0 110.656 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.1 m -127.68 138.03 55.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.544 ' HA ' ' HA ' ' A' ' 12' ' ' VAL . 44.7 ttp85 -97.07 113.07 24.59 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-O 121.166 0.508 . . . . 0.0 110.799 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 46.5 mm -101.91 107.5 21.77 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.757 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -90.55 11.09 2.76 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.339 2.026 . . . . 0.0 112.678 179.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 p -126.21 121.45 32.78 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -177.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.544 ' HA ' ' HA ' ' A' ' 7' ' ' ARG . 7.1 p -95.57 128.36 46.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.097 0.475 . . . . 0.0 110.232 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.1 mtm180 -112.86 127.94 56.32 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 90.9 m -106.35 107.53 18.59 Favored 'General case' 0 C--N 1.289 -2.027 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.0 m -88.86 114.72 25.79 Favored 'General case' 0 N--CA 1.412 -2.368 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 -178.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.9 p -90.72 115.95 31.01 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.816 0 CA-C-O 121.461 0.648 . . . . 0.0 109.974 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -118.27 93.12 4.01 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo . . . . . 0 N--CA 1.439 -1.727 0 N-CA-C 112.295 0.075 . . . . 0.0 112.295 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.9 t -116.74 126.5 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.637 -174.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 49.1 m -99.05 108.64 21.35 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 175.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 78.5 m95 -89.94 106.57 18.56 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 74.6 m -105.08 111.86 24.79 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 121.56 0.695 . . . . 0.0 112.119 -178.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -105.3 140.45 23.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 175.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -116.54 126.99 54.12 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.608 -0.837 . . . . 0.0 111.506 -177.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.3 mp -107.55 91.28 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 177.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -84.43 -1.06 9.62 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.606 2.204 . . . . 0.0 113.015 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.2 m -101.45 126.64 48.26 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 120.867 0.365 . . . . 0.0 110.079 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 35.2 m -107.48 140.12 26.89 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 CA-C-O 120.971 0.415 . . . . 0.0 109.884 178.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -122.79 105.46 10.06 Favored 'General case' 0 C--N 1.29 -2.014 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 176.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 88.3 m -104.68 110.06 22.23 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.595 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.3 m -102.38 114.79 29.28 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 177.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 7.4 p -93.75 112.49 26.78 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.862 0 CA-C-O 122.272 1.034 . . . . 0.0 111.096 -178.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -120.23 115.8 24.33 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.26 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo . . . . . 0 N--CA 1.443 -1.483 0 CA-C-O 120.62 0.175 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.3 t -113.24 129.98 68.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 121.666 -0.646 . . . . 0.0 111.103 -176.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 58.0 m -100.18 114.82 28.52 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.686 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -104.09 117.08 33.4 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 80.7 m -103.53 111.18 23.52 Favored 'General case' 0 C--N 1.298 -1.65 0 C-N-CA 119.603 -0.839 . . . . 0.0 111.43 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p -104.03 135.08 43.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.193 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -90.09 121.14 31.88 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-O 121.218 0.533 . . . . 0.0 110.491 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.6 mt -117.62 94.66 3.21 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -84.85 -8.25 9.23 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.197 1.932 . . . . 0.0 112.648 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.7 p -114.53 130.82 56.79 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -174.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 45.0 t -103.71 121.8 55.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -105.13 122.65 46.33 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.187 -176.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 87.5 m -94.85 104.28 16.18 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.727 0.775 . . . . 0.0 110.491 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 41.1 p -89.84 109.58 20.57 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.646 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.7 t -86.33 115.84 28.13 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -110.31 102.24 10.91 Favored 'General case' 0 C--N 1.29 -1.999 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 CA--C 1.545 1.045 0 CA-C-O 121.342 0.476 . . . . 0.0 112.192 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.7 t -94.97 130.16 44.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 53.1 m -130.13 105.33 7.87 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-O 121.25 0.548 . . . . 0.0 110.936 -178.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -91.64 102.74 15.38 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.152 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 75.1 m -94.35 100.86 12.81 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-O 121.339 0.59 . . . . 0.0 109.412 177.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.0 p -106.42 131.28 56.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.807 -177.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -78.39 109.97 13.02 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.519 0.676 . . . . 0.0 110.657 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.3 tt -105.52 107.47 22.71 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.906 0 CA-C-N 114.433 -1.258 . . . . 0.0 107.731 177.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -91.43 6.4 3.64 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.604 2.203 . . . . 0.0 112.116 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.4 p -119.15 164.48 15.51 Favored 'General case' 0 C--N 1.309 -1.184 0 O-C-N 122.17 -0.331 . . . . 0.0 111.332 -176.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.7 t -119.19 124.19 72.65 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -105.74 109.98 22.12 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 73.6 m -92.08 107.86 19.52 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 121.69 0.757 . . . . 0.0 110.294 177.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.4 m -90.91 111.87 23.49 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-N 114.746 -1.116 . . . . 0.0 108.167 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.5 t -97.38 110.88 26.06 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 CA-C-O 121.241 0.543 . . . . 0.0 110.192 -176.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 32.8 mmt180 -110.98 92.73 4.16 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo . . . . . 0 N--CA 1.444 -1.405 0 CA-C-O 120.666 0.194 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.5 t -108.01 122.31 62.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -175.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 17.1 m -102.47 110.75 22.79 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 77.9 m95 -91.37 121.43 33.08 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 71.5 m -110.73 100.46 9.22 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 121.366 0.603 . . . . 0.0 110.871 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.6 p -99.63 126.59 52.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.549 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.529 ' HA ' ' HA ' ' A' ' 12' ' ' VAL . 40.0 ttm180 -91.04 114.75 27.36 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 120.884 0.373 . . . . 0.0 111.322 -176.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 63.9 mt -109.35 98.62 7.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 174.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -85.0 -6.75 9.45 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.666 2.244 . . . . 0.0 112.543 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.3 p -114.19 116.54 29.23 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -176.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.529 ' HA ' ' HA ' ' A' ' 7' ' ' ARG . 7.5 p -92.79 130.67 41.54 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.948 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 174.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -105.28 111.1 23.71 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 92.0 m -96.58 99.43 11.06 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.539 0.685 . . . . 0.0 110.153 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.4 m -96.13 116.77 29.49 Favored 'General case' 0 N--CA 1.416 -2.141 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.407 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 13.5 p -85.27 114.55 25.5 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 CA-C-O 121.864 0.84 . . . . 0.0 110.264 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -110.11 99.28 8.39 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo . . . . . 0 CA--C 1.542 0.894 0 CA-C-O 121.01 0.338 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 50.6 t -109.86 141.1 26.1 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -178.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 40.4 m -130.19 128.7 42.24 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.747 -0.595 . . . . 0.0 110.71 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -115.73 142.94 46.08 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 83.3 m -121.37 126.18 48.78 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-O 121.15 0.5 . . . . 0.0 110.441 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 55.0 t -99.26 124.84 52.8 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -100.68 118.74 37.41 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.51 -177.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 39.7 mt -128.65 89.42 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.402 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -87.34 -6.13 7.24 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.33 2.02 . . . . 0.0 111.546 176.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.4 m -91.64 129.52 37.6 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.429 -178.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.78 123.92 55.49 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-O 121.467 0.651 . . . . 0.0 109.573 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -115.25 114.14 24.82 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.828 -0.623 . . . . 0.0 109.807 -177.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 85.7 m -100.65 113.55 26.5 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 121.622 0.725 . . . . 0.0 109.965 177.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.4 m -101.33 128.36 47.53 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.744 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 31.3 m -89.5 133.79 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.532 0 CA-C-O 121.489 0.661 . . . . 0.0 110.736 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -125.46 81.55 1.98 Allowed 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 175.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo . . . . . 0 N--CA 1.447 -1.229 0 N-CA-C 113.686 0.61 . . . . 0.0 113.686 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 37.9 t -115.78 127.94 73.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 C-N-CA 119.707 -0.797 . . . . 0.0 111.805 -175.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 29.2 m -93.1 110.3 21.79 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -96.89 99.49 11.05 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 78.1 m -91.34 109.86 21.14 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.4 m -101.92 138.89 24.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.581 178.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -109.74 134.25 52.21 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.943 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 55.7 mt -138.73 96.9 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 N-CA-C 106.871 -1.529 . . . . 0.0 106.871 176.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -87.01 -4.14 7.95 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 122.223 1.949 . . . . 0.0 111.748 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 m -94.36 133.65 37.7 Favored 'General case' 0 N--CA 1.423 -1.794 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.336 -176.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.2 p -129.22 122.42 56.05 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -119.99 113.89 21.2 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.072 -177.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 81.7 m -92.73 101.7 14.1 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 121.929 0.871 . . . . 0.0 110.296 177.007 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.9 m -100.28 110.25 22.49 Favored 'General case' 0 N--CA 1.414 -2.266 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.172 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 7.2 p -89.45 121.26 39.4 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.002 0 CA-C-O 121.847 0.832 . . . . 0.0 110.994 -176.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -115.03 102.52 10.03 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo . . . . . 0 N--CA 1.448 -1.164 0 N-CA-C 112.918 0.315 . . . . 0.0 112.918 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.6 t -105.55 122.9 59.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.977 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.5 m -85.04 117.74 24.18 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -105.88 100.37 9.93 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 120.888 0.375 . . . . 0.0 110.995 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 71.2 m -90.0 99.96 12.87 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-O 121.573 0.702 . . . . 0.0 109.412 177.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 30.8 m -99.76 147.11 7.71 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.405 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -102.5 122.15 43.77 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.07 -176.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.7 mp -120.02 98.35 6.13 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 176.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -87.27 -2.8 7.82 Favored 'Trans proline' 0 CA--C 1.546 1.09 0 C-N-CA 122.379 2.053 . . . . 0.0 113.46 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.4 m -116.2 126.45 53.65 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.257 0.551 . . . . 0.0 111.951 -174.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 58.8 t -91.45 130.42 40.64 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 tpp180 -116.11 111.33 20.11 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 85.0 m -94.01 97.36 10.28 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.762 0.792 . . . . 0.0 110.761 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 34.7 m -89.81 134.08 34.38 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 114.577 -1.192 . . . . 0.0 108.337 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 m -98.15 118.92 45.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 C-N-CA 120.071 -0.652 . . . . 0.0 111.289 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.6 mmt180 -113.85 102.06 9.86 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 177.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo . . . . . 0 N--CA 1.442 -1.547 0 N-CA-C 113.082 0.378 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 46.3 t -119.46 140.01 44.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 O-C-N 121.876 -0.515 . . . . 0.0 111.11 -175.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.3 m -104.03 103.66 13.51 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 176.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -90.74 116.17 28.39 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.932 -177.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 73.8 m -98.23 101.19 12.57 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.2 m -99.18 131.54 46.27 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.336 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -104.17 98.73 8.5 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-O 122.077 0.941 . . . . 0.0 110.264 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.3 mt -106.0 106.02 19.8 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.877 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -91.49 14.97 1.78 Allowed 'Trans proline' 0 N--CA 1.438 -1.786 0 C-N-CA 122.454 2.102 . . . . 0.0 111.98 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.7 m -113.7 120.78 42.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 121.267 0.556 . . . . 0.0 110.441 -179.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.4 t -107.28 109.3 27.68 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.823 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -104.95 115.34 30.11 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.362 -178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 71.8 m -96.82 90.09 5.13 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-O 121.589 0.709 . . . . 0.0 109.166 176.24 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.3 m -95.42 127.08 41.17 Favored 'General case' 0 N--CA 1.424 -1.738 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.604 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.4 p -83.02 114.56 24.04 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.617 0 CA-C-O 121.882 0.849 . . . . 0.0 109.399 177.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 -116.91 116.77 28.06 Favored 'General case' 0 C--N 1.288 -2.099 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 N--CA 1.448 -1.175 0 N-CA-C 113.009 0.35 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 21.5 t -111.73 124.92 68.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 O-C-N 121.819 -0.55 . . . . 0.0 111.348 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 19.1 m -100.66 113.09 25.66 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -99.3 106.38 18.49 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 76.1 m -94.45 105.5 17.47 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.6 m -99.17 157.75 3.69 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.685 -179.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.6 ptp85 -114.85 134.92 54.74 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 121.728 0.775 . . . . 0.0 111.836 -176.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 3.5 mp -118.65 88.75 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.965 0 N-CA-C 104.441 -2.429 . . . . 0.0 104.441 171.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -81.86 -6.67 12.37 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 122.757 2.304 . . . . 0.0 113.291 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.3 m -106.12 133.59 50.59 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -175.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.2 m -110.34 143.53 20.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.4 ttt180 -121.49 112.36 18.42 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 71.9 m -89.12 104.98 17.48 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-O 121.732 0.777 . . . . 0.0 110.124 177.018 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 84.9 m -99.39 111.47 23.83 Favored 'General case' 0 N--CA 1.418 -2.058 0 CA-C-N 114.527 -1.215 . . . . 0.0 108.509 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.437 ' HA ' ' HA ' ' A' ' 3' ' ' THR . 8.7 p -91.51 122.5 42.98 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.284 0 CA-C-O 121.564 0.697 . . . . 0.0 109.956 -179.015 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -117.4 100.34 7.6 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo . . . . . 0 CA--C 1.541 0.84 0 CA-C-O 121.041 0.351 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.0 t -107.82 126.72 64.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -176.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 39.8 m -114.21 116.08 28.48 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.2 m95 -96.02 100.79 12.42 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 72.5 m -93.34 105.66 17.71 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.461 0.648 . . . . 0.0 109.864 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -107.58 135.13 47.2 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.019 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -91.19 127.37 36.59 Favored 'General case' 0 C--N 1.298 -1.649 0 C-N-CA 119.938 -0.705 . . . . 0.0 110.054 178.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.5 mt -119.83 89.65 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.887 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 176.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -87.83 1.06 6.94 Favored 'Trans proline' 0 N--CA 1.446 -1.27 0 C-N-CA 122.347 2.031 . . . . 0.0 112.764 178.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.4 m -108.55 126.54 53.04 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 7.6 p -101.4 124.66 55.28 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.053 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 176.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -106.47 114.68 28.94 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 -178.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 88.5 m -99.86 98.62 9.39 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-O 121.462 0.649 . . . . 0.0 109.878 177.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.5 m -89.96 114.18 25.96 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.162 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.2 t -93.29 119.33 40.86 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.52 -176.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -118.09 96.77 5.48 Favored 'General case' 0 C--N 1.295 -1.779 0 N-CA-C 107.389 -1.338 . . . . 0.0 107.389 176.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo . . . . . 0 N--CA 1.438 -1.772 0 N-CA-C 113.614 0.582 . . . . 0.0 113.614 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.7 t -117.04 129.13 74.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 119.923 -0.711 . . . . 0.0 112.206 -174.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 29.6 m -95.27 107.67 19.78 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 81.7 m95 -98.87 111.51 23.88 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 88.6 m -102.69 99.71 9.71 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 175.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -100.52 130.4 49.85 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.144 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.21 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -94.88 100.82 12.63 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.615 177.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 67.4 mt -94.42 109.27 21.89 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.053 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 178.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -97.36 9.75 1.21 Allowed 'Trans proline' 0 N--CA 1.442 -1.539 0 C-N-CA 122.739 2.293 . . . . 0.0 112.854 176.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 p -111.93 156.1 22.63 Favored 'General case' 0 C--N 1.318 -0.793 0 O-C-N 122.28 -0.263 . . . . 0.0 111.301 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.7 p -125.58 138.25 55.03 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.547 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -119.48 117.95 29.79 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 175.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 99.9 m -102.36 96.29 6.85 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-O 121.391 0.615 . . . . 0.0 109.572 176.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.8 p -98.79 117.92 34.36 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.732 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.1 t -87.71 103.52 13.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -100.22 104.12 15.61 Favored 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 N--CA 1.443 -1.448 0 N-CA-C 112.733 0.244 . . . . 0.0 112.733 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 38.3 t -116.41 128.89 73.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 122.218 -0.301 . . . . 0.0 110.626 -175.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.4 m -104.34 119.71 39.57 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-O 121.048 0.451 . . . . 0.0 109.834 177.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -101.53 126.03 48.27 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 97.9 m -110.25 116.14 30.96 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 41.1 t -116.56 134.37 60.23 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -92.97 99.38 12.02 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 176.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.8 mt -92.09 111.47 24.25 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.829 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -98.2 1.11 1.32 Allowed 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 122.439 2.093 . . . . 0.0 111.776 174.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.7 m -98.21 119.97 37.81 Favored 'General case' 0 N--CA 1.429 -1.505 0 CA-C-O 121.247 0.546 . . . . 0.0 111.665 -172.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 49.7 t -86.78 110.76 20.66 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -114.98 134.11 55.46 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.755 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 77.3 m -116.12 125.28 52.14 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-O 121.208 0.527 . . . . 0.0 110.165 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.4 t -115.35 132.26 56.67 Favored 'General case' 0 N--CA 1.416 -2.159 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -96.58 119.26 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 CA-C-O 122.092 0.948 . . . . 0.0 110.825 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 20.0 mmm180 -115.38 100.34 8.03 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.19 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo . . . . . 0 N--CA 1.449 -1.113 0 N-CA-C 113.211 0.427 . . . . 0.0 113.211 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 32.4 t -113.37 130.85 66.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 CA-C-O 121.186 0.517 . . . . 0.0 111.083 -174.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 m -94.05 131.31 39.68 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . 0.419 ' CD1' ' HD3' ' A' ' 17' ' ' ARG . 95.4 m95 -118.32 103.58 9.93 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-O 121.196 0.522 . . . . 0.0 109.705 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 86.3 m -102.6 122.41 44.34 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.6 -179.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.5 m -114.13 130.08 68.97 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 173.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 50.0 ttp180 -90.44 96.57 10.72 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.994 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 43.5 mm -90.32 113.31 26.15 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -100.5 5.65 0.72 Allowed 'Trans proline' 0 N--CA 1.44 -1.662 0 C-N-CA 122.705 2.27 . . . . 0.0 111.298 175.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 27.0 m -103.19 123.31 46.47 Favored 'General case' 0 N--CA 1.424 -1.746 0 CA-C-O 121.203 0.525 . . . . 0.0 110.91 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.6 m -83.85 104.86 12.77 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.856 0 CA-C-O 121.907 0.86 . . . . 0.0 109.274 175.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -86.75 100.64 12.64 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 77.8 m -100.65 110.11 22.22 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.142 -176.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.7 t -102.16 150.89 22.82 Favored 'General case' 0 N--CA 1.414 -2.236 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 175.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.3 p -116.47 131.96 67.52 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.253 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.541 -177.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.419 ' HD3' ' CD1' ' A' ' 4' ' ' TRP . 73.8 mtp180 -119.04 102.92 9.1 Favored 'General case' 0 N--CA 1.428 -1.559 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 176.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo . . . . . 0 N--CA 1.443 -1.448 0 CA-C-O 121.002 0.334 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 20.9 t -116.61 118.91 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.398 0 CA-C-O 121.502 0.668 . . . . 0.0 110.796 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 59.0 m -108.64 131.64 54.69 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 177.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 87.0 m95 -116.26 108.6 16.31 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 70.9 m -97.56 99.9 11.3 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 29.9 m -99.01 140.5 18.39 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.206 -178.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -104.58 101.97 11.6 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.392 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.5 mt -108.12 101.29 12.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -94.44 7.73 2.27 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.853 2.368 . . . . 0.0 112.408 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 p -127.53 116.48 20.45 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -176.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 18.7 m -95.07 150.31 4.18 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 174.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -137.61 118.98 14.7 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 -179.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 96.7 m -100.92 101.0 11.71 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.586 176.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.8 t -93.14 119.84 32.78 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-O 121.382 0.61 . . . . 0.0 109.425 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 51.7 t -96.26 105.44 17.07 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.409 ' HA ' ' HD2' ' A' ' 18' ' ' DPR . 52.9 mtm180 -118.73 104.04 10.22 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . 0.409 ' HD2' ' HA ' ' A' ' 17' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo . . . . . 0 CA--C 1.544 1.016 0 CA-C-O 120.839 0.266 . . . . 0.0 112.62 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.8 t -92.73 142.71 12.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-O 120.838 0.351 . . . . 0.0 110.186 -173.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.7 m -127.38 126.55 42.67 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -112.04 118.92 36.74 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . 94.0 m -101.41 99.29 9.61 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 121.998 0.904 . . . . 0.0 110.449 177.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 45.7 t -101.08 113.72 38.04 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.136 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.6 ptt-85 -86.07 110.31 19.43 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.855 0.836 . . . . 0.0 109.533 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 78.5 mt -107.86 100.69 11.25 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.125 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -88.75 -4.43 6.3 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.733 2.288 . . . . 0.0 112.64 177.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.7 m -101.67 110.03 21.93 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 121.359 0.6 . . . . 0.0 111.855 -174.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 51.6 t -85.26 99.29 7.14 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.218 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 173.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.7 tpm_? -89.15 95.41 10.3 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -176.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 5' ' ' CYS . 94.5 m -91.56 92.97 8.73 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.176 0.513 . . . . 0.0 109.703 176.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 8.9 t -91.32 138.96 31.18 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.571 -178.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.1 p -106.76 132.15 54.8 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.749 0 CA-C-O 121.232 0.539 . . . . 0.0 109.938 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -128.14 100.42 5.85 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_