data_2m1p_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 2m1p _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.8 t . . . . . 0 N--CA 1.442 -0.852 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.5 m -89.95 123.97 34.32 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-O 121.752 0.787 . . . . 0.0 110.239 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 . . . . . 0 C--N 1.289 -2.028 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.36 -176.583 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.435 -1.204 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 59.5 m -106.42 131.2 53.9 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.355 -178.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -138.33 120.84 16.12 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 63.97 29.79 14.31 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.364 1.066 . . . . 0.0 109.543 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.62 1.95 90.35 Favored Glycine 0 N--CA 1.441 -1.016 0 CA-C-N 115.168 -0.924 . . . . 0.0 112.479 -178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.5 t -99.56 111.87 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.6 m -92.72 124.94 37.1 Favored 'General case' 0 C--N 1.289 -2.028 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.134 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 . . . . . 0 C--N 1.284 -2.243 0 CA-C-N 114.691 -1.141 . . . . 0.0 109.965 -179.63 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.6 m . . . . . 0 N--CA 1.439 -0.991 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.7 m -111.33 131.52 55.11 Favored 'General case' 0 C--N 1.287 -2.13 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.183 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 . . . . . 0 N--CA 1.424 -1.741 0 CA-C-O 121.183 0.516 . . . . 0.0 110.122 -174.579 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 68.8 t . . . . . 0 CA--C 1.5 -0.974 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.9 m -97.45 125.16 41.94 Favored 'General case' 0 C--N 1.285 -2.205 0 C-N-CA 119.235 -0.986 . . . . 0.0 111.552 -179.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 . . . . . 0 C--N 1.283 -2.298 0 CA-C-N 114.328 -1.305 . . . . 0.0 109.432 178.755 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.8 m -124.95 139.3 53.95 Favored 'General case' 0 C--N 1.288 -2.074 0 C-N-CA 118.544 -1.262 . . . . 0.0 111.397 -177.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -153.65 127.46 8.84 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.292 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 62.44 32.45 16.73 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.584 1.154 . . . . 0.0 110.125 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.73 0.04 89.82 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.578 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.8 t -107.44 119.55 57.24 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.029 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.1 m -98.28 123.84 42.58 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.795 0.807 . . . . 0.0 110.872 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? . . . . . 0 C--N 1.285 -2.227 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.228 -179.892 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 99.0 t . . . . . 0 N--CA 1.427 -1.62 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 64.9 m -95.23 123.3 38.66 Favored 'General case' 0 C--N 1.29 -2.021 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 . . . . . 0 C--N 1.293 -1.871 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.042 -175.904 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 N--CA 1.439 -1.015 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.1 m -95.85 128.96 43.18 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.8 tpm_? . . . . . 0 C--N 1.297 -1.682 0 CA-C-N 113.927 -1.488 . . . . 0.0 107.865 178.303 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.439 -0.981 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.8 m -99.88 124.55 45.31 Favored 'General case' 0 C--N 1.291 -1.955 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.414 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -136.7 118.8 15.43 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.778 -175.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 59.45 34.76 22.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.721 1.248 . . . . 0.0 110.573 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.55 -8.42 74.52 Favored Glycine 0 N--CA 1.43 -1.727 0 CA-C-N 114.511 -1.222 . . . . 0.0 113.733 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.9 t -108.44 116.55 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 117.359 0.579 . . . . 0.0 109.672 -176.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 64.9 m -84.44 115.96 22.83 Favored 'General case' 0 N--CA 1.419 -2.0 0 CA-C-O 121.917 0.865 . . . . 0.0 110.119 175.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? . . . . . 0 C--N 1.283 -2.296 0 CA-C-N 113.65 -1.614 . . . . 0.0 108.703 -178.162 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.1 m . . . . . 0 N--CA 1.432 -1.331 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.0 m -111.33 130.39 55.69 Favored 'General case' 0 C--N 1.283 -2.308 0 C-N-CA 119.861 -0.735 . . . . 0.0 110.606 -176.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 . . . . . 0 N--CA 1.432 -1.37 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -177.581 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 92.0 t . . . . . 0 C--O 1.239 0.52 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 90.4 m -95.7 129.86 42.78 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 121.255 0.55 . . . . 0.0 110.68 176.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 . . . . . 0 C--N 1.279 -2.479 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.668 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.43 -1.45 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 55.6 m -108.64 139.3 43.61 Favored 'General case' 0 C--N 1.288 -2.072 0 C-N-CA 119.974 -0.691 . . . . 0.0 109.782 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -151.32 134.04 15.64 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.706 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 49.0 ttp180 61.78 25.0 14.98 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.182 0.991 . . . . 0.0 109.764 -178.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.56 -3.37 87.26 Favored Glycine 0 N--CA 1.439 -1.157 0 CA-C-N 115.131 -0.941 . . . . 0.0 112.602 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.9 t -103.55 126.85 57.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -176.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.2 m -96.0 130.83 42.89 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.77 0.795 . . . . 0.0 112.074 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 . . . . . 0 C--N 1.297 -1.702 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.812 -178.808 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.0 t . . . . . 0 N--CA 1.438 -1.051 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 78.4 m -106.17 132.63 52.01 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.111 -178.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 . . . . . 0 CA--C 1.502 -0.888 0 O-C-N 123.415 0.447 . . . . 0.0 110.717 179.492 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 50.1 t . . . . . 0 N--CA 1.437 -1.08 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.8 m -90.58 121.71 32.74 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-O 121.335 0.588 . . . . 0.0 110.306 179.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 . . . . . 0 C--N 1.288 -2.098 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.179 -179.798 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.9 t . . . . . 0 C--O 1.244 0.815 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 40.5 m -96.93 123.91 40.76 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-O 121.242 0.544 . . . . 0.0 110.826 -177.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 75.3 mtt180 -134.0 121.52 21.72 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.459 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 63.62 30.72 14.88 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 122.672 1.225 . . . . 0.0 110.037 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.18 8.78 87.6 Favored Glycine 0 C--N 1.308 -1.004 0 CA-C-N 115.021 -0.99 . . . . 0.0 112.028 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.9 t -107.29 108.37 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.7 m -91.3 117.47 29.68 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-O 121.497 0.665 . . . . 0.0 111.011 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 . . . . . 0 C--N 1.275 -2.646 0 CA-C-N 114.856 -1.066 . . . . 0.0 109.142 177.363 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.432 -1.364 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.6 m -101.14 124.92 47.6 Favored 'General case' 0 C--N 1.29 -2.0 0 C-N-CA 119.653 -0.819 . . . . 0.0 109.532 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 . . . . . 0 C--N 1.303 -1.433 0 CA-C-N 115.444 -0.798 . . . . 0.0 108.901 -176.063 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 51.5 t . . . . . 0 CA--C 1.497 -1.093 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 85.2 m -105.45 135.61 46.53 Favored 'General case' 0 C--N 1.282 -2.362 0 C-N-CA 119.584 -0.846 . . . . 0.0 112.929 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 . . . . . 0 C--N 1.297 -1.712 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.875 175.332 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.435 -1.204 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 55.7 m -110.78 134.04 52.84 Favored 'General case' 0 C--N 1.284 -2.261 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.065 -178.308 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 65.0 mtm180 -132.24 116.63 17.18 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 59.75 33.93 21.89 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 122.048 0.928 . . . . 0.0 110.237 178.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.01 -2.88 87.2 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.844 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.7 t -101.96 114.8 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.7 m -92.49 126.84 37.75 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-O 121.682 0.753 . . . . 0.0 111.564 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.3 tpt85 . . . . . 0 C--N 1.287 -2.136 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.195 179.135 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.7 m . . . . . 0 N--CA 1.428 -1.575 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.3 m -108.38 144.43 35.96 Favored 'General case' 0 C--N 1.284 -2.246 0 C-N-CA 119.744 -0.782 . . . . 0.0 111.182 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 . . . . . 0 N--CA 1.44 -0.936 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 175.912 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.447 -0.609 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 88.3 m -96.03 121.87 38.25 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-O 121.516 0.674 . . . . 0.0 110.323 176.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 . . . . . 0 C--N 1.279 -2.493 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.257 -178.89 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p . . . . . 0 N--CA 1.429 -1.515 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.2 m -115.29 136.69 52.83 Favored 'General case' 0 C--N 1.294 -1.838 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.942 -178.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -129.52 109.64 11.2 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.337 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 63.06 29.03 16.33 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.662 1.185 . . . . 0.0 110.032 178.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.73 -13.1 59.47 Favored Glycine 0 N--CA 1.434 -1.463 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.844 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.7 t -91.75 111.39 23.97 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.001 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 -177.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.3 m -93.82 131.07 39.57 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 119.691 -0.803 . . . . 0.0 111.944 -178.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 . . . . . 0 C--N 1.29 -1.994 0 CA-C-N 114.473 -1.239 . . . . 0.0 110.123 178.03 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 N--CA 1.437 -1.086 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 69.9 m -100.08 122.26 42.67 Favored 'General case' 0 C--N 1.289 -2.06 0 C-N-CA 119.524 -0.87 . . . . 0.0 109.662 178.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 . . . . . 0 C--N 1.302 -1.463 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.559 -177.761 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 CA--C 1.508 -0.641 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 77.2 m -100.56 132.36 45.99 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.705 0.764 . . . . 0.0 112.706 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? . . . . . 0 C--N 1.292 -1.907 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.485 177.059 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 N--CA 1.44 -0.952 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.9 m -101.81 128.07 48.33 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 120.273 -0.571 . . . . 0.0 111.019 -177.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 28.8 mmm180 -136.55 127.71 27.99 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.812 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.2 tpp180 60.85 31.92 20.05 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 122.128 0.966 . . . . 0.0 110.629 175.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.81 14.61 81.85 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.584 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.3 t -122.02 119.82 59.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.7 m -91.19 119.28 31.15 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-O 121.933 0.873 . . . . 0.0 112.166 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 . . . . . 0 C--N 1.279 -2.468 0 CA-C-N 113.96 -1.473 . . . . 0.0 108.337 179.838 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.4 t . . . . . 0 N--CA 1.434 -1.27 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 70.0 m -125.11 133.88 52.68 Favored 'General case' 0 C--N 1.288 -2.102 0 C-N-CA 119.801 -0.76 . . . . 0.0 109.717 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 . . . . . 0 N--CA 1.433 -1.304 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -176.981 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.0 t . . . . . 0 CA--C 1.51 -0.575 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 78.2 m -96.48 124.81 40.59 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.634 0.731 . . . . 0.0 111.669 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 . . . . . 0 C--N 1.292 -1.897 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.671 -178.419 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 N--CA 1.442 -0.861 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 77.6 m -106.58 137.12 45.16 Favored 'General case' 0 C--N 1.288 -2.086 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.13 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -145.15 119.3 9.46 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.16 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 59.57 35.58 22.63 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.927 0.891 . . . . 0.0 110.959 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.48 11.29 85.63 Favored Glycine 0 C--N 1.313 -0.73 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.442 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.92 114.33 46.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.0 m -101.35 131.62 47.33 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.748 0.785 . . . . 0.0 112.533 -178.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 . . . . . 0 C--N 1.287 -2.118 0 CA-C-N 113.978 -1.465 . . . . 0.0 109.133 177.239 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m . . . . . 0 N--CA 1.44 -0.939 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 62.2 m -104.08 124.8 49.72 Favored 'General case' 0 C--N 1.284 -2.242 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.093 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 . . . . . 0 N--CA 1.433 -1.312 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -176.061 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 55.3 t . . . . . 0 N--CA 1.442 -0.831 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.452 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 79.8 m -92.89 130.19 38.56 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 121.312 0.577 . . . . 0.0 111.723 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 . . . . . 0 C--N 1.294 -1.843 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.807 179.634 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.441 -0.895 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.9 m -113.7 130.76 56.37 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.085 -176.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.4 mtm180 -135.3 126.26 27.68 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 59.02 36.39 24.36 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-O 122.089 0.947 . . . . 0.0 110.504 177.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.86 14.32 78.44 Favored Glycine 0 C--O 1.245 0.795 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.67 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 51.0 t -118.69 118.8 59.06 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 78.8 m -93.2 130.07 39.01 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-O 121.64 0.733 . . . . 0.0 111.94 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 . . . . . 0 C--N 1.299 -1.604 0 CA-C-N 114.564 -1.198 . . . . 0.0 108.951 179.968 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 56.7 t . . . . . 0 N--CA 1.436 -1.137 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.452 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.5 m -101.47 133.31 46.3 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 120.822 0.344 . . . . 0.0 110.891 -179.136 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 ptp180 . . . . . 0 N--CA 1.433 -1.288 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.854 -177.698 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.4 t . . . . . 0 N--CA 1.435 -1.206 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.6 m -94.38 127.88 40.55 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 121.344 0.592 . . . . 0.0 110.52 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 . . . . . 0 C--N 1.281 -2.376 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.842 -179.647 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.427 -1.619 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 59.7 m -98.62 123.4 42.79 Favored 'General case' 0 C--N 1.286 -2.165 0 C-N-CA 119.43 -0.908 . . . . 0.0 110.071 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.5 ptp180 -148.47 137.77 21.91 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.967 -177.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 42.3 ttt180 66.37 26.32 10.21 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 122.455 1.122 . . . . 0.0 109.735 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.01 15.69 81.44 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 114.567 -1.197 . . . . 0.0 112.573 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.1 t -129.11 129.86 67.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 72.3 m -92.19 125.68 36.96 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.555 0.693 . . . . 0.0 110.732 177.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? . . . . . 0 C--N 1.295 -1.792 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.551 -178.384 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 m . . . . . 0 N--CA 1.43 -1.443 0 CA-C-O 121.471 0.653 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 70.1 m -102.44 134.82 45.14 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.83 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 . . . . . 0 C--N 1.313 -0.996 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.206 -179.595 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.1 t . . . . . 0 N--CA 1.446 -0.674 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 61.4 m -88.53 113.9 24.6 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 122.726 1.25 . . . . 0.0 111.97 -178.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 32.1 tpt180 . . . . . 0 C--N 1.287 -2.148 0 CA-C-N 113.268 -1.787 . . . . 0.0 109.446 -176.168 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.1 t . . . . . 0 N--CA 1.437 -1.116 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 49.2 m -99.15 135.58 40.34 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-O 120.944 0.402 . . . . 0.0 110.838 -178.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -139.19 120.35 14.69 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 58.83 36.59 24.78 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 122.174 0.988 . . . . 0.0 110.987 176.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.14 -2.25 87.62 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.262 -0.881 . . . . 0.0 113.444 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.7 t -109.35 126.08 66.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.3 m -99.63 131.54 45.55 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.641 -178.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 . . . . . 0 C--N 1.297 -1.684 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.674 179.912 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.435 -1.222 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 36.3 m -95.01 124.06 38.84 Favored 'General case' 0 C--N 1.285 -2.226 0 CA-C-O 121.586 0.708 . . . . 0.0 110.422 -177.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 30.6 mmm180 . . . . . 0 N--CA 1.424 -1.726 0 CA-C-N 114.443 -1.253 . . . . 0.0 107.784 -175.517 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 56.9 t . . . . . 0 N--CA 1.443 -0.804 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 82.6 m -86.44 131.56 34.16 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 121.642 0.734 . . . . 0.0 111.851 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 . . . . . 0 C--N 1.291 -1.956 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.994 -179.151 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.428 -1.53 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 46.7 m -105.28 136.74 44.25 Favored 'General case' 0 C--N 1.287 -2.152 0 C-N-CA 119.771 -0.771 . . . . 0.0 111.051 -177.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 78.8 mtp180 -129.78 109.19 10.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 55.43 42.64 29.79 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 124.82 1.248 . . . . 0.0 111.187 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.9 -5.54 84.74 Favored Glycine 0 N--CA 1.442 -0.949 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.873 177.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 48.2 t -101.31 108.98 24.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -179.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 65.3 m -90.75 129.7 36.8 Favored 'General case' 0 C--N 1.296 -1.723 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.074 -179.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 . . . . . 0 C--N 1.294 -1.814 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.251 179.495 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.3 m . . . . . 0 N--CA 1.437 -1.095 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 53.8 m -116.27 128.99 56.05 Favored 'General case' 0 C--N 1.281 -2.382 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.086 -177.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 . . . . . 0 C--N 1.301 -1.51 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.746 -177.776 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 48.7 t . . . . . 0 N--CA 1.447 -0.585 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 72.4 m -101.79 124.76 47.97 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 121.813 0.816 . . . . 0.0 111.012 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 5.2 tpm_? . . . . . 0 C--N 1.281 -2.378 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.216 -178.413 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.417 -2.096 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 50.2 m -96.64 127.91 43.08 Favored 'General case' 0 C--N 1.277 -2.564 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.831 -178.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -120.07 109.05 15.02 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.656 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 46.93 51.81 12.31 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 124.595 1.184 . . . . 0.0 111.169 178.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.55 -0.24 86.72 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.181 -0.918 . . . . 0.0 114.168 174.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.3 t -116.04 114.63 46.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 117.748 0.774 . . . . 0.0 108.916 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.2 m -91.0 127.5 36.45 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 . . . . . 0 C--N 1.298 -1.656 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.743 179.05 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.6 m . . . . . 0 N--CA 1.439 -1.02 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.5 m -112.41 139.24 48.15 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 120.211 -0.595 . . . . 0.0 110.029 -179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 . . . . . 0 C--N 1.308 -1.224 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.115 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 CA--C 1.504 -0.813 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 73.4 m -97.92 126.91 43.54 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-O 121.544 0.688 . . . . 0.0 112.724 -175.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 . . . . . 0 C--N 1.296 -1.758 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.465 179.697 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 99.3 t . . . . . 0 N--CA 1.438 -1.026 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.8 m -96.7 129.94 44.02 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -152.71 128.98 10.51 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.494 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 63.47 31.15 15.11 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 122.246 1.022 . . . . 0.0 110.473 176.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.69 10.03 86.2 Favored Glycine 0 C--N 1.31 -0.899 0 CA-C-N 115.318 -0.856 . . . . 0.0 112.083 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.5 t -115.98 120.5 65.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.2 m -100.41 116.35 32.17 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-O 121.85 0.833 . . . . 0.0 110.898 177.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 . . . . . 0 C--N 1.278 -2.517 0 CA-C-N 114.299 -1.318 . . . . 0.0 109.215 -177.925 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.432 -1.352 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 58.0 m -102.02 135.86 42.86 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.342 -177.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 . . . . . 0 C--N 1.308 -1.209 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.525 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 56.4 t . . . . . 0 N--CA 1.442 -0.856 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.3 m -102.67 115.7 31.1 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 121.665 0.745 . . . . 0.0 110.721 178.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 . . . . . 0 C--N 1.277 -2.584 0 CA-C-N 114.21 -1.359 . . . . 0.0 108.992 -177.846 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 34.9 m . . . . . 0 N--CA 1.437 -1.077 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 35.3 m -114.62 133.44 55.83 Favored 'General case' 0 C--N 1.282 -2.339 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.244 -179.078 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -123.49 109.85 14.35 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 62.8 30.68 16.69 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 122.353 1.073 . . . . 0.0 109.263 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.47 -11.95 70.53 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 114.924 -1.035 . . . . 0.0 112.592 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.16 112.85 27.65 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.887 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -176.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 72.0 m -88.46 132.29 34.54 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-O 121.776 0.798 . . . . 0.0 113.04 -175.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 . . . . . 0 C--N 1.293 -1.865 0 CA-C-N 113.881 -1.509 . . . . 0.0 107.257 173.98 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.4 p . . . . . 0 N--CA 1.433 -1.293 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 65.7 m -106.81 135.29 48.6 Favored 'General case' 0 C--N 1.288 -2.08 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.145 178.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 . . . . . 0 N--CA 1.432 -1.362 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.485 -178.494 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.6 t . . . . . 0 CA--C 1.507 -0.693 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 74.7 m -95.89 132.11 41.52 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 119.722 -0.791 . . . . 0.0 112.841 -177.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.6 tpm_? . . . . . 0 C--N 1.3 -1.549 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.293 179.534 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.5 p . . . . . 0 N--CA 1.435 -1.192 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 29.1 m -105.8 138.58 41.75 Favored 'General case' 0 C--N 1.293 -1.88 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.729 -177.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -138.53 123.93 19.42 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.534 -178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 61.3 25.09 15.12 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 122.834 1.302 . . . . 0.0 110.428 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.94 -1.97 81.29 Favored Glycine 0 C--N 1.301 -1.404 0 CA-C-N 114.856 -1.065 . . . . 0.0 113.209 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.0 t -106.05 127.99 60.74 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 -179.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 66.6 m -94.62 129.82 41.33 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.714 0.768 . . . . 0.0 111.794 -177.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 . . . . . 0 C--N 1.297 -1.676 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.509 -176.57 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.439 -0.979 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 60.5 m -109.39 131.87 54.66 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 119.851 -0.739 . . . . 0.0 110.153 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 . . . . . 0 N--CA 1.428 -1.558 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.801 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 70.8 t . . . . . 0 N--CA 1.445 -0.692 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 70.9 m -98.81 122.42 42.03 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-O 121.613 0.72 . . . . 0.0 110.072 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? . . . . . 0 C--N 1.277 -2.555 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.037 -177.096 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.4 m . . . . . 0 N--CA 1.437 -1.104 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 34.7 m -100.18 121.72 41.89 Favored 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 119.545 -0.862 . . . . 0.0 110.98 -175.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -127.64 121.96 31.84 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 114.497 -1.229 . . . . 0.0 107.79 -176.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 64.32 27.7 13.75 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.228 1.013 . . . . 0.0 109.542 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.53 9.18 87.25 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.037 -0.983 . . . . 0.0 112.715 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.0 t -111.81 130.24 65.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 58.4 m -99.8 116.66 32.39 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 122.139 0.971 . . . . 0.0 112.203 -175.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 . . . . . 0 C--N 1.288 -2.085 0 CA-C-N 113.88 -1.509 . . . . 0.0 109.887 -177.603 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.9 t . . . . . 0 N--CA 1.443 -0.814 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.5 m -103.94 133.95 48.04 Favored 'General case' 0 C--N 1.295 -1.791 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.834 -178.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.199 -177.799 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.0 t . . . . . 0 N--CA 1.445 -0.683 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 78.4 m -95.79 124.56 39.86 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 121.473 0.654 . . . . 0.0 110.948 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 . . . . . 0 C--N 1.284 -2.28 0 CA-C-N 114.572 -1.194 . . . . 0.0 108.296 -179.693 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.0 m . . . . . 0 N--CA 1.439 -1.025 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 75.5 m -130.91 138.55 49.83 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -137.29 109.77 7.43 Favored 'General case' 0 N--CA 1.422 -1.87 0 CA-C-O 120.924 0.392 . . . . 0.0 110.273 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 57.41 41.15 26.7 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 122.772 1.272 . . . . 0.0 110.531 178.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.22 -9.13 78.43 Favored Glycine 0 N--CA 1.436 -1.301 0 CA-C-N 114.6 -1.182 . . . . 0.0 113.086 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.1 t -99.98 110.1 26.32 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 70.7 m -90.24 128.7 36.46 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-O 121.374 0.607 . . . . 0.0 110.742 178.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 . . . . . 0 C--N 1.293 -1.871 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.886 -176.411 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 40.5 t . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 85.8 m -102.12 131.06 48.84 Favored 'General case' 0 C--N 1.293 -1.864 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.026 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 . . . . . 0 N--CA 1.435 -1.217 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.021 -175.584 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 N--CA 1.443 -0.807 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 85.8 m -96.62 128.93 44.03 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-O 121.762 0.791 . . . . 0.0 111.325 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 . . . . . 0 C--N 1.296 -1.726 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.736 -177.819 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.7 m . . . . . 0 N--CA 1.442 -0.849 0 CA-C-O 121.069 0.462 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -94.17 136.27 34.64 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-O 122.166 0.984 . . . . 0.0 112.491 -178.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -135.37 116.67 14.55 Favored 'General case' 0 N--CA 1.416 -2.131 0 CA-C-N 113.508 -1.678 . . . . 0.0 108.054 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? 56.65 40.03 29.48 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 122.177 0.989 . . . . 0.0 110.578 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.12 0.97 90.2 Favored Glycine 0 C--N 1.314 -0.68 0 CA-C-N 115.18 -0.918 . . . . 0.0 113.413 176.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.68 120.27 62.4 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 6.0 m -86.58 129.8 34.73 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-O 122.533 1.159 . . . . 0.0 113.773 178.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 . . . . . 0 C--N 1.278 -2.543 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.966 177.01 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 N--CA 1.442 -0.838 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 58.1 m -112.54 137.65 50.46 Favored 'General case' 0 C--N 1.292 -1.924 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.233 -178.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 . . . . . 0 C--N 1.312 -1.036 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -179.039 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.044 0 CA-C-O 120.27 -0.184 . . . . 0.0 113.434 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.8 t -112.54 113.16 43.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 117.341 0.57 . . . . 0.0 109.575 -177.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.5 m -89.95 123.97 34.32 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-O 121.752 0.787 . . . . 0.0 110.239 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -119.5 123.25 43.54 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.36 -176.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -118.53 126.72 75.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 59.5 m -106.42 131.2 53.9 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.355 -178.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -138.33 120.84 16.12 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 63.97 29.79 14.31 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.364 1.066 . . . . 0.0 109.543 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.62 1.95 90.35 Favored Glycine 0 N--CA 1.441 -1.016 0 CA-C-N 115.168 -0.924 . . . . 0.0 112.479 -178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.5 t -99.56 111.87 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.6 m -92.72 124.94 37.1 Favored 'General case' 0 C--N 1.289 -2.028 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.134 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -122.3 126.13 47.46 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 114.691 -1.141 . . . . 0.0 109.965 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.6 m -97.34 139.44 19.78 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 178.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.7 m -111.33 131.52 55.11 Favored 'General case' 0 C--N 1.287 -2.13 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.183 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -135.56 109.37 8.1 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-O 121.183 0.516 . . . . 0.0 110.122 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 . . . . . 0 CA--C 1.546 0.825 0 C-N-CA 125.032 1.333 . . . . 0.0 111.719 177.733 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.944 0 N-CA-C 112.692 -0.163 . . . . 0.0 112.692 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 68.8 t -105.22 126.22 60.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.9 m -97.45 125.16 41.94 Favored 'General case' 0 C--N 1.285 -2.205 0 C-N-CA 119.235 -0.986 . . . . 0.0 111.552 -179.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -119.17 121.49 39.86 Favored 'General case' 0 C--N 1.283 -2.298 0 CA-C-N 114.328 -1.305 . . . . 0.0 109.432 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.7 m -89.62 144.33 9.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.8 m -124.95 139.3 53.95 Favored 'General case' 0 C--N 1.288 -2.074 0 C-N-CA 118.544 -1.262 . . . . 0.0 111.397 -177.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -153.65 127.46 8.84 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.292 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 62.44 32.45 16.73 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.584 1.154 . . . . 0.0 110.125 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.73 0.04 89.82 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.578 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.8 t -107.44 119.55 57.24 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.029 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.1 m -98.28 123.84 42.58 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.795 0.807 . . . . 0.0 110.872 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -109.09 123.61 49.45 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.228 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 99.0 t -95.33 108.19 20.6 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 64.9 m -95.23 123.3 38.66 Favored 'General case' 0 C--N 1.29 -2.021 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -139.3 129.32 25.07 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.042 -175.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 122.083 0.944 . . . . 0.0 109.593 -178.389 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.931 0 N-CA-C 113.05 -0.02 . . . . 0.0 113.05 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.3 t -102.28 115.37 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.1 m -95.85 128.96 43.18 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.8 tpm_? -111.07 121.99 46.73 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 113.927 -1.488 . . . . 0.0 107.865 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.1 m -111.0 128.84 67.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.8 m -99.88 124.55 45.31 Favored 'General case' 0 C--N 1.291 -1.955 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.414 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -136.7 118.8 15.43 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.778 -175.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 59.45 34.76 22.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.721 1.248 . . . . 0.0 110.573 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.55 -8.42 74.52 Favored Glycine 0 N--CA 1.43 -1.727 0 CA-C-N 114.511 -1.222 . . . . 0.0 113.733 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.9 t -108.44 116.55 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 117.359 0.579 . . . . 0.0 109.672 -176.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 64.9 m -84.44 115.96 22.83 Favored 'General case' 0 N--CA 1.419 -2.0 0 CA-C-O 121.917 0.865 . . . . 0.0 110.119 175.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -110.67 120.81 43.62 Favored 'General case' 0 C--N 1.283 -2.296 0 CA-C-N 113.65 -1.614 . . . . 0.0 108.703 -178.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.1 m -111.6 130.12 65.74 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.0 m -111.33 130.39 55.69 Favored 'General case' 0 C--N 1.283 -2.308 0 C-N-CA 119.861 -0.735 . . . . 0.0 110.606 -176.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -126.18 109.85 12.8 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 . . . . . 0 CA--C 1.542 0.662 0 CA-C-O 122.238 1.018 . . . . 0.0 110.246 177.826 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.03 0 CA-C-O 120.339 -0.145 . . . . 0.0 112.881 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 92.0 t -120.79 127.25 75.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 117.3 0.55 . . . . 0.0 109.91 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 90.4 m -95.7 129.86 42.78 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 121.255 0.55 . . . . 0.0 110.68 176.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -115.14 120.32 39.36 Favored 'General case' 0 C--N 1.279 -2.479 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 m -116.07 132.86 64.35 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 55.6 m -108.64 139.3 43.61 Favored 'General case' 0 C--N 1.288 -2.072 0 C-N-CA 119.974 -0.691 . . . . 0.0 109.782 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -151.32 134.04 15.64 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.706 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 49.0 ttp180 61.78 25.0 14.98 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.182 0.991 . . . . 0.0 109.764 -178.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.56 -3.37 87.26 Favored Glycine 0 N--CA 1.439 -1.157 0 CA-C-N 115.131 -0.941 . . . . 0.0 112.602 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.9 t -103.55 126.85 57.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -176.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.2 m -96.0 130.83 42.89 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.77 0.795 . . . . 0.0 112.074 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -113.95 126.46 55.18 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.812 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.0 t -112.54 108.11 24.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 78.4 m -106.17 132.63 52.01 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.111 -178.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -164.13 145.3 8.56 Favored 'General case' 0 CA--C 1.502 -0.888 0 O-C-N 123.415 0.447 . . . . 0.0 110.717 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 . . . . . 0 N--CA 1.475 0.812 0 C-N-CA 125.227 1.411 . . . . 0.0 110.567 177.831 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.601 0 N-CA-C 112.491 -0.244 . . . . 0.0 112.491 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 50.1 t -103.75 107.96 23.46 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.8 m -90.58 121.71 32.74 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-O 121.335 0.588 . . . . 0.0 110.306 179.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -119.02 125.25 48.94 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.179 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.9 t -82.47 106.92 13.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 40.5 m -96.93 123.91 40.76 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-O 121.242 0.544 . . . . 0.0 110.826 -177.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 75.3 mtt180 -134.0 121.52 21.72 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.459 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 63.62 30.72 14.88 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 122.672 1.225 . . . . 0.0 110.037 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.18 8.78 87.6 Favored Glycine 0 C--N 1.308 -1.004 0 CA-C-N 115.021 -0.99 . . . . 0.0 112.028 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.9 t -107.29 108.37 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.7 m -91.3 117.47 29.68 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-O 121.497 0.665 . . . . 0.0 111.011 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -105.44 120.84 42.62 Favored 'General case' 0 C--N 1.275 -2.646 0 CA-C-N 114.856 -1.066 . . . . 0.0 109.142 177.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.7 m -95.3 123.58 47.51 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.6 m -101.14 124.92 47.6 Favored 'General case' 0 C--N 1.29 -2.0 0 C-N-CA 119.653 -0.819 . . . . 0.0 109.532 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -131.22 112.66 13.01 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.444 -0.798 . . . . 0.0 108.901 -176.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 . . . . . 0 CA--C 1.545 0.782 0 CA-C-O 122.573 1.178 . . . . 0.0 109.984 177.185 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.496 0 N-CA-C 112.535 -0.226 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.23 120.9 51.43 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.093 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 177.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 85.2 m -105.45 135.61 46.53 Favored 'General case' 0 C--N 1.282 -2.362 0 C-N-CA 119.584 -0.846 . . . . 0.0 112.929 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -115.12 120.53 40.09 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.875 175.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.1 m -116.85 133.69 62.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 176.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 55.7 m -110.78 134.04 52.84 Favored 'General case' 0 C--N 1.284 -2.261 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.065 -178.308 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 65.0 mtm180 -132.24 116.63 17.18 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 59.75 33.93 21.89 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 122.048 0.928 . . . . 0.0 110.237 178.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.01 -2.88 87.2 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.844 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.7 t -101.96 114.8 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.7 m -92.49 126.84 37.75 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-O 121.682 0.753 . . . . 0.0 111.564 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.3 tpt85 -117.81 120.54 38.23 Favored 'General case' 0 C--N 1.287 -2.136 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.195 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.7 m -104.36 125.14 59.2 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.3 m -108.38 144.43 35.96 Favored 'General case' 0 C--N 1.284 -2.246 0 C-N-CA 119.744 -0.782 . . . . 0.0 111.182 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -142.64 120.35 11.87 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 175.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 . . . . . 0 N--CA 1.482 1.163 0 CA-C-O 122.254 1.026 . . . . 0.0 110.317 178.481 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.056 0 CA-C-O 120.062 -0.299 . . . . 0.0 113.315 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.9 t -128.49 124.96 62.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 88.3 m -96.03 121.87 38.25 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-O 121.516 0.674 . . . . 0.0 110.323 176.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -117.59 121.2 40.3 Favored 'General case' 0 C--N 1.279 -2.493 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.257 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p -107.89 134.83 48.52 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.2 m -115.29 136.69 52.83 Favored 'General case' 0 C--N 1.294 -1.838 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.942 -178.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -129.52 109.64 11.2 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.337 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 63.06 29.03 16.33 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.662 1.185 . . . . 0.0 110.032 178.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.73 -13.1 59.47 Favored Glycine 0 N--CA 1.434 -1.463 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.844 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.7 t -91.75 111.39 23.97 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.001 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 -177.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.3 m -93.82 131.07 39.57 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 119.691 -0.803 . . . . 0.0 111.944 -178.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 -123.45 121.72 36.43 Favored 'General case' 0 C--N 1.29 -1.994 0 CA-C-N 114.473 -1.239 . . . . 0.0 110.123 178.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.6 t -91.08 111.72 24.17 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.732 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 69.9 m -100.08 122.26 42.67 Favored 'General case' 0 C--N 1.289 -2.06 0 C-N-CA 119.524 -0.87 . . . . 0.0 109.662 178.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -146.69 131.0 17.52 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.559 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 . . . . . 0 CA--C 1.536 0.413 0 C-N-CA 125.594 1.558 . . . . 0.0 111.532 179.377 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.565 0 CA-C-O 120.31 -0.161 . . . . 0.0 113.254 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.5 t -106.76 121.73 59.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 77.2 m -100.56 132.36 45.99 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.705 0.764 . . . . 0.0 112.706 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -117.57 120.82 39.24 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.485 177.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.4 t -115.94 121.94 68.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.9 m -101.81 128.07 48.33 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 120.273 -0.571 . . . . 0.0 111.019 -177.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 28.8 mmm180 -136.55 127.71 27.99 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.812 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.2 tpp180 60.85 31.92 20.05 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 122.128 0.966 . . . . 0.0 110.629 175.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.81 14.61 81.85 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.584 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.3 t -122.02 119.82 59.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.7 m -91.19 119.28 31.15 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-O 121.933 0.873 . . . . 0.0 112.166 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -98.82 120.51 39.37 Favored 'General case' 0 C--N 1.279 -2.468 0 CA-C-N 113.96 -1.473 . . . . 0.0 108.337 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.4 t -112.58 139.56 36.85 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.038 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 177.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 70.0 m -125.11 133.88 52.68 Favored 'General case' 0 C--N 1.288 -2.102 0 C-N-CA 119.801 -0.76 . . . . 0.0 109.717 178.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -133.12 112.67 11.95 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -176.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 . . . . . 0 C--N 1.312 -1.051 0 C-N-CA 124.667 1.187 . . . . 0.0 110.737 177.328 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.29 0 CA-C-O 120.001 -0.333 . . . . 0.0 113.53 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.0 t -126.66 128.42 71.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 78.2 m -96.48 124.81 40.59 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.634 0.731 . . . . 0.0 111.669 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -103.09 128.41 50.0 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.671 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.5 t -105.63 106.48 20.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 77.6 m -106.58 137.12 45.16 Favored 'General case' 0 C--N 1.288 -2.086 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.13 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -145.15 119.3 9.46 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.16 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 59.57 35.58 22.63 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.927 0.891 . . . . 0.0 110.959 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.48 11.29 85.63 Favored Glycine 0 C--N 1.313 -0.73 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.442 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.92 114.33 46.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.0 m -101.35 131.62 47.33 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.748 0.785 . . . . 0.0 112.533 -178.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -119.33 130.58 55.44 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-N 113.978 -1.465 . . . . 0.0 109.133 177.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m -111.01 126.36 68.39 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.284 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 177.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 62.2 m -104.08 124.8 49.72 Favored 'General case' 0 C--N 1.284 -2.242 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.093 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -138.31 127.99 25.06 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -176.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 . . . . . 0 C--N 1.318 -0.798 0 C-N-CA 124.411 1.084 . . . . 0.0 110.946 176.501 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.117 0 CA-C-O 120.383 -0.121 . . . . 0.0 112.973 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 55.3 t -118.2 128.12 75.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.452 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 79.8 m -92.89 130.19 38.56 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 121.312 0.577 . . . . 0.0 111.723 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -113.93 121.37 43.73 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.807 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p -105.53 138.52 30.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.9 m -113.7 130.76 56.37 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.085 -176.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.4 mtm180 -135.3 126.26 27.68 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 59.02 36.39 24.36 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-O 122.089 0.947 . . . . 0.0 110.504 177.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.86 14.32 78.44 Favored Glycine 0 C--O 1.245 0.795 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.67 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 51.0 t -118.69 118.8 59.06 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 78.8 m -93.2 130.07 39.01 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-O 121.64 0.733 . . . . 0.0 111.94 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -115.54 121.89 44.04 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.564 -1.198 . . . . 0.0 108.951 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 56.7 t -119.45 125.81 74.74 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.452 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.5 m -101.47 133.31 46.3 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 120.822 0.344 . . . . 0.0 110.891 -179.136 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 ptp180 -147.11 128.51 14.92 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.854 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 64.8 ttt180 . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 122.458 1.123 . . . . 0.0 110.862 177.217 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.449 0 CA-C-O 121.037 0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.4 t -114.91 120.16 63.75 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 -179.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.6 m -94.38 127.88 40.55 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 121.344 0.592 . . . . 0.0 110.52 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -124.85 122.96 38.89 Favored 'General case' 0 C--N 1.281 -2.376 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.842 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 41.8 t -98.95 119.53 47.06 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 59.7 m -98.62 123.4 42.79 Favored 'General case' 0 C--N 1.286 -2.165 0 C-N-CA 119.43 -0.908 . . . . 0.0 110.071 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.5 ptp180 -148.47 137.77 21.91 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.967 -177.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 42.3 ttt180 66.37 26.32 10.21 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 122.455 1.122 . . . . 0.0 109.735 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.01 15.69 81.44 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 114.567 -1.197 . . . . 0.0 112.573 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.1 t -129.11 129.86 67.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 72.3 m -92.19 125.68 36.96 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.555 0.693 . . . . 0.0 110.732 177.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? -115.58 120.8 40.63 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.551 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 m -101.43 121.05 51.86 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-O 121.471 0.653 . . . . 0.0 109.884 -179.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 70.1 m -102.44 134.82 45.14 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.83 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -153.5 131.39 11.68 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.206 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 . . . . . 0 CA--C 1.551 0.991 0 CA-C-O 122.632 1.206 . . . . 0.0 110.536 177.071 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.14 0 CA-C-O 120.278 -0.179 . . . . 0.0 112.937 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.1 t -110.46 121.06 62.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 61.4 m -88.53 113.9 24.6 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 122.726 1.25 . . . . 0.0 111.97 -178.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 32.1 tpt180 -99.54 122.83 43.17 Favored 'General case' 0 C--N 1.287 -2.148 0 CA-C-N 113.268 -1.787 . . . . 0.0 109.446 -176.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.1 t -104.84 115.65 47.13 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 176.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 49.2 m -99.15 135.58 40.34 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-O 120.944 0.402 . . . . 0.0 110.838 -178.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -139.19 120.35 14.69 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 58.83 36.59 24.78 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 122.174 0.988 . . . . 0.0 110.987 176.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.14 -2.25 87.62 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.262 -0.881 . . . . 0.0 113.444 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.7 t -109.35 126.08 66.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.3 m -99.63 131.54 45.55 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.641 -178.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -111.53 121.73 45.94 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.674 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -94.89 124.56 47.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.366 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 36.3 m -95.01 124.06 38.84 Favored 'General case' 0 C--N 1.285 -2.226 0 CA-C-O 121.586 0.708 . . . . 0.0 110.422 -177.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 30.6 mmm180 -127.36 113.81 16.73 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 114.443 -1.253 . . . . 0.0 107.784 -175.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 . . . . . 0 CA--C 1.551 0.995 0 CA-C-O 122.267 1.032 . . . . 0.0 110.573 177.872 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.646 0 N-CA-C 112.367 -0.293 . . . . 0.0 112.367 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 56.9 t -116.99 113.18 42.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 82.6 m -86.44 131.56 34.16 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 121.642 0.734 . . . . 0.0 111.851 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 -127.1 121.93 32.85 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.994 -179.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p -113.62 132.26 63.06 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.929 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 177.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 46.7 m -105.28 136.74 44.25 Favored 'General case' 0 C--N 1.287 -2.152 0 C-N-CA 119.771 -0.771 . . . . 0.0 111.051 -177.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 78.8 mtp180 -129.78 109.19 10.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 55.43 42.64 29.79 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 124.82 1.248 . . . . 0.0 111.187 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.9 -5.54 84.74 Favored Glycine 0 N--CA 1.442 -0.949 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.873 177.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 48.2 t -101.31 108.98 24.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -179.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 65.3 m -90.75 129.7 36.8 Favored 'General case' 0 C--N 1.296 -1.723 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.074 -179.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -119.65 124.3 45.95 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.251 179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.3 m -96.35 135.91 28.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 176.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 53.8 m -116.27 128.99 56.05 Favored 'General case' 0 C--N 1.281 -2.382 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.086 -177.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 -133.6 124.52 27.0 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.746 -177.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 . . . . . 0 CA--C 1.546 0.797 0 CA-C-O 122.204 1.002 . . . . 0.0 110.314 178.529 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.051 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 48.7 t -122.13 135.15 63.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -176.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 72.4 m -101.79 124.76 47.97 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 121.813 0.816 . . . . 0.0 111.012 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 5.2 tpm_? -111.82 120.86 43.41 Favored 'General case' 0 C--N 1.281 -2.378 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.216 -178.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -97.88 112.37 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.096 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 50.2 m -96.64 127.91 43.08 Favored 'General case' 0 C--N 1.277 -2.564 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.831 -178.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -120.07 109.05 15.02 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.656 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 46.93 51.81 12.31 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 124.595 1.184 . . . . 0.0 111.169 178.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.55 -0.24 86.72 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.181 -0.918 . . . . 0.0 114.168 174.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.3 t -116.04 114.63 46.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 117.748 0.774 . . . . 0.0 108.916 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.2 m -91.0 127.5 36.45 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -115.94 124.93 51.8 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.743 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.6 m -117.05 135.51 57.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.5 m -112.41 139.24 48.15 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 120.211 -0.595 . . . . 0.0 110.029 -179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -159.06 140.49 13.17 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? . . . . . 0 N--CA 1.481 1.106 0 CA-C-O 122.296 1.046 . . . . 0.0 111.141 174.832 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.552 0 CA-C-O 120.432 -0.094 . . . . 0.0 113.224 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 57.6 t -94.16 114.01 29.94 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.813 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 73.4 m -97.92 126.91 43.54 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-O 121.544 0.688 . . . . 0.0 112.724 -175.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 -111.79 123.13 49.6 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.465 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 99.3 t -94.76 106.32 18.02 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.569 -177.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.8 m -96.7 129.94 44.02 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -152.71 128.98 10.51 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.494 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 63.47 31.15 15.11 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 122.246 1.022 . . . . 0.0 110.473 176.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.69 10.03 86.2 Favored Glycine 0 C--N 1.31 -0.899 0 CA-C-N 115.318 -0.856 . . . . 0.0 112.083 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.5 t -115.98 120.5 65.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.2 m -100.41 116.35 32.17 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-O 121.85 0.833 . . . . 0.0 110.898 177.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -117.72 127.9 54.37 Favored 'General case' 0 C--N 1.278 -2.517 0 CA-C-N 114.299 -1.318 . . . . 0.0 109.215 -177.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -126.54 120.17 55.56 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 175.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 58.0 m -102.02 135.86 42.86 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.342 -177.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -128.05 109.55 11.65 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 . . . . . 0 N--CA 1.475 0.811 0 C-N-CA 124.437 1.095 . . . . 0.0 110.377 177.149 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.805 0 CA-C-O 120.815 0.12 . . . . 0.0 112.98 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 56.4 t -107.64 126.5 64.0 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 -176.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.3 m -102.67 115.7 31.1 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 121.665 0.745 . . . . 0.0 110.721 178.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 -100.56 128.82 46.5 Favored 'General case' 0 C--N 1.277 -2.584 0 CA-C-N 114.21 -1.359 . . . . 0.0 108.992 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . 0.45 ' HA ' ' O ' ' A' ' 13' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 34.9 m -112.81 141.68 27.62 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 35.3 m -114.62 133.44 55.83 Favored 'General case' 0 C--N 1.282 -2.339 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.244 -179.078 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -123.49 109.85 14.35 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 62.8 30.68 16.69 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 122.353 1.073 . . . . 0.0 109.263 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.47 -11.95 70.53 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 114.924 -1.035 . . . . 0.0 112.592 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.16 112.85 27.65 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.887 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -176.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 72.0 m -88.46 132.29 34.54 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-O 121.776 0.798 . . . . 0.0 113.04 -175.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.45 ' O ' ' HA ' ' A' ' 5' ' ' ABA . 16.3 tpp180 -108.09 121.37 44.69 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 113.881 -1.509 . . . . 0.0 107.257 173.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.4 p -131.52 133.76 61.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.83 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 65.7 m -106.81 135.29 48.6 Favored 'General case' 0 C--N 1.288 -2.08 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.145 178.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -153.6 128.55 9.57 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.485 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 . . . . . 0 CA--C 1.553 1.071 0 CA-C-O 122.41 1.1 . . . . 0.0 110.298 177.958 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.558 0 N-CA-C 114.543 0.577 . . . . 0.0 114.543 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.6 t -106.15 115.93 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.693 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 74.7 m -95.89 132.11 41.52 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 119.722 -0.791 . . . . 0.0 112.841 -177.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.6 tpm_? -118.25 120.97 39.28 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.293 179.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.5 p -103.0 136.86 33.52 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -177.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 29.1 m -105.8 138.58 41.75 Favored 'General case' 0 C--N 1.293 -1.88 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.729 -177.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -138.53 123.93 19.42 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.534 -178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 61.3 25.09 15.12 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 122.834 1.302 . . . . 0.0 110.428 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.94 -1.97 81.29 Favored Glycine 0 C--N 1.301 -1.404 0 CA-C-N 114.856 -1.065 . . . . 0.0 113.209 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.0 t -106.05 127.99 60.74 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 -179.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 66.6 m -94.62 129.82 41.33 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.714 0.768 . . . . 0.0 111.794 -177.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -119.28 124.12 45.9 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.509 -176.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t -101.94 122.57 54.32 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.597 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 60.5 m -109.39 131.87 54.66 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 119.851 -0.739 . . . . 0.0 110.153 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -114.02 108.06 16.51 Favored 'General case' 0 N--CA 1.428 -1.558 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 63.1 ttt180 . . . . . 0 CA--C 1.561 1.368 0 C-N-CA 125.345 1.458 . . . . 0.0 112.627 176.695 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.066 0 CA-C-O 120.176 -0.235 . . . . 0.0 113.536 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 70.8 t -120.18 126.55 75.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.16 0 CA-C-N 117.769 0.785 . . . . 0.0 109.447 -178.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 70.9 m -98.81 122.42 42.03 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-O 121.613 0.72 . . . . 0.0 110.072 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -118.85 121.85 40.98 Favored 'General case' 0 C--N 1.277 -2.555 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.037 -177.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.4 m -99.76 129.83 49.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.566 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 34.7 m -100.18 121.72 41.89 Favored 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 119.545 -0.862 . . . . 0.0 110.98 -175.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -127.64 121.96 31.84 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 114.497 -1.229 . . . . 0.0 107.79 -176.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 64.32 27.7 13.75 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.228 1.013 . . . . 0.0 109.542 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.53 9.18 87.25 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.037 -0.983 . . . . 0.0 112.715 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.0 t -111.81 130.24 65.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 58.4 m -99.8 116.66 32.39 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 122.139 0.971 . . . . 0.0 112.203 -175.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -105.54 128.28 53.5 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 113.88 -1.509 . . . . 0.0 109.887 -177.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.9 t -122.86 121.72 64.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 175.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.5 m -103.94 133.95 48.04 Favored 'General case' 0 C--N 1.295 -1.791 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.834 -178.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -151.4 127.12 10.21 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.199 -177.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 122.591 1.186 . . . . 0.0 111.568 176.821 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.223 0 CA-C-O 120.249 -0.195 . . . . 0.0 113.242 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.0 t -112.94 119.87 61.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 78.4 m -95.79 124.56 39.86 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 121.473 0.654 . . . . 0.0 110.948 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -110.28 120.52 42.69 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-N 114.572 -1.194 . . . . 0.0 108.296 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.0 m -130.3 167.79 24.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.358 -179.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 75.5 m -130.91 138.55 49.83 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -137.29 109.77 7.43 Favored 'General case' 0 N--CA 1.422 -1.87 0 CA-C-O 120.924 0.392 . . . . 0.0 110.273 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 57.41 41.15 26.7 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 122.772 1.272 . . . . 0.0 110.531 178.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.22 -9.13 78.43 Favored Glycine 0 N--CA 1.436 -1.301 0 CA-C-N 114.6 -1.182 . . . . 0.0 113.086 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.1 t -99.98 110.1 26.32 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 70.7 m -90.24 128.7 36.46 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-O 121.374 0.607 . . . . 0.0 110.742 178.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -129.99 137.73 50.44 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.886 -176.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 40.5 t -87.32 122.74 39.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.04 -175.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 85.8 m -102.12 131.06 48.84 Favored 'General case' 0 C--N 1.293 -1.864 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.026 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -145.17 117.59 8.51 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.021 -175.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 tmm_? . . . . . 0 CA--C 1.545 0.782 0 CA-C-O 122.446 1.117 . . . . 0.0 110.697 178.163 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.912 0 N-CA-C 112.602 -0.199 . . . . 0.0 112.602 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.3 t -115.75 129.52 71.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 85.8 m -96.62 128.93 44.03 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-O 121.762 0.791 . . . . 0.0 111.325 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -117.65 131.17 56.69 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.736 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.7 m -90.16 123.36 42.31 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.278 0 CA-C-O 121.069 0.462 . . . . 0.0 110.32 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -94.17 136.27 34.64 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-O 122.166 0.984 . . . . 0.0 112.491 -178.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -135.37 116.67 14.55 Favored 'General case' 0 N--CA 1.416 -2.131 0 CA-C-N 113.508 -1.678 . . . . 0.0 108.054 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? 56.65 40.03 29.48 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 122.177 0.989 . . . . 0.0 110.578 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.12 0.97 90.2 Favored Glycine 0 C--N 1.314 -0.68 0 CA-C-N 115.18 -0.918 . . . . 0.0 113.413 176.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.68 120.27 62.4 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 6.0 m -86.58 129.8 34.73 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-O 122.533 1.159 . . . . 0.0 113.773 178.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -105.95 127.42 53.13 Favored 'General case' 0 C--N 1.278 -2.543 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.966 177.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.9 p -122.26 137.32 56.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 58.1 m -112.54 137.65 50.46 Favored 'General case' 0 C--N 1.292 -1.924 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.233 -178.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -148.94 131.38 15.71 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 122.445 1.117 . . . . 0.0 110.469 178.853 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.8 t . . . . . 0 N--CA 1.442 -0.852 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.5 m -89.95 123.97 34.32 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-O 121.752 0.787 . . . . 0.0 110.239 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 . . . . . 0 C--N 1.289 -2.028 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.36 -176.583 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.435 -1.204 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 59.5 m -106.42 131.2 53.9 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.355 -178.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -138.33 120.84 16.12 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 63.97 29.79 14.31 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.364 1.066 . . . . 0.0 109.543 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.62 1.95 90.35 Favored Glycine 0 N--CA 1.441 -1.016 0 CA-C-N 115.168 -0.924 . . . . 0.0 112.479 -178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.5 t -99.56 111.87 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.6 m -92.72 124.94 37.1 Favored 'General case' 0 C--N 1.289 -2.028 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.134 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 . . . . . 0 C--N 1.284 -2.243 0 CA-C-N 114.691 -1.141 . . . . 0.0 109.965 -179.63 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.6 m . . . . . 0 N--CA 1.439 -0.991 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.7 m -111.33 131.52 55.11 Favored 'General case' 0 C--N 1.287 -2.13 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.183 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 . . . . . 0 N--CA 1.424 -1.741 0 CA-C-O 121.183 0.516 . . . . 0.0 110.122 -174.579 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 68.8 t . . . . . 0 CA--C 1.5 -0.974 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.9 m -97.45 125.16 41.94 Favored 'General case' 0 C--N 1.285 -2.205 0 C-N-CA 119.235 -0.986 . . . . 0.0 111.552 -179.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 . . . . . 0 C--N 1.283 -2.298 0 CA-C-N 114.328 -1.305 . . . . 0.0 109.432 178.755 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 60.8 m -124.95 139.3 53.95 Favored 'General case' 0 C--N 1.288 -2.074 0 C-N-CA 118.544 -1.262 . . . . 0.0 111.397 -177.308 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -153.65 127.46 8.84 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.292 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 62.44 32.45 16.73 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.584 1.154 . . . . 0.0 110.125 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.73 0.04 89.82 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.578 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.8 t -107.44 119.55 57.24 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.029 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.1 m -98.28 123.84 42.58 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.795 0.807 . . . . 0.0 110.872 177.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.401 ' NE ' ' HA ' ' A' ' 13' ' ' ARG . 1.6 tpm_? . . . . . 0 C--N 1.285 -2.227 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.228 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 99.0 t . . . . . 0 N--CA 1.427 -1.62 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 64.9 m -95.23 123.3 38.66 Favored 'General case' 0 C--N 1.29 -2.021 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.458 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 . . . . . 0 C--N 1.293 -1.871 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.042 -175.904 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 N--CA 1.439 -1.015 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 84.1 m -95.85 128.96 43.18 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -175.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.8 tpm_? . . . . . 0 C--N 1.297 -1.682 0 CA-C-N 113.927 -1.488 . . . . 0.0 107.865 178.303 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.439 -0.981 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.8 m -99.88 124.55 45.31 Favored 'General case' 0 C--N 1.291 -1.955 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.414 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -136.7 118.8 15.43 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.778 -175.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 59.45 34.76 22.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.721 1.248 . . . . 0.0 110.573 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.55 -8.42 74.52 Favored Glycine 0 N--CA 1.43 -1.727 0 CA-C-N 114.511 -1.222 . . . . 0.0 113.733 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.9 t -108.44 116.55 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 117.359 0.579 . . . . 0.0 109.672 -176.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 64.9 m -84.44 115.96 22.83 Favored 'General case' 0 N--CA 1.419 -2.0 0 CA-C-O 121.917 0.865 . . . . 0.0 110.119 175.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? . . . . . 0 C--N 1.283 -2.296 0 CA-C-N 113.65 -1.614 . . . . 0.0 108.703 -178.162 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.1 m . . . . . 0 N--CA 1.432 -1.331 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 62.0 m -111.33 130.39 55.69 Favored 'General case' 0 C--N 1.283 -2.308 0 C-N-CA 119.861 -0.735 . . . . 0.0 110.606 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 . . . . . 0 N--CA 1.432 -1.37 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -177.581 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 92.0 t . . . . . 0 C--O 1.239 0.52 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 90.4 m -95.7 129.86 42.78 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 121.255 0.55 . . . . 0.0 110.68 176.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 . . . . . 0 C--N 1.279 -2.479 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.668 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.43 -1.45 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 55.6 m -108.64 139.3 43.61 Favored 'General case' 0 C--N 1.288 -2.072 0 C-N-CA 119.974 -0.691 . . . . 0.0 109.782 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -151.32 134.04 15.64 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.706 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 49.0 ttp180 61.78 25.0 14.98 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.182 0.991 . . . . 0.0 109.764 -178.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.56 -3.37 87.26 Favored Glycine 0 N--CA 1.439 -1.157 0 CA-C-N 115.131 -0.941 . . . . 0.0 112.602 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.9 t -103.55 126.85 57.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -176.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 71.2 m -96.0 130.83 42.89 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.77 0.795 . . . . 0.0 112.074 179.461 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 . . . . . 0 C--N 1.297 -1.702 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.812 -178.808 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.0 t . . . . . 0 N--CA 1.438 -1.051 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 78.4 m -106.17 132.63 52.01 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.111 -178.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 . . . . . 0 CA--C 1.502 -0.888 0 O-C-N 123.415 0.447 . . . . 0.0 110.717 179.492 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 50.1 t . . . . . 0 N--CA 1.437 -1.08 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.8 m -90.58 121.71 32.74 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-O 121.335 0.588 . . . . 0.0 110.306 179.144 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 . . . . . 0 C--N 1.288 -2.098 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.179 -179.798 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.9 t . . . . . 0 C--O 1.244 0.815 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 40.5 m -96.93 123.91 40.76 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-O 121.242 0.544 . . . . 0.0 110.826 -177.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 75.3 mtt180 -134.0 121.52 21.72 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.459 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 63.62 30.72 14.88 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 122.672 1.225 . . . . 0.0 110.037 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.18 8.78 87.6 Favored Glycine 0 C--N 1.308 -1.004 0 CA-C-N 115.021 -0.99 . . . . 0.0 112.028 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.9 t -107.29 108.37 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.7 m -91.3 117.47 29.68 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-O 121.497 0.665 . . . . 0.0 111.011 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.434 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 17.7 tpt180 . . . . . 0 C--N 1.275 -2.646 0 CA-C-N 114.856 -1.066 . . . . 0.0 109.142 177.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.432 -1.364 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.6 m -101.14 124.92 47.6 Favored 'General case' 0 C--N 1.29 -2.0 0 C-N-CA 119.653 -0.819 . . . . 0.0 109.532 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 . . . . . 0 C--N 1.303 -1.433 0 CA-C-N 115.444 -0.798 . . . . 0.0 108.901 -176.063 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 51.5 t . . . . . 0 CA--C 1.497 -1.093 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 85.2 m -105.45 135.61 46.53 Favored 'General case' 0 C--N 1.282 -2.362 0 C-N-CA 119.584 -0.846 . . . . 0.0 112.929 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 . . . . . 0 C--N 1.297 -1.712 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.875 175.332 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.435 -1.204 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 55.7 m -110.78 134.04 52.84 Favored 'General case' 0 C--N 1.284 -2.261 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.065 -178.308 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 65.0 mtm180 -132.24 116.63 17.18 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 59.75 33.93 21.89 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 122.048 0.928 . . . . 0.0 110.237 178.316 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.01 -2.88 87.2 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.844 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.7 t -101.96 114.8 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.7 m -92.49 126.84 37.75 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-O 121.682 0.753 . . . . 0.0 111.564 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.3 tpt85 . . . . . 0 C--N 1.287 -2.136 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.195 179.135 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.7 m . . . . . 0 N--CA 1.428 -1.575 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.3 m -108.38 144.43 35.96 Favored 'General case' 0 C--N 1.284 -2.246 0 C-N-CA 119.744 -0.782 . . . . 0.0 111.182 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 . . . . . 0 N--CA 1.44 -0.936 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 175.912 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.447 -0.609 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 88.3 m -96.03 121.87 38.25 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-O 121.516 0.674 . . . . 0.0 110.323 176.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 . . . . . 0 C--N 1.279 -2.493 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.257 -178.89 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p . . . . . 0 N--CA 1.429 -1.515 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.2 m -115.29 136.69 52.83 Favored 'General case' 0 C--N 1.294 -1.838 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.942 -178.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -129.52 109.64 11.2 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.337 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 63.06 29.03 16.33 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.662 1.185 . . . . 0.0 110.032 178.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.73 -13.1 59.47 Favored Glycine 0 N--CA 1.434 -1.463 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.844 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.7 t -91.75 111.39 23.97 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.001 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 -177.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.3 m -93.82 131.07 39.57 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 119.691 -0.803 . . . . 0.0 111.944 -178.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 . . . . . 0 C--N 1.29 -1.994 0 CA-C-N 114.473 -1.239 . . . . 0.0 110.123 178.03 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 N--CA 1.437 -1.086 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 69.9 m -100.08 122.26 42.67 Favored 'General case' 0 C--N 1.289 -2.06 0 C-N-CA 119.524 -0.87 . . . . 0.0 109.662 178.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 . . . . . 0 C--N 1.302 -1.463 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.559 -177.761 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 CA--C 1.508 -0.641 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 77.2 m -100.56 132.36 45.99 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.705 0.764 . . . . 0.0 112.706 -176.372 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? . . . . . 0 C--N 1.292 -1.907 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.485 177.059 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 N--CA 1.44 -0.952 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.9 m -101.81 128.07 48.33 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 120.273 -0.571 . . . . 0.0 111.019 -177.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 28.8 mmm180 -136.55 127.71 27.99 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.812 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.2 tpp180 60.85 31.92 20.05 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 122.128 0.966 . . . . 0.0 110.629 175.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.81 14.61 81.85 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.584 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.3 t -122.02 119.82 59.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.7 m -91.19 119.28 31.15 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-O 121.933 0.873 . . . . 0.0 112.166 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 . . . . . 0 C--N 1.279 -2.468 0 CA-C-N 113.96 -1.473 . . . . 0.0 108.337 179.838 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.4 t . . . . . 0 N--CA 1.434 -1.27 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 70.0 m -125.11 133.88 52.68 Favored 'General case' 0 C--N 1.288 -2.102 0 C-N-CA 119.801 -0.76 . . . . 0.0 109.717 178.122 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 . . . . . 0 N--CA 1.433 -1.304 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -176.981 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.0 t . . . . . 0 CA--C 1.51 -0.575 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 78.2 m -96.48 124.81 40.59 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.634 0.731 . . . . 0.0 111.669 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 . . . . . 0 C--N 1.292 -1.897 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.671 -178.419 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 N--CA 1.442 -0.861 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 77.6 m -106.58 137.12 45.16 Favored 'General case' 0 C--N 1.288 -2.086 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.13 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -145.15 119.3 9.46 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.16 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 59.57 35.58 22.63 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.927 0.891 . . . . 0.0 110.959 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.48 11.29 85.63 Favored Glycine 0 C--N 1.313 -0.73 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.442 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.92 114.33 46.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.0 m -101.35 131.62 47.33 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.748 0.785 . . . . 0.0 112.533 -178.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 . . . . . 0 C--N 1.287 -2.118 0 CA-C-N 113.978 -1.465 . . . . 0.0 109.133 177.239 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m . . . . . 0 N--CA 1.44 -0.939 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 62.2 m -104.08 124.8 49.72 Favored 'General case' 0 C--N 1.284 -2.242 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.093 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 . . . . . 0 N--CA 1.433 -1.312 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -176.061 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 55.3 t . . . . . 0 N--CA 1.442 -0.831 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 79.8 m -92.89 130.19 38.56 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 121.312 0.577 . . . . 0.0 111.723 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 . . . . . 0 C--N 1.294 -1.843 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.807 179.634 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.441 -0.895 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.9 m -113.7 130.76 56.37 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.085 -176.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.4 mtm180 -135.3 126.26 27.68 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 59.02 36.39 24.36 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-O 122.089 0.947 . . . . 0.0 110.504 177.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.86 14.32 78.44 Favored Glycine 0 C--O 1.245 0.795 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.67 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 51.0 t -118.69 118.8 59.06 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 78.8 m -93.2 130.07 39.01 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-O 121.64 0.733 . . . . 0.0 111.94 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 . . . . . 0 C--N 1.299 -1.604 0 CA-C-N 114.564 -1.198 . . . . 0.0 108.951 179.968 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 56.7 t . . . . . 0 N--CA 1.436 -1.137 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.5 m -101.47 133.31 46.3 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 120.822 0.344 . . . . 0.0 110.891 -179.136 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 ptp180 . . . . . 0 N--CA 1.433 -1.288 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.854 -177.698 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.4 t . . . . . 0 N--CA 1.435 -1.206 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.6 m -94.38 127.88 40.55 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 121.344 0.592 . . . . 0.0 110.52 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 . . . . . 0 C--N 1.281 -2.376 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.842 -179.647 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.427 -1.619 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.496 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 59.7 m -98.62 123.4 42.79 Favored 'General case' 0 C--N 1.286 -2.165 0 C-N-CA 119.43 -0.908 . . . . 0.0 110.071 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.5 ptp180 -148.47 137.77 21.91 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.967 -177.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 42.3 ttt180 66.37 26.32 10.21 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 122.455 1.122 . . . . 0.0 109.735 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.01 15.69 81.44 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 114.567 -1.197 . . . . 0.0 112.573 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.1 t -129.11 129.86 67.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.496 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 72.3 m -92.19 125.68 36.96 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.555 0.693 . . . . 0.0 110.732 177.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? . . . . . 0 C--N 1.295 -1.792 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.551 -178.384 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 m . . . . . 0 N--CA 1.43 -1.443 0 CA-C-O 121.471 0.653 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 70.1 m -102.44 134.82 45.14 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.83 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 . . . . . 0 C--N 1.313 -0.996 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.206 -179.595 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.1 t . . . . . 0 N--CA 1.446 -0.674 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 61.4 m -88.53 113.9 24.6 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 122.726 1.25 . . . . 0.0 111.97 -178.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 32.1 tpt180 . . . . . 0 C--N 1.287 -2.148 0 CA-C-N 113.268 -1.787 . . . . 0.0 109.446 -176.168 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.1 t . . . . . 0 N--CA 1.437 -1.116 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 49.2 m -99.15 135.58 40.34 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-O 120.944 0.402 . . . . 0.0 110.838 -178.001 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -139.19 120.35 14.69 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 58.83 36.59 24.78 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 122.174 0.988 . . . . 0.0 110.987 176.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.14 -2.25 87.62 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.262 -0.881 . . . . 0.0 113.444 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.7 t -109.35 126.08 66.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.3 m -99.63 131.54 45.55 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.641 -178.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 . . . . . 0 C--N 1.297 -1.684 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.674 179.912 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.435 -1.222 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 36.3 m -95.01 124.06 38.84 Favored 'General case' 0 C--N 1.285 -2.226 0 CA-C-O 121.586 0.708 . . . . 0.0 110.422 -177.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 30.6 mmm180 . . . . . 0 N--CA 1.424 -1.726 0 CA-C-N 114.443 -1.253 . . . . 0.0 107.784 -175.517 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 56.9 t . . . . . 0 N--CA 1.443 -0.804 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 82.6 m -86.44 131.56 34.16 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 121.642 0.734 . . . . 0.0 111.851 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 . . . . . 0 C--N 1.291 -1.956 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.994 -179.151 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.428 -1.53 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 46.7 m -105.28 136.74 44.25 Favored 'General case' 0 C--N 1.287 -2.152 0 C-N-CA 119.771 -0.771 . . . . 0.0 111.051 -177.207 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 78.8 mtp180 -129.78 109.19 10.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 55.43 42.64 29.79 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 124.82 1.248 . . . . 0.0 111.187 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.9 -5.54 84.74 Favored Glycine 0 N--CA 1.442 -0.949 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.873 177.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 48.2 t -101.31 108.98 24.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -179.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 65.3 m -90.75 129.7 36.8 Favored 'General case' 0 C--N 1.296 -1.723 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.074 -179.273 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 . . . . . 0 C--N 1.294 -1.814 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.251 179.495 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.3 m . . . . . 0 N--CA 1.437 -1.095 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 53.8 m -116.27 128.99 56.05 Favored 'General case' 0 C--N 1.281 -2.382 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.086 -177.223 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 . . . . . 0 C--N 1.301 -1.51 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.746 -177.776 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 48.7 t . . . . . 0 N--CA 1.447 -0.585 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.4 m -101.79 124.76 47.97 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 121.813 0.816 . . . . 0.0 111.012 177.648 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 5.2 tpm_? . . . . . 0 C--N 1.281 -2.378 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.216 -178.413 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.417 -2.096 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 50.2 m -96.64 127.91 43.08 Favored 'General case' 0 C--N 1.277 -2.564 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.831 -178.055 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -120.07 109.05 15.02 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.656 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 46.93 51.81 12.31 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 124.595 1.184 . . . . 0.0 111.169 178.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.55 -0.24 86.72 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.181 -0.918 . . . . 0.0 114.168 174.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.3 t -116.04 114.63 46.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 117.748 0.774 . . . . 0.0 108.916 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.2 m -91.0 127.5 36.45 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.629 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 . . . . . 0 C--N 1.298 -1.656 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.743 179.05 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.6 m . . . . . 0 N--CA 1.439 -1.02 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.5 m -112.41 139.24 48.15 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 120.211 -0.595 . . . . 0.0 110.029 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 . . . . . 0 C--N 1.308 -1.224 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.115 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 CA--C 1.504 -0.813 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 73.4 m -97.92 126.91 43.54 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-O 121.544 0.688 . . . . 0.0 112.724 -175.31 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 . . . . . 0 C--N 1.296 -1.758 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.465 179.697 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 99.3 t . . . . . 0 N--CA 1.438 -1.026 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.8 m -96.7 129.94 44.02 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -152.71 128.98 10.51 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.494 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 63.47 31.15 15.11 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 122.246 1.022 . . . . 0.0 110.473 176.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.69 10.03 86.2 Favored Glycine 0 C--N 1.31 -0.899 0 CA-C-N 115.318 -0.856 . . . . 0.0 112.083 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.5 t -115.98 120.5 65.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.2 m -100.41 116.35 32.17 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-O 121.85 0.833 . . . . 0.0 110.898 177.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 . . . . . 0 C--N 1.278 -2.517 0 CA-C-N 114.299 -1.318 . . . . 0.0 109.215 -177.925 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.432 -1.352 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 58.0 m -102.02 135.86 42.86 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.342 -177.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 . . . . . 0 C--N 1.308 -1.209 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.525 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 56.4 t . . . . . 0 N--CA 1.442 -0.856 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 71.3 m -102.67 115.7 31.1 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 121.665 0.745 . . . . 0.0 110.721 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 . . . . . 0 C--N 1.277 -2.584 0 CA-C-N 114.21 -1.359 . . . . 0.0 108.992 -177.846 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 34.9 m . . . . . 0 N--CA 1.437 -1.077 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 35.3 m -114.62 133.44 55.83 Favored 'General case' 0 C--N 1.282 -2.339 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.244 -179.078 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -123.49 109.85 14.35 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 62.8 30.68 16.69 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 122.353 1.073 . . . . 0.0 109.263 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.47 -11.95 70.53 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 114.924 -1.035 . . . . 0.0 112.592 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.16 112.85 27.65 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.887 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -176.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 72.0 m -88.46 132.29 34.54 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-O 121.776 0.798 . . . . 0.0 113.04 -175.019 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 . . . . . 0 C--N 1.293 -1.865 0 CA-C-N 113.881 -1.509 . . . . 0.0 107.257 173.98 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.4 p . . . . . 0 N--CA 1.433 -1.293 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.7 m -106.81 135.29 48.6 Favored 'General case' 0 C--N 1.288 -2.08 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.145 178.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 . . . . . 0 N--CA 1.432 -1.362 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.485 -178.494 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.6 t . . . . . 0 CA--C 1.507 -0.693 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 74.7 m -95.89 132.11 41.52 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 119.722 -0.791 . . . . 0.0 112.841 -177.165 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.6 tpm_? . . . . . 0 C--N 1.3 -1.549 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.293 179.534 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.5 p . . . . . 0 N--CA 1.435 -1.192 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 29.1 m -105.8 138.58 41.75 Favored 'General case' 0 C--N 1.293 -1.88 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.729 -177.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -138.53 123.93 19.42 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.534 -178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 61.3 25.09 15.12 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 122.834 1.302 . . . . 0.0 110.428 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.94 -1.97 81.29 Favored Glycine 0 C--N 1.301 -1.404 0 CA-C-N 114.856 -1.065 . . . . 0.0 113.209 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.0 t -106.05 127.99 60.74 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 -179.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 66.6 m -94.62 129.82 41.33 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.714 0.768 . . . . 0.0 111.794 -177.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 . . . . . 0 C--N 1.297 -1.676 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.509 -176.57 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.439 -0.979 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 60.5 m -109.39 131.87 54.66 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 119.851 -0.739 . . . . 0.0 110.153 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 . . . . . 0 N--CA 1.428 -1.558 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.801 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 70.8 t . . . . . 0 N--CA 1.445 -0.692 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 70.9 m -98.81 122.42 42.03 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-O 121.613 0.72 . . . . 0.0 110.072 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? . . . . . 0 C--N 1.277 -2.555 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.037 -177.096 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.4 m . . . . . 0 N--CA 1.437 -1.104 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 34.7 m -100.18 121.72 41.89 Favored 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 119.545 -0.862 . . . . 0.0 110.98 -175.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -127.64 121.96 31.84 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 114.497 -1.229 . . . . 0.0 107.79 -176.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 64.32 27.7 13.75 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.228 1.013 . . . . 0.0 109.542 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.53 9.18 87.25 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.037 -0.983 . . . . 0.0 112.715 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.0 t -111.81 130.24 65.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 58.4 m -99.8 116.66 32.39 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 122.139 0.971 . . . . 0.0 112.203 -175.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 . . . . . 0 C--N 1.288 -2.085 0 CA-C-N 113.88 -1.509 . . . . 0.0 109.887 -177.603 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.9 t . . . . . 0 N--CA 1.443 -0.814 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.5 m -103.94 133.95 48.04 Favored 'General case' 0 C--N 1.295 -1.791 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.834 -178.084 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.199 -177.799 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.0 t . . . . . 0 N--CA 1.445 -0.683 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 78.4 m -95.79 124.56 39.86 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 121.473 0.654 . . . . 0.0 110.948 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 . . . . . 0 C--N 1.284 -2.28 0 CA-C-N 114.572 -1.194 . . . . 0.0 108.296 -179.693 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.0 m . . . . . 0 N--CA 1.439 -1.025 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 75.5 m -130.91 138.55 49.83 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -137.29 109.77 7.43 Favored 'General case' 0 N--CA 1.422 -1.87 0 CA-C-O 120.924 0.392 . . . . 0.0 110.273 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 57.41 41.15 26.7 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 122.772 1.272 . . . . 0.0 110.531 178.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.22 -9.13 78.43 Favored Glycine 0 N--CA 1.436 -1.301 0 CA-C-N 114.6 -1.182 . . . . 0.0 113.086 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.1 t -99.98 110.1 26.32 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 70.7 m -90.24 128.7 36.46 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-O 121.374 0.607 . . . . 0.0 110.742 178.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 . . . . . 0 C--N 1.293 -1.871 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.886 -176.411 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 40.5 t . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 85.8 m -102.12 131.06 48.84 Favored 'General case' 0 C--N 1.293 -1.864 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.026 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 . . . . . 0 N--CA 1.435 -1.217 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.021 -175.584 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 N--CA 1.443 -0.807 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 85.8 m -96.62 128.93 44.03 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-O 121.762 0.791 . . . . 0.0 111.325 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 . . . . . 0 C--N 1.296 -1.726 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.736 -177.819 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.7 m . . . . . 0 N--CA 1.442 -0.849 0 CA-C-O 121.069 0.462 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -94.17 136.27 34.64 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-O 122.166 0.984 . . . . 0.0 112.491 -178.593 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -135.37 116.67 14.55 Favored 'General case' 0 N--CA 1.416 -2.131 0 CA-C-N 113.508 -1.678 . . . . 0.0 108.054 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? 56.65 40.03 29.48 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 122.177 0.989 . . . . 0.0 110.578 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.12 0.97 90.2 Favored Glycine 0 C--N 1.314 -0.68 0 CA-C-N 115.18 -0.918 . . . . 0.0 113.413 176.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.68 120.27 62.4 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 6.0 m -86.58 129.8 34.73 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-O 122.533 1.159 . . . . 0.0 113.773 178.338 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 . . . . . 0 C--N 1.278 -2.543 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.966 177.01 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 N--CA 1.442 -0.838 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 58.1 m -112.54 137.65 50.46 Favored 'General case' 0 C--N 1.292 -1.924 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.233 -178.002 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 . . . . . 0 C--N 1.312 -1.036 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -179.039 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.044 0 CA-C-O 120.27 -0.184 . . . . 0.0 113.434 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.8 t -112.54 113.16 43.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 117.341 0.57 . . . . 0.0 109.575 -177.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.5 m -89.95 123.97 34.32 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-O 121.752 0.787 . . . . 0.0 110.239 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -119.5 123.25 43.54 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.36 -176.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ABA . . . . . 0.421 ' HA ' ' HA ' ' A' ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -118.53 126.72 75.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 59.5 m -106.42 131.2 53.9 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.355 -178.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -138.33 120.84 16.12 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 63.97 29.79 14.31 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.364 1.066 . . . . 0.0 109.543 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.62 1.95 90.35 Favored Glycine 0 N--CA 1.441 -1.016 0 CA-C-N 115.168 -0.924 . . . . 0.0 112.479 -178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.5 t -99.56 111.87 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.6 m -92.72 124.94 37.1 Favored 'General case' 0 C--N 1.289 -2.028 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.134 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -122.3 126.13 47.46 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 114.691 -1.141 . . . . 0.0 109.965 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ABA . . . . . 0.421 ' HA ' ' HA ' ' A' ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.6 m -97.34 139.44 19.78 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 178.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.7 m -111.33 131.52 55.11 Favored 'General case' 0 C--N 1.287 -2.13 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.183 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -135.56 109.37 8.1 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-O 121.183 0.516 . . . . 0.0 110.122 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 . . . . . 0 CA--C 1.546 0.825 0 C-N-CA 125.032 1.333 . . . . 0.0 111.719 177.733 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.944 0 N-CA-C 112.692 -0.163 . . . . 0.0 112.692 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 68.8 t -105.22 126.22 60.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.9 m -97.45 125.16 41.94 Favored 'General case' 0 C--N 1.285 -2.205 0 C-N-CA 119.235 -0.986 . . . . 0.0 111.552 -179.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -119.17 121.49 39.86 Favored 'General case' 0 C--N 1.283 -2.298 0 CA-C-N 114.328 -1.305 . . . . 0.0 109.432 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.7 m -89.62 144.33 9.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 60.8 m -124.95 139.3 53.95 Favored 'General case' 0 C--N 1.288 -2.074 0 C-N-CA 118.544 -1.262 . . . . 0.0 111.397 -177.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -153.65 127.46 8.84 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.292 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 62.44 32.45 16.73 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.584 1.154 . . . . 0.0 110.125 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.73 0.04 89.82 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.578 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.8 t -107.44 119.55 57.24 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.029 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.1 m -98.28 123.84 42.58 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.795 0.807 . . . . 0.0 110.872 177.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.401 ' NE ' ' HA ' ' A' ' 13' ' ' ARG . 1.6 tpm_? -109.09 123.61 49.45 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.228 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 99.0 t -95.33 108.19 20.6 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 64.9 m -95.23 123.3 38.66 Favored 'General case' 0 C--N 1.29 -2.021 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -139.3 129.32 25.07 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.042 -175.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 122.083 0.944 . . . . 0.0 109.593 -178.389 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.931 0 N-CA-C 113.05 -0.02 . . . . 0.0 113.05 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.3 t -102.28 115.37 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 84.1 m -95.85 128.96 43.18 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -175.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.8 tpm_? -111.07 121.99 46.73 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 113.927 -1.488 . . . . 0.0 107.865 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.1 m -111.0 128.84 67.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.8 m -99.88 124.55 45.31 Favored 'General case' 0 C--N 1.291 -1.955 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.414 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -136.7 118.8 15.43 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.778 -175.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 59.45 34.76 22.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.721 1.248 . . . . 0.0 110.573 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.55 -8.42 74.52 Favored Glycine 0 N--CA 1.43 -1.727 0 CA-C-N 114.511 -1.222 . . . . 0.0 113.733 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.9 t -108.44 116.55 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 117.359 0.579 . . . . 0.0 109.672 -176.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 64.9 m -84.44 115.96 22.83 Favored 'General case' 0 N--CA 1.419 -2.0 0 CA-C-O 121.917 0.865 . . . . 0.0 110.119 175.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -110.67 120.81 43.62 Favored 'General case' 0 C--N 1.283 -2.296 0 CA-C-N 113.65 -1.614 . . . . 0.0 108.703 -178.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.1 m -111.6 130.12 65.74 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 62.0 m -111.33 130.39 55.69 Favored 'General case' 0 C--N 1.283 -2.308 0 C-N-CA 119.861 -0.735 . . . . 0.0 110.606 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -126.18 109.85 12.8 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 . . . . . 0 CA--C 1.542 0.662 0 CA-C-O 122.238 1.018 . . . . 0.0 110.246 177.826 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.03 0 CA-C-O 120.339 -0.145 . . . . 0.0 112.881 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 92.0 t -120.79 127.25 75.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 117.3 0.55 . . . . 0.0 109.91 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 90.4 m -95.7 129.86 42.78 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 121.255 0.55 . . . . 0.0 110.68 176.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -115.14 120.32 39.36 Favored 'General case' 0 C--N 1.279 -2.479 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 m -116.07 132.86 64.35 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 55.6 m -108.64 139.3 43.61 Favored 'General case' 0 C--N 1.288 -2.072 0 C-N-CA 119.974 -0.691 . . . . 0.0 109.782 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -151.32 134.04 15.64 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.706 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 49.0 ttp180 61.78 25.0 14.98 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.182 0.991 . . . . 0.0 109.764 -178.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.56 -3.37 87.26 Favored Glycine 0 N--CA 1.439 -1.157 0 CA-C-N 115.131 -0.941 . . . . 0.0 112.602 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.9 t -103.55 126.85 57.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -176.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 71.2 m -96.0 130.83 42.89 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.77 0.795 . . . . 0.0 112.074 179.461 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -113.95 126.46 55.18 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.812 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.0 t -112.54 108.11 24.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 78.4 m -106.17 132.63 52.01 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.111 -178.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -164.13 145.3 8.56 Favored 'General case' 0 CA--C 1.502 -0.888 0 O-C-N 123.415 0.447 . . . . 0.0 110.717 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 . . . . . 0 N--CA 1.475 0.812 0 C-N-CA 125.227 1.411 . . . . 0.0 110.567 177.831 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.601 0 N-CA-C 112.491 -0.244 . . . . 0.0 112.491 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 50.1 t -103.75 107.96 23.46 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.8 m -90.58 121.71 32.74 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-O 121.335 0.588 . . . . 0.0 110.306 179.144 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -119.02 125.25 48.94 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.179 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.9 t -82.47 106.92 13.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 40.5 m -96.93 123.91 40.76 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-O 121.242 0.544 . . . . 0.0 110.826 -177.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 75.3 mtt180 -134.0 121.52 21.72 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.459 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 63.62 30.72 14.88 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 122.672 1.225 . . . . 0.0 110.037 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.18 8.78 87.6 Favored Glycine 0 C--N 1.308 -1.004 0 CA-C-N 115.021 -0.99 . . . . 0.0 112.028 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.9 t -107.29 108.37 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.7 m -91.3 117.47 29.68 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-O 121.497 0.665 . . . . 0.0 111.011 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.434 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 17.7 tpt180 -105.44 120.84 42.62 Favored 'General case' 0 C--N 1.275 -2.646 0 CA-C-N 114.856 -1.066 . . . . 0.0 109.142 177.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.7 m -95.3 123.58 47.51 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.6 m -101.14 124.92 47.6 Favored 'General case' 0 C--N 1.29 -2.0 0 C-N-CA 119.653 -0.819 . . . . 0.0 109.532 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -131.22 112.66 13.01 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.444 -0.798 . . . . 0.0 108.901 -176.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 . . . . . 0 CA--C 1.545 0.782 0 CA-C-O 122.573 1.178 . . . . 0.0 109.984 177.185 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.496 0 N-CA-C 112.535 -0.226 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.23 120.9 51.43 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.093 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 177.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 85.2 m -105.45 135.61 46.53 Favored 'General case' 0 C--N 1.282 -2.362 0 C-N-CA 119.584 -0.846 . . . . 0.0 112.929 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -115.12 120.53 40.09 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.875 175.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.1 m -116.85 133.69 62.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 176.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 55.7 m -110.78 134.04 52.84 Favored 'General case' 0 C--N 1.284 -2.261 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.065 -178.308 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 65.0 mtm180 -132.24 116.63 17.18 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 59.75 33.93 21.89 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 122.048 0.928 . . . . 0.0 110.237 178.316 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.01 -2.88 87.2 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.844 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.7 t -101.96 114.8 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.7 m -92.49 126.84 37.75 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-O 121.682 0.753 . . . . 0.0 111.564 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.3 tpt85 -117.81 120.54 38.23 Favored 'General case' 0 C--N 1.287 -2.136 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.195 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.7 m -104.36 125.14 59.2 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.3 m -108.38 144.43 35.96 Favored 'General case' 0 C--N 1.284 -2.246 0 C-N-CA 119.744 -0.782 . . . . 0.0 111.182 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -142.64 120.35 11.87 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 175.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 . . . . . 0 N--CA 1.482 1.163 0 CA-C-O 122.254 1.026 . . . . 0.0 110.317 178.481 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.056 0 CA-C-O 120.062 -0.299 . . . . 0.0 113.315 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.9 t -128.49 124.96 62.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 88.3 m -96.03 121.87 38.25 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-O 121.516 0.674 . . . . 0.0 110.323 176.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -117.59 121.2 40.3 Favored 'General case' 0 C--N 1.279 -2.493 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.257 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p -107.89 134.83 48.52 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.2 m -115.29 136.69 52.83 Favored 'General case' 0 C--N 1.294 -1.838 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.942 -178.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -129.52 109.64 11.2 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.337 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 63.06 29.03 16.33 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.662 1.185 . . . . 0.0 110.032 178.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.73 -13.1 59.47 Favored Glycine 0 N--CA 1.434 -1.463 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.844 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.7 t -91.75 111.39 23.97 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.001 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 -177.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.3 m -93.82 131.07 39.57 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 119.691 -0.803 . . . . 0.0 111.944 -178.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 -123.45 121.72 36.43 Favored 'General case' 0 C--N 1.29 -1.994 0 CA-C-N 114.473 -1.239 . . . . 0.0 110.123 178.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.6 t -91.08 111.72 24.17 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.732 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 69.9 m -100.08 122.26 42.67 Favored 'General case' 0 C--N 1.289 -2.06 0 C-N-CA 119.524 -0.87 . . . . 0.0 109.662 178.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -146.69 131.0 17.52 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.559 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 . . . . . 0 CA--C 1.536 0.413 0 C-N-CA 125.594 1.558 . . . . 0.0 111.532 179.377 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.565 0 CA-C-O 120.31 -0.161 . . . . 0.0 113.254 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.5 t -106.76 121.73 59.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 77.2 m -100.56 132.36 45.99 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.705 0.764 . . . . 0.0 112.706 -176.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -117.57 120.82 39.24 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.485 177.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.4 t -115.94 121.94 68.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.9 m -101.81 128.07 48.33 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 120.273 -0.571 . . . . 0.0 111.019 -177.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 28.8 mmm180 -136.55 127.71 27.99 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.812 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.2 tpp180 60.85 31.92 20.05 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 122.128 0.966 . . . . 0.0 110.629 175.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.81 14.61 81.85 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.584 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.3 t -122.02 119.82 59.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.7 m -91.19 119.28 31.15 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-O 121.933 0.873 . . . . 0.0 112.166 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -98.82 120.51 39.37 Favored 'General case' 0 C--N 1.279 -2.468 0 CA-C-N 113.96 -1.473 . . . . 0.0 108.337 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.4 t -112.58 139.56 36.85 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.038 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 177.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 70.0 m -125.11 133.88 52.68 Favored 'General case' 0 C--N 1.288 -2.102 0 C-N-CA 119.801 -0.76 . . . . 0.0 109.717 178.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -133.12 112.67 11.95 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -176.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 . . . . . 0 C--N 1.312 -1.051 0 C-N-CA 124.667 1.187 . . . . 0.0 110.737 177.328 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.29 0 CA-C-O 120.001 -0.333 . . . . 0.0 113.53 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.0 t -126.66 128.42 71.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 78.2 m -96.48 124.81 40.59 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.634 0.731 . . . . 0.0 111.669 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -103.09 128.41 50.0 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.671 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.5 t -105.63 106.48 20.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 77.6 m -106.58 137.12 45.16 Favored 'General case' 0 C--N 1.288 -2.086 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.13 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -145.15 119.3 9.46 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.16 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 59.57 35.58 22.63 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.927 0.891 . . . . 0.0 110.959 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.48 11.29 85.63 Favored Glycine 0 C--N 1.313 -0.73 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.442 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.92 114.33 46.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.0 m -101.35 131.62 47.33 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.748 0.785 . . . . 0.0 112.533 -178.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -119.33 130.58 55.44 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-N 113.978 -1.465 . . . . 0.0 109.133 177.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m -111.01 126.36 68.39 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.284 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 177.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 62.2 m -104.08 124.8 49.72 Favored 'General case' 0 C--N 1.284 -2.242 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.093 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -138.31 127.99 25.06 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -176.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 . . . . . 0 C--N 1.318 -0.798 0 C-N-CA 124.411 1.084 . . . . 0.0 110.946 176.501 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.117 0 CA-C-O 120.383 -0.121 . . . . 0.0 112.973 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 55.3 t -118.2 128.12 75.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 79.8 m -92.89 130.19 38.56 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 121.312 0.577 . . . . 0.0 111.723 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -113.93 121.37 43.73 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.807 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p -105.53 138.52 30.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.9 m -113.7 130.76 56.37 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.085 -176.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.4 mtm180 -135.3 126.26 27.68 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 59.02 36.39 24.36 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-O 122.089 0.947 . . . . 0.0 110.504 177.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.86 14.32 78.44 Favored Glycine 0 C--O 1.245 0.795 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.67 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 51.0 t -118.69 118.8 59.06 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 78.8 m -93.2 130.07 39.01 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-O 121.64 0.733 . . . . 0.0 111.94 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -115.54 121.89 44.04 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.564 -1.198 . . . . 0.0 108.951 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 56.7 t -119.45 125.81 74.74 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.5 m -101.47 133.31 46.3 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 120.822 0.344 . . . . 0.0 110.891 -179.136 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 ptp180 -147.11 128.51 14.92 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.854 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 64.8 ttt180 . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 122.458 1.123 . . . . 0.0 110.862 177.217 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.449 0 CA-C-O 121.037 0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.4 t -114.91 120.16 63.75 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 -179.108 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.6 m -94.38 127.88 40.55 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 121.344 0.592 . . . . 0.0 110.52 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -124.85 122.96 38.89 Favored 'General case' 0 C--N 1.281 -2.376 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.842 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 41.8 t -98.95 119.53 47.06 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.496 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 59.7 m -98.62 123.4 42.79 Favored 'General case' 0 C--N 1.286 -2.165 0 C-N-CA 119.43 -0.908 . . . . 0.0 110.071 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.5 ptp180 -148.47 137.77 21.91 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.967 -177.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 42.3 ttt180 66.37 26.32 10.21 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 122.455 1.122 . . . . 0.0 109.735 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.01 15.69 81.44 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 114.567 -1.197 . . . . 0.0 112.573 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.1 t -129.11 129.86 67.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.496 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 72.3 m -92.19 125.68 36.96 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.555 0.693 . . . . 0.0 110.732 177.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? -115.58 120.8 40.63 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.551 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 m -101.43 121.05 51.86 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-O 121.471 0.653 . . . . 0.0 109.884 -179.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 70.1 m -102.44 134.82 45.14 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.83 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -153.5 131.39 11.68 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.206 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 . . . . . 0 CA--C 1.551 0.991 0 CA-C-O 122.632 1.206 . . . . 0.0 110.536 177.071 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.14 0 CA-C-O 120.278 -0.179 . . . . 0.0 112.937 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.1 t -110.46 121.06 62.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 61.4 m -88.53 113.9 24.6 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 122.726 1.25 . . . . 0.0 111.97 -178.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 32.1 tpt180 -99.54 122.83 43.17 Favored 'General case' 0 C--N 1.287 -2.148 0 CA-C-N 113.268 -1.787 . . . . 0.0 109.446 -176.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.1 t -104.84 115.65 47.13 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 176.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 49.2 m -99.15 135.58 40.34 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-O 120.944 0.402 . . . . 0.0 110.838 -178.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -139.19 120.35 14.69 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 58.83 36.59 24.78 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 122.174 0.988 . . . . 0.0 110.987 176.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.14 -2.25 87.62 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.262 -0.881 . . . . 0.0 113.444 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.7 t -109.35 126.08 66.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.3 m -99.63 131.54 45.55 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.641 -178.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -111.53 121.73 45.94 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.674 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -94.89 124.56 47.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.366 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 36.3 m -95.01 124.06 38.84 Favored 'General case' 0 C--N 1.285 -2.226 0 CA-C-O 121.586 0.708 . . . . 0.0 110.422 -177.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 30.6 mmm180 -127.36 113.81 16.73 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 114.443 -1.253 . . . . 0.0 107.784 -175.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 . . . . . 0 CA--C 1.551 0.995 0 CA-C-O 122.267 1.032 . . . . 0.0 110.573 177.872 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.646 0 N-CA-C 112.367 -0.293 . . . . 0.0 112.367 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 56.9 t -116.99 113.18 42.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 82.6 m -86.44 131.56 34.16 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 121.642 0.734 . . . . 0.0 111.851 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 -127.1 121.93 32.85 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.994 -179.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p -113.62 132.26 63.06 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.929 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 177.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 46.7 m -105.28 136.74 44.25 Favored 'General case' 0 C--N 1.287 -2.152 0 C-N-CA 119.771 -0.771 . . . . 0.0 111.051 -177.207 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 78.8 mtp180 -129.78 109.19 10.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 55.43 42.64 29.79 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 124.82 1.248 . . . . 0.0 111.187 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.9 -5.54 84.74 Favored Glycine 0 N--CA 1.442 -0.949 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.873 177.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 48.2 t -101.31 108.98 24.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -179.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 65.3 m -90.75 129.7 36.8 Favored 'General case' 0 C--N 1.296 -1.723 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.074 -179.273 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -119.65 124.3 45.95 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.251 179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.3 m -96.35 135.91 28.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 176.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 53.8 m -116.27 128.99 56.05 Favored 'General case' 0 C--N 1.281 -2.382 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.086 -177.223 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 -133.6 124.52 27.0 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.746 -177.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 . . . . . 0 CA--C 1.546 0.797 0 CA-C-O 122.204 1.002 . . . . 0.0 110.314 178.529 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.051 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 48.7 t -122.13 135.15 63.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -176.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.4 m -101.79 124.76 47.97 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 121.813 0.816 . . . . 0.0 111.012 177.648 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 5.2 tpm_? -111.82 120.86 43.41 Favored 'General case' 0 C--N 1.281 -2.378 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.216 -178.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -97.88 112.37 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.096 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 50.2 m -96.64 127.91 43.08 Favored 'General case' 0 C--N 1.277 -2.564 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.831 -178.055 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -120.07 109.05 15.02 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.656 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 46.93 51.81 12.31 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 124.595 1.184 . . . . 0.0 111.169 178.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.55 -0.24 86.72 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.181 -0.918 . . . . 0.0 114.168 174.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.3 t -116.04 114.63 46.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 117.748 0.774 . . . . 0.0 108.916 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.2 m -91.0 127.5 36.45 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.629 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -115.94 124.93 51.8 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.743 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.6 m -117.05 135.51 57.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.5 m -112.41 139.24 48.15 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 120.211 -0.595 . . . . 0.0 110.029 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -159.06 140.49 13.17 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? . . . . . 0 N--CA 1.481 1.106 0 CA-C-O 122.296 1.046 . . . . 0.0 111.141 174.832 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.552 0 CA-C-O 120.432 -0.094 . . . . 0.0 113.224 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 57.6 t -94.16 114.01 29.94 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.813 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 73.4 m -97.92 126.91 43.54 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-O 121.544 0.688 . . . . 0.0 112.724 -175.31 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 -111.79 123.13 49.6 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.465 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 99.3 t -94.76 106.32 18.02 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.569 -177.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.8 m -96.7 129.94 44.02 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -152.71 128.98 10.51 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.494 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 63.47 31.15 15.11 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 122.246 1.022 . . . . 0.0 110.473 176.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.69 10.03 86.2 Favored Glycine 0 C--N 1.31 -0.899 0 CA-C-N 115.318 -0.856 . . . . 0.0 112.083 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.5 t -115.98 120.5 65.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.2 m -100.41 116.35 32.17 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-O 121.85 0.833 . . . . 0.0 110.898 177.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -117.72 127.9 54.37 Favored 'General case' 0 C--N 1.278 -2.517 0 CA-C-N 114.299 -1.318 . . . . 0.0 109.215 -177.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -126.54 120.17 55.56 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 175.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 58.0 m -102.02 135.86 42.86 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.342 -177.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -128.05 109.55 11.65 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 . . . . . 0 N--CA 1.475 0.811 0 C-N-CA 124.437 1.095 . . . . 0.0 110.377 177.149 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.805 0 CA-C-O 120.815 0.12 . . . . 0.0 112.98 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 56.4 t -107.64 126.5 64.0 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 -176.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 71.3 m -102.67 115.7 31.1 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 121.665 0.745 . . . . 0.0 110.721 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 -100.56 128.82 46.5 Favored 'General case' 0 C--N 1.277 -2.584 0 CA-C-N 114.21 -1.359 . . . . 0.0 108.992 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ABA . . . . . 0.461 ' HA ' ' O ' ' A' ' 13' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 34.9 m -112.81 141.68 27.62 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 35.3 m -114.62 133.44 55.83 Favored 'General case' 0 C--N 1.282 -2.339 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.244 -179.078 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -123.49 109.85 14.35 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 62.8 30.68 16.69 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 122.353 1.073 . . . . 0.0 109.263 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.47 -11.95 70.53 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 114.924 -1.035 . . . . 0.0 112.592 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.16 112.85 27.65 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.887 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -176.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 72.0 m -88.46 132.29 34.54 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-O 121.776 0.798 . . . . 0.0 113.04 -175.019 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.461 ' O ' ' HA ' ' A' ' 5' ' ' ABA . 16.3 tpp180 -108.09 121.37 44.69 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 113.881 -1.509 . . . . 0.0 107.257 173.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.4 p -131.52 133.76 61.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.83 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.7 m -106.81 135.29 48.6 Favored 'General case' 0 C--N 1.288 -2.08 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.145 178.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -153.6 128.55 9.57 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.485 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 . . . . . 0 CA--C 1.553 1.071 0 CA-C-O 122.41 1.1 . . . . 0.0 110.298 177.958 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.558 0 N-CA-C 114.543 0.577 . . . . 0.0 114.543 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.6 t -106.15 115.93 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.693 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 74.7 m -95.89 132.11 41.52 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 119.722 -0.791 . . . . 0.0 112.841 -177.165 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.6 tpm_? -118.25 120.97 39.28 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.293 179.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.5 p -103.0 136.86 33.52 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -177.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 29.1 m -105.8 138.58 41.75 Favored 'General case' 0 C--N 1.293 -1.88 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.729 -177.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -138.53 123.93 19.42 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.534 -178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 61.3 25.09 15.12 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 122.834 1.302 . . . . 0.0 110.428 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.94 -1.97 81.29 Favored Glycine 0 C--N 1.301 -1.404 0 CA-C-N 114.856 -1.065 . . . . 0.0 113.209 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.0 t -106.05 127.99 60.74 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 -179.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 66.6 m -94.62 129.82 41.33 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.714 0.768 . . . . 0.0 111.794 -177.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -119.28 124.12 45.9 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.509 -176.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t -101.94 122.57 54.32 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.597 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 60.5 m -109.39 131.87 54.66 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 119.851 -0.739 . . . . 0.0 110.153 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -114.02 108.06 16.51 Favored 'General case' 0 N--CA 1.428 -1.558 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 63.1 ttt180 . . . . . 0 CA--C 1.561 1.368 0 C-N-CA 125.345 1.458 . . . . 0.0 112.627 176.695 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.066 0 CA-C-O 120.176 -0.235 . . . . 0.0 113.536 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 70.8 t -120.18 126.55 75.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.16 0 CA-C-N 117.769 0.785 . . . . 0.0 109.447 -178.218 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 70.9 m -98.81 122.42 42.03 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-O 121.613 0.72 . . . . 0.0 110.072 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -118.85 121.85 40.98 Favored 'General case' 0 C--N 1.277 -2.555 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.037 -177.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.4 m -99.76 129.83 49.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.566 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 34.7 m -100.18 121.72 41.89 Favored 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 119.545 -0.862 . . . . 0.0 110.98 -175.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -127.64 121.96 31.84 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 114.497 -1.229 . . . . 0.0 107.79 -176.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 64.32 27.7 13.75 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.228 1.013 . . . . 0.0 109.542 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.53 9.18 87.25 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.037 -0.983 . . . . 0.0 112.715 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.0 t -111.81 130.24 65.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 58.4 m -99.8 116.66 32.39 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 122.139 0.971 . . . . 0.0 112.203 -175.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -105.54 128.28 53.5 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 113.88 -1.509 . . . . 0.0 109.887 -177.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.9 t -122.86 121.72 64.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 175.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.5 m -103.94 133.95 48.04 Favored 'General case' 0 C--N 1.295 -1.791 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.834 -178.084 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -151.4 127.12 10.21 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.199 -177.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 122.591 1.186 . . . . 0.0 111.568 176.821 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.223 0 CA-C-O 120.249 -0.195 . . . . 0.0 113.242 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.0 t -112.94 119.87 61.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 78.4 m -95.79 124.56 39.86 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 121.473 0.654 . . . . 0.0 110.948 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -110.28 120.52 42.69 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-N 114.572 -1.194 . . . . 0.0 108.296 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.0 m -130.3 167.79 24.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.358 -179.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 75.5 m -130.91 138.55 49.83 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -137.29 109.77 7.43 Favored 'General case' 0 N--CA 1.422 -1.87 0 CA-C-O 120.924 0.392 . . . . 0.0 110.273 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 57.41 41.15 26.7 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 122.772 1.272 . . . . 0.0 110.531 178.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.22 -9.13 78.43 Favored Glycine 0 N--CA 1.436 -1.301 0 CA-C-N 114.6 -1.182 . . . . 0.0 113.086 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.1 t -99.98 110.1 26.32 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 70.7 m -90.24 128.7 36.46 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-O 121.374 0.607 . . . . 0.0 110.742 178.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -129.99 137.73 50.44 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.886 -176.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 40.5 t -87.32 122.74 39.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.04 -175.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 85.8 m -102.12 131.06 48.84 Favored 'General case' 0 C--N 1.293 -1.864 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.026 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -145.17 117.59 8.51 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.021 -175.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 tmm_? . . . . . 0 CA--C 1.545 0.782 0 CA-C-O 122.446 1.117 . . . . 0.0 110.697 178.163 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.912 0 N-CA-C 112.602 -0.199 . . . . 0.0 112.602 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.3 t -115.75 129.52 71.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 85.8 m -96.62 128.93 44.03 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-O 121.762 0.791 . . . . 0.0 111.325 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -117.65 131.17 56.69 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.736 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.7 m -90.16 123.36 42.31 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.278 0 CA-C-O 121.069 0.462 . . . . 0.0 110.32 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -94.17 136.27 34.64 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-O 122.166 0.984 . . . . 0.0 112.491 -178.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -135.37 116.67 14.55 Favored 'General case' 0 N--CA 1.416 -2.131 0 CA-C-N 113.508 -1.678 . . . . 0.0 108.054 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? 56.65 40.03 29.48 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 122.177 0.989 . . . . 0.0 110.578 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.12 0.97 90.2 Favored Glycine 0 C--N 1.314 -0.68 0 CA-C-N 115.18 -0.918 . . . . 0.0 113.413 176.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.68 120.27 62.4 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 6.0 m -86.58 129.8 34.73 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-O 122.533 1.159 . . . . 0.0 113.773 178.338 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -105.95 127.42 53.13 Favored 'General case' 0 C--N 1.278 -2.543 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.966 177.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.9 p -122.26 137.32 56.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 58.1 m -112.54 137.65 50.46 Favored 'General case' 0 C--N 1.292 -1.924 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.233 -178.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -148.94 131.38 15.71 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 122.445 1.117 . . . . 0.0 110.469 178.853 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.8 t . . . . . 0 N--CA 1.442 -0.852 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.5 m -89.95 123.97 34.32 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-O 121.752 0.787 . . . . 0.0 110.239 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 . . . . . 0 C--N 1.289 -2.028 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.36 -176.583 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.435 -1.204 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 59.5 m -106.42 131.2 53.9 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.355 -178.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -138.33 120.84 16.12 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 63.97 29.79 14.31 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.364 1.066 . . . . 0.0 109.543 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.62 1.95 90.35 Favored Glycine 0 N--CA 1.441 -1.016 0 CA-C-N 115.168 -0.924 . . . . 0.0 112.479 -178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.5 t -99.56 111.87 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.6 m -92.72 124.94 37.1 Favored 'General case' 0 C--N 1.289 -2.028 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.134 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 . . . . . 0 C--N 1.284 -2.243 0 CA-C-N 114.691 -1.141 . . . . 0.0 109.965 -179.63 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.6 m . . . . . 0 N--CA 1.439 -0.991 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.7 m -111.33 131.52 55.11 Favored 'General case' 0 C--N 1.287 -2.13 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.183 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 . . . . . 0 N--CA 1.424 -1.741 0 CA-C-O 121.183 0.516 . . . . 0.0 110.122 -174.579 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 68.8 t . . . . . 0 CA--C 1.5 -0.974 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.9 m -97.45 125.16 41.94 Favored 'General case' 0 C--N 1.285 -2.205 0 C-N-CA 119.235 -0.986 . . . . 0.0 111.552 -179.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 . . . . . 0 C--N 1.283 -2.298 0 CA-C-N 114.328 -1.305 . . . . 0.0 109.432 178.755 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 60.8 m -124.95 139.3 53.95 Favored 'General case' 0 C--N 1.288 -2.074 0 C-N-CA 118.544 -1.262 . . . . 0.0 111.397 -177.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -153.65 127.46 8.84 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.292 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 62.44 32.45 16.73 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.584 1.154 . . . . 0.0 110.125 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.73 0.04 89.82 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.578 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.8 t -107.44 119.55 57.24 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.029 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.1 m -98.28 123.84 42.58 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.795 0.807 . . . . 0.0 110.872 177.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.401 ' NE ' ' HA ' ' A' ' 13' ' ' ARG . 1.6 tpm_? . . . . . 0 C--N 1.285 -2.227 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.228 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 99.0 t . . . . . 0 N--CA 1.427 -1.62 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 64.9 m -95.23 123.3 38.66 Favored 'General case' 0 C--N 1.29 -2.021 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 . . . . . 0 C--N 1.293 -1.871 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.042 -175.904 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 N--CA 1.439 -1.015 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 84.1 m -95.85 128.96 43.18 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -175.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.8 tpm_? . . . . . 0 C--N 1.297 -1.682 0 CA-C-N 113.927 -1.488 . . . . 0.0 107.865 178.303 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.439 -0.981 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.8 m -99.88 124.55 45.31 Favored 'General case' 0 C--N 1.291 -1.955 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.414 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -136.7 118.8 15.43 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.778 -175.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 59.45 34.76 22.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.721 1.248 . . . . 0.0 110.573 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.55 -8.42 74.52 Favored Glycine 0 N--CA 1.43 -1.727 0 CA-C-N 114.511 -1.222 . . . . 0.0 113.733 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.9 t -108.44 116.55 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 117.359 0.579 . . . . 0.0 109.672 -176.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 64.9 m -84.44 115.96 22.83 Favored 'General case' 0 N--CA 1.419 -2.0 0 CA-C-O 121.917 0.865 . . . . 0.0 110.119 175.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? . . . . . 0 C--N 1.283 -2.296 0 CA-C-N 113.65 -1.614 . . . . 0.0 108.703 -178.162 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.1 m . . . . . 0 N--CA 1.432 -1.331 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 62.0 m -111.33 130.39 55.69 Favored 'General case' 0 C--N 1.283 -2.308 0 C-N-CA 119.861 -0.735 . . . . 0.0 110.606 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 . . . . . 0 N--CA 1.432 -1.37 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -177.581 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 92.0 t . . . . . 0 C--O 1.239 0.52 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 90.4 m -95.7 129.86 42.78 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 121.255 0.55 . . . . 0.0 110.68 176.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 . . . . . 0 C--N 1.279 -2.479 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.668 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.43 -1.45 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 55.6 m -108.64 139.3 43.61 Favored 'General case' 0 C--N 1.288 -2.072 0 C-N-CA 119.974 -0.691 . . . . 0.0 109.782 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -151.32 134.04 15.64 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.706 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 49.0 ttp180 61.78 25.0 14.98 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.182 0.991 . . . . 0.0 109.764 -178.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.56 -3.37 87.26 Favored Glycine 0 N--CA 1.439 -1.157 0 CA-C-N 115.131 -0.941 . . . . 0.0 112.602 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.9 t -103.55 126.85 57.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -176.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 71.2 m -96.0 130.83 42.89 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.77 0.795 . . . . 0.0 112.074 179.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 . . . . . 0 C--N 1.297 -1.702 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.812 -178.808 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.0 t . . . . . 0 N--CA 1.438 -1.051 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 78.4 m -106.17 132.63 52.01 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.111 -178.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 . . . . . 0 CA--C 1.502 -0.888 0 O-C-N 123.415 0.447 . . . . 0.0 110.717 179.492 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 50.1 t . . . . . 0 N--CA 1.437 -1.08 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.8 m -90.58 121.71 32.74 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-O 121.335 0.588 . . . . 0.0 110.306 179.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 . . . . . 0 C--N 1.288 -2.098 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.179 -179.798 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.9 t . . . . . 0 C--O 1.244 0.815 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 40.5 m -96.93 123.91 40.76 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-O 121.242 0.544 . . . . 0.0 110.826 -177.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 75.3 mtt180 -134.0 121.52 21.72 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.459 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 63.62 30.72 14.88 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 122.672 1.225 . . . . 0.0 110.037 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.18 8.78 87.6 Favored Glycine 0 C--N 1.308 -1.004 0 CA-C-N 115.021 -0.99 . . . . 0.0 112.028 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.9 t -107.29 108.37 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.7 m -91.3 117.47 29.68 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-O 121.497 0.665 . . . . 0.0 111.011 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.434 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 17.7 tpt180 . . . . . 0 C--N 1.275 -2.646 0 CA-C-N 114.856 -1.066 . . . . 0.0 109.142 177.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.432 -1.364 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.6 m -101.14 124.92 47.6 Favored 'General case' 0 C--N 1.29 -2.0 0 C-N-CA 119.653 -0.819 . . . . 0.0 109.532 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 . . . . . 0 C--N 1.303 -1.433 0 CA-C-N 115.444 -0.798 . . . . 0.0 108.901 -176.063 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 51.5 t . . . . . 0 CA--C 1.497 -1.093 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 85.2 m -105.45 135.61 46.53 Favored 'General case' 0 C--N 1.282 -2.362 0 C-N-CA 119.584 -0.846 . . . . 0.0 112.929 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 . . . . . 0 C--N 1.297 -1.712 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.875 175.332 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.435 -1.204 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 55.7 m -110.78 134.04 52.84 Favored 'General case' 0 C--N 1.284 -2.261 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.065 -178.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 65.0 mtm180 -132.24 116.63 17.18 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 59.75 33.93 21.89 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 122.048 0.928 . . . . 0.0 110.237 178.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.01 -2.88 87.2 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.844 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.7 t -101.96 114.8 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.7 m -92.49 126.84 37.75 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-O 121.682 0.753 . . . . 0.0 111.564 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.3 tpt85 . . . . . 0 C--N 1.287 -2.136 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.195 179.135 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.7 m . . . . . 0 N--CA 1.428 -1.575 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.3 m -108.38 144.43 35.96 Favored 'General case' 0 C--N 1.284 -2.246 0 C-N-CA 119.744 -0.782 . . . . 0.0 111.182 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 . . . . . 0 N--CA 1.44 -0.936 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 175.912 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.447 -0.609 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 88.3 m -96.03 121.87 38.25 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-O 121.516 0.674 . . . . 0.0 110.323 176.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 . . . . . 0 C--N 1.279 -2.493 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.257 -178.89 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p . . . . . 0 N--CA 1.429 -1.515 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.2 m -115.29 136.69 52.83 Favored 'General case' 0 C--N 1.294 -1.838 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.942 -178.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -129.52 109.64 11.2 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.337 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 63.06 29.03 16.33 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.662 1.185 . . . . 0.0 110.032 178.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.73 -13.1 59.47 Favored Glycine 0 N--CA 1.434 -1.463 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.844 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.7 t -91.75 111.39 23.97 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.001 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 -177.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.3 m -93.82 131.07 39.57 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 119.691 -0.803 . . . . 0.0 111.944 -178.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 . . . . . 0 C--N 1.29 -1.994 0 CA-C-N 114.473 -1.239 . . . . 0.0 110.123 178.03 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 N--CA 1.437 -1.086 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 69.9 m -100.08 122.26 42.67 Favored 'General case' 0 C--N 1.289 -2.06 0 C-N-CA 119.524 -0.87 . . . . 0.0 109.662 178.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 . . . . . 0 C--N 1.302 -1.463 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.559 -177.761 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 CA--C 1.508 -0.641 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 77.2 m -100.56 132.36 45.99 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.705 0.764 . . . . 0.0 112.706 -176.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? . . . . . 0 C--N 1.292 -1.907 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.485 177.059 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 N--CA 1.44 -0.952 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.9 m -101.81 128.07 48.33 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 120.273 -0.571 . . . . 0.0 111.019 -177.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 28.8 mmm180 -136.55 127.71 27.99 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.812 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.2 tpp180 60.85 31.92 20.05 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 122.128 0.966 . . . . 0.0 110.629 175.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.81 14.61 81.85 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.584 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.3 t -122.02 119.82 59.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.7 m -91.19 119.28 31.15 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-O 121.933 0.873 . . . . 0.0 112.166 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 . . . . . 0 C--N 1.279 -2.468 0 CA-C-N 113.96 -1.473 . . . . 0.0 108.337 179.838 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.4 t . . . . . 0 N--CA 1.434 -1.27 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 70.0 m -125.11 133.88 52.68 Favored 'General case' 0 C--N 1.288 -2.102 0 C-N-CA 119.801 -0.76 . . . . 0.0 109.717 178.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 . . . . . 0 N--CA 1.433 -1.304 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -176.981 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.0 t . . . . . 0 CA--C 1.51 -0.575 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 78.2 m -96.48 124.81 40.59 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.634 0.731 . . . . 0.0 111.669 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 . . . . . 0 C--N 1.292 -1.897 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.671 -178.419 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 N--CA 1.442 -0.861 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 77.6 m -106.58 137.12 45.16 Favored 'General case' 0 C--N 1.288 -2.086 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.13 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -145.15 119.3 9.46 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.16 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 59.57 35.58 22.63 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.927 0.891 . . . . 0.0 110.959 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.48 11.29 85.63 Favored Glycine 0 C--N 1.313 -0.73 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.442 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.92 114.33 46.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.0 m -101.35 131.62 47.33 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.748 0.785 . . . . 0.0 112.533 -178.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 . . . . . 0 C--N 1.287 -2.118 0 CA-C-N 113.978 -1.465 . . . . 0.0 109.133 177.239 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m . . . . . 0 N--CA 1.44 -0.939 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 62.2 m -104.08 124.8 49.72 Favored 'General case' 0 C--N 1.284 -2.242 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.093 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 . . . . . 0 N--CA 1.433 -1.312 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -176.061 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 55.3 t . . . . . 0 N--CA 1.442 -0.831 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 79.8 m -92.89 130.19 38.56 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 121.312 0.577 . . . . 0.0 111.723 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 . . . . . 0 C--N 1.294 -1.843 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.807 179.634 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.441 -0.895 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.9 m -113.7 130.76 56.37 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.085 -176.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.4 mtm180 -135.3 126.26 27.68 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 59.02 36.39 24.36 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-O 122.089 0.947 . . . . 0.0 110.504 177.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.86 14.32 78.44 Favored Glycine 0 C--O 1.245 0.795 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.67 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 51.0 t -118.69 118.8 59.06 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 78.8 m -93.2 130.07 39.01 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-O 121.64 0.733 . . . . 0.0 111.94 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 . . . . . 0 C--N 1.299 -1.604 0 CA-C-N 114.564 -1.198 . . . . 0.0 108.951 179.968 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 56.7 t . . . . . 0 N--CA 1.436 -1.137 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.5 m -101.47 133.31 46.3 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 120.822 0.344 . . . . 0.0 110.891 -179.136 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 ptp180 . . . . . 0 N--CA 1.433 -1.288 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.854 -177.698 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.4 t . . . . . 0 N--CA 1.435 -1.206 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.6 m -94.38 127.88 40.55 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 121.344 0.592 . . . . 0.0 110.52 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 . . . . . 0 C--N 1.281 -2.376 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.842 -179.647 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.427 -1.619 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.496 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 59.7 m -98.62 123.4 42.79 Favored 'General case' 0 C--N 1.286 -2.165 0 C-N-CA 119.43 -0.908 . . . . 0.0 110.071 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.5 ptp180 -148.47 137.77 21.91 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.967 -177.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 42.3 ttt180 66.37 26.32 10.21 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 122.455 1.122 . . . . 0.0 109.735 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.01 15.69 81.44 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 114.567 -1.197 . . . . 0.0 112.573 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.1 t -129.11 129.86 67.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.496 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 72.3 m -92.19 125.68 36.96 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.555 0.693 . . . . 0.0 110.732 177.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? . . . . . 0 C--N 1.295 -1.792 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.551 -178.384 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 m . . . . . 0 N--CA 1.43 -1.443 0 CA-C-O 121.471 0.653 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 70.1 m -102.44 134.82 45.14 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.83 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 . . . . . 0 C--N 1.313 -0.996 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.206 -179.595 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.1 t . . . . . 0 N--CA 1.446 -0.674 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 61.4 m -88.53 113.9 24.6 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 122.726 1.25 . . . . 0.0 111.97 -178.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 32.1 tpt180 . . . . . 0 C--N 1.287 -2.148 0 CA-C-N 113.268 -1.787 . . . . 0.0 109.446 -176.168 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.1 t . . . . . 0 N--CA 1.437 -1.116 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 49.2 m -99.15 135.58 40.34 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-O 120.944 0.402 . . . . 0.0 110.838 -178.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -139.19 120.35 14.69 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 58.83 36.59 24.78 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 122.174 0.988 . . . . 0.0 110.987 176.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.14 -2.25 87.62 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.262 -0.881 . . . . 0.0 113.444 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.7 t -109.35 126.08 66.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.3 m -99.63 131.54 45.55 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.641 -178.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 . . . . . 0 C--N 1.297 -1.684 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.674 179.912 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.435 -1.222 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 36.3 m -95.01 124.06 38.84 Favored 'General case' 0 C--N 1.285 -2.226 0 CA-C-O 121.586 0.708 . . . . 0.0 110.422 -177.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 30.6 mmm180 . . . . . 0 N--CA 1.424 -1.726 0 CA-C-N 114.443 -1.253 . . . . 0.0 107.784 -175.517 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 56.9 t . . . . . 0 N--CA 1.443 -0.804 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 82.6 m -86.44 131.56 34.16 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 121.642 0.734 . . . . 0.0 111.851 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 . . . . . 0 C--N 1.291 -1.956 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.994 -179.151 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.428 -1.53 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 46.7 m -105.28 136.74 44.25 Favored 'General case' 0 C--N 1.287 -2.152 0 C-N-CA 119.771 -0.771 . . . . 0.0 111.051 -177.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 78.8 mtp180 -129.78 109.19 10.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 55.43 42.64 29.79 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 124.82 1.248 . . . . 0.0 111.187 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.9 -5.54 84.74 Favored Glycine 0 N--CA 1.442 -0.949 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.873 177.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 48.2 t -101.31 108.98 24.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -179.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 65.3 m -90.75 129.7 36.8 Favored 'General case' 0 C--N 1.296 -1.723 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.074 -179.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 . . . . . 0 C--N 1.294 -1.814 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.251 179.495 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.3 m . . . . . 0 N--CA 1.437 -1.095 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 53.8 m -116.27 128.99 56.05 Favored 'General case' 0 C--N 1.281 -2.382 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.086 -177.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 . . . . . 0 C--N 1.301 -1.51 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.746 -177.776 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 48.7 t . . . . . 0 N--CA 1.447 -0.585 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.4 m -101.79 124.76 47.97 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 121.813 0.816 . . . . 0.0 111.012 177.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 5.2 tpm_? . . . . . 0 C--N 1.281 -2.378 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.216 -178.413 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.417 -2.096 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 50.2 m -96.64 127.91 43.08 Favored 'General case' 0 C--N 1.277 -2.564 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.831 -178.055 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -120.07 109.05 15.02 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.656 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 46.93 51.81 12.31 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 124.595 1.184 . . . . 0.0 111.169 178.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.55 -0.24 86.72 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.181 -0.918 . . . . 0.0 114.168 174.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.3 t -116.04 114.63 46.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 117.748 0.774 . . . . 0.0 108.916 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.2 m -91.0 127.5 36.45 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 . . . . . 0 C--N 1.298 -1.656 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.743 179.05 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.6 m . . . . . 0 N--CA 1.439 -1.02 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.5 m -112.41 139.24 48.15 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 120.211 -0.595 . . . . 0.0 110.029 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 . . . . . 0 C--N 1.308 -1.224 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.115 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 CA--C 1.504 -0.813 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 73.4 m -97.92 126.91 43.54 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-O 121.544 0.688 . . . . 0.0 112.724 -175.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 . . . . . 0 C--N 1.296 -1.758 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.465 179.697 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 99.3 t . . . . . 0 N--CA 1.438 -1.026 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.8 m -96.7 129.94 44.02 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -152.71 128.98 10.51 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.494 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 63.47 31.15 15.11 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 122.246 1.022 . . . . 0.0 110.473 176.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.69 10.03 86.2 Favored Glycine 0 C--N 1.31 -0.899 0 CA-C-N 115.318 -0.856 . . . . 0.0 112.083 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.5 t -115.98 120.5 65.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.2 m -100.41 116.35 32.17 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-O 121.85 0.833 . . . . 0.0 110.898 177.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 . . . . . 0 C--N 1.278 -2.517 0 CA-C-N 114.299 -1.318 . . . . 0.0 109.215 -177.925 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.432 -1.352 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 58.0 m -102.02 135.86 42.86 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.342 -177.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 . . . . . 0 C--N 1.308 -1.209 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.525 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 56.4 t . . . . . 0 N--CA 1.442 -0.856 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 71.3 m -102.67 115.7 31.1 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 121.665 0.745 . . . . 0.0 110.721 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 . . . . . 0 C--N 1.277 -2.584 0 CA-C-N 114.21 -1.359 . . . . 0.0 108.992 -177.846 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 34.9 m . . . . . 0 N--CA 1.437 -1.077 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 35.3 m -114.62 133.44 55.83 Favored 'General case' 0 C--N 1.282 -2.339 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.244 -179.078 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -123.49 109.85 14.35 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 62.8 30.68 16.69 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 122.353 1.073 . . . . 0.0 109.263 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.47 -11.95 70.53 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 114.924 -1.035 . . . . 0.0 112.592 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.16 112.85 27.65 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.887 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -176.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 72.0 m -88.46 132.29 34.54 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-O 121.776 0.798 . . . . 0.0 113.04 -175.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 . . . . . 0 C--N 1.293 -1.865 0 CA-C-N 113.881 -1.509 . . . . 0.0 107.257 173.98 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.4 p . . . . . 0 N--CA 1.433 -1.293 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.7 m -106.81 135.29 48.6 Favored 'General case' 0 C--N 1.288 -2.08 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.145 178.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 . . . . . 0 N--CA 1.432 -1.362 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.485 -178.494 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.6 t . . . . . 0 CA--C 1.507 -0.693 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 74.7 m -95.89 132.11 41.52 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 119.722 -0.791 . . . . 0.0 112.841 -177.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.6 tpm_? . . . . . 0 C--N 1.3 -1.549 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.293 179.534 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.5 p . . . . . 0 N--CA 1.435 -1.192 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 29.1 m -105.8 138.58 41.75 Favored 'General case' 0 C--N 1.293 -1.88 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.729 -177.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -138.53 123.93 19.42 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.534 -178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 61.3 25.09 15.12 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 122.834 1.302 . . . . 0.0 110.428 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.94 -1.97 81.29 Favored Glycine 0 C--N 1.301 -1.404 0 CA-C-N 114.856 -1.065 . . . . 0.0 113.209 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.0 t -106.05 127.99 60.74 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 -179.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 66.6 m -94.62 129.82 41.33 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.714 0.768 . . . . 0.0 111.794 -177.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 . . . . . 0 C--N 1.297 -1.676 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.509 -176.57 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.439 -0.979 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 60.5 m -109.39 131.87 54.66 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 119.851 -0.739 . . . . 0.0 110.153 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 . . . . . 0 N--CA 1.428 -1.558 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.801 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 70.8 t . . . . . 0 N--CA 1.445 -0.692 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 70.9 m -98.81 122.42 42.03 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-O 121.613 0.72 . . . . 0.0 110.072 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? . . . . . 0 C--N 1.277 -2.555 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.037 -177.096 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.4 m . . . . . 0 N--CA 1.437 -1.104 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 34.7 m -100.18 121.72 41.89 Favored 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 119.545 -0.862 . . . . 0.0 110.98 -175.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -127.64 121.96 31.84 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 114.497 -1.229 . . . . 0.0 107.79 -176.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 64.32 27.7 13.75 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.228 1.013 . . . . 0.0 109.542 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.53 9.18 87.25 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.037 -0.983 . . . . 0.0 112.715 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.0 t -111.81 130.24 65.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 58.4 m -99.8 116.66 32.39 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 122.139 0.971 . . . . 0.0 112.203 -175.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 . . . . . 0 C--N 1.288 -2.085 0 CA-C-N 113.88 -1.509 . . . . 0.0 109.887 -177.603 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.9 t . . . . . 0 N--CA 1.443 -0.814 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.5 m -103.94 133.95 48.04 Favored 'General case' 0 C--N 1.295 -1.791 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.834 -178.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.199 -177.799 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.0 t . . . . . 0 N--CA 1.445 -0.683 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 78.4 m -95.79 124.56 39.86 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 121.473 0.654 . . . . 0.0 110.948 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 . . . . . 0 C--N 1.284 -2.28 0 CA-C-N 114.572 -1.194 . . . . 0.0 108.296 -179.693 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.0 m . . . . . 0 N--CA 1.439 -1.025 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 75.5 m -130.91 138.55 49.83 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -137.29 109.77 7.43 Favored 'General case' 0 N--CA 1.422 -1.87 0 CA-C-O 120.924 0.392 . . . . 0.0 110.273 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 57.41 41.15 26.7 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 122.772 1.272 . . . . 0.0 110.531 178.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.22 -9.13 78.43 Favored Glycine 0 N--CA 1.436 -1.301 0 CA-C-N 114.6 -1.182 . . . . 0.0 113.086 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.1 t -99.98 110.1 26.32 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 70.7 m -90.24 128.7 36.46 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-O 121.374 0.607 . . . . 0.0 110.742 178.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 . . . . . 0 C--N 1.293 -1.871 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.886 -176.411 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 40.5 t . . . . . 0 N--CA 1.447 -0.618 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 85.8 m -102.12 131.06 48.84 Favored 'General case' 0 C--N 1.293 -1.864 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.026 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 . . . . . 0 N--CA 1.435 -1.217 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.021 -175.584 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 N--CA 1.443 -0.807 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 85.8 m -96.62 128.93 44.03 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-O 121.762 0.791 . . . . 0.0 111.325 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 . . . . . 0 C--N 1.296 -1.726 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.736 -177.819 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.7 m . . . . . 0 N--CA 1.442 -0.849 0 CA-C-O 121.069 0.462 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -94.17 136.27 34.64 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-O 122.166 0.984 . . . . 0.0 112.491 -178.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -135.37 116.67 14.55 Favored 'General case' 0 N--CA 1.416 -2.131 0 CA-C-N 113.508 -1.678 . . . . 0.0 108.054 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? 56.65 40.03 29.48 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 122.177 0.989 . . . . 0.0 110.578 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.12 0.97 90.2 Favored Glycine 0 C--N 1.314 -0.68 0 CA-C-N 115.18 -0.918 . . . . 0.0 113.413 176.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.68 120.27 62.4 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 6.0 m -86.58 129.8 34.73 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-O 122.533 1.159 . . . . 0.0 113.773 178.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 . . . . . 0 C--N 1.278 -2.543 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.966 177.01 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 N--CA 1.442 -0.838 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 58.1 m -112.54 137.65 50.46 Favored 'General case' 0 C--N 1.292 -1.924 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.233 -178.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 . . . . . 0 C--N 1.312 -1.036 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -179.039 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.044 0 CA-C-O 120.27 -0.184 . . . . 0.0 113.434 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.8 t -112.54 113.16 43.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 117.341 0.57 . . . . 0.0 109.575 -177.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.5 m -89.95 123.97 34.32 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-O 121.752 0.787 . . . . 0.0 110.239 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -119.5 123.25 43.54 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.36 -176.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . 0.421 ' HA ' ' HA ' ' A' ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -118.53 126.72 75.36 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 59.5 m -106.42 131.2 53.9 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.355 -178.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -138.33 120.84 16.12 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 63.97 29.79 14.31 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.364 1.066 . . . . 0.0 109.543 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.62 1.95 90.35 Favored Glycine 0 N--CA 1.441 -1.016 0 CA-C-N 115.168 -0.924 . . . . 0.0 112.479 -178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.5 t -99.56 111.87 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.6 m -92.72 124.94 37.1 Favored 'General case' 0 C--N 1.289 -2.028 0 C-N-CA 120.017 -0.673 . . . . 0.0 111.134 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -122.3 126.13 47.46 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-N 114.691 -1.141 . . . . 0.0 109.965 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . 0.421 ' HA ' ' HA ' ' A' ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.6 m -97.34 139.44 19.78 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 178.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.7 m -111.33 131.52 55.11 Favored 'General case' 0 C--N 1.287 -2.13 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.183 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -135.56 109.37 8.1 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-O 121.183 0.516 . . . . 0.0 110.122 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 . . . . . 0 CA--C 1.546 0.825 0 C-N-CA 125.032 1.333 . . . . 0.0 111.719 177.733 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.944 0 N-CA-C 112.692 -0.163 . . . . 0.0 112.692 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 68.8 t -105.22 126.22 60.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.9 m -97.45 125.16 41.94 Favored 'General case' 0 C--N 1.285 -2.205 0 C-N-CA 119.235 -0.986 . . . . 0.0 111.552 -179.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -119.17 121.49 39.86 Favored 'General case' 0 C--N 1.283 -2.298 0 CA-C-N 114.328 -1.305 . . . . 0.0 109.432 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.7 m -89.62 144.33 9.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 60.8 m -124.95 139.3 53.95 Favored 'General case' 0 C--N 1.288 -2.074 0 C-N-CA 118.544 -1.262 . . . . 0.0 111.397 -177.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -153.65 127.46 8.84 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.292 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 62.44 32.45 16.73 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.584 1.154 . . . . 0.0 110.125 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.73 0.04 89.82 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.578 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.8 t -107.44 119.55 57.24 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.029 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 -176.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.1 m -98.28 123.84 42.58 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-O 121.795 0.807 . . . . 0.0 110.872 177.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.401 ' NE ' ' HA ' ' A' ' 13' ' ' ARG . 1.6 tpm_? -109.09 123.61 49.45 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.228 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 99.0 t -95.33 108.19 20.6 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 64.9 m -95.23 123.3 38.66 Favored 'General case' 0 C--N 1.29 -2.021 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 177.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -139.3 129.32 25.07 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.042 -175.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 122.083 0.944 . . . . 0.0 109.593 -178.389 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.931 0 N-CA-C 113.05 -0.02 . . . . 0.0 113.05 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.3 t -102.28 115.37 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.015 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 84.1 m -95.85 128.96 43.18 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -175.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 2.8 tpm_? -111.07 121.99 46.73 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 113.927 -1.488 . . . . 0.0 107.865 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.1 m -111.0 128.84 67.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.8 m -99.88 124.55 45.31 Favored 'General case' 0 C--N 1.291 -1.955 0 C-N-CA 120.187 -0.605 . . . . 0.0 109.414 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -136.7 118.8 15.43 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.778 -175.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 59.45 34.76 22.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.721 1.248 . . . . 0.0 110.573 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.55 -8.42 74.52 Favored Glycine 0 N--CA 1.43 -1.727 0 CA-C-N 114.511 -1.222 . . . . 0.0 113.733 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.9 t -108.44 116.55 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 117.359 0.579 . . . . 0.0 109.672 -176.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 64.9 m -84.44 115.96 22.83 Favored 'General case' 0 N--CA 1.419 -2.0 0 CA-C-O 121.917 0.865 . . . . 0.0 110.119 175.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -110.67 120.81 43.62 Favored 'General case' 0 C--N 1.283 -2.296 0 CA-C-N 113.65 -1.614 . . . . 0.0 108.703 -178.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.1 m -111.6 130.12 65.74 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 176.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 62.0 m -111.33 130.39 55.69 Favored 'General case' 0 C--N 1.283 -2.308 0 C-N-CA 119.861 -0.735 . . . . 0.0 110.606 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -126.18 109.85 12.8 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 . . . . . 0 CA--C 1.542 0.662 0 CA-C-O 122.238 1.018 . . . . 0.0 110.246 177.826 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.03 0 CA-C-O 120.339 -0.145 . . . . 0.0 112.881 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 92.0 t -120.79 127.25 75.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 117.3 0.55 . . . . 0.0 109.91 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 90.4 m -95.7 129.86 42.78 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 121.255 0.55 . . . . 0.0 110.68 176.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -115.14 120.32 39.36 Favored 'General case' 0 C--N 1.279 -2.479 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 25.3 m -116.07 132.86 64.35 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 55.6 m -108.64 139.3 43.61 Favored 'General case' 0 C--N 1.288 -2.072 0 C-N-CA 119.974 -0.691 . . . . 0.0 109.782 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -151.32 134.04 15.64 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.706 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 49.0 ttp180 61.78 25.0 14.98 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.182 0.991 . . . . 0.0 109.764 -178.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.56 -3.37 87.26 Favored Glycine 0 N--CA 1.439 -1.157 0 CA-C-N 115.131 -0.941 . . . . 0.0 112.602 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.9 t -103.55 126.85 57.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -176.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 71.2 m -96.0 130.83 42.89 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.77 0.795 . . . . 0.0 112.074 179.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -113.95 126.46 55.18 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.812 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.0 t -112.54 108.11 24.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 78.4 m -106.17 132.63 52.01 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.111 -178.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -164.13 145.3 8.56 Favored 'General case' 0 CA--C 1.502 -0.888 0 O-C-N 123.415 0.447 . . . . 0.0 110.717 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 . . . . . 0 N--CA 1.475 0.812 0 C-N-CA 125.227 1.411 . . . . 0.0 110.567 177.831 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.601 0 N-CA-C 112.491 -0.244 . . . . 0.0 112.491 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 50.1 t -103.75 107.96 23.46 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.8 m -90.58 121.71 32.74 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-O 121.335 0.588 . . . . 0.0 110.306 179.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -119.02 125.25 48.94 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.179 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.9 t -82.47 106.92 13.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 40.5 m -96.93 123.91 40.76 Favored 'General case' 0 C--N 1.295 -1.795 0 CA-C-O 121.242 0.544 . . . . 0.0 110.826 -177.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 75.3 mtt180 -134.0 121.52 21.72 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.459 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 63.62 30.72 14.88 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 122.672 1.225 . . . . 0.0 110.037 178.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.18 8.78 87.6 Favored Glycine 0 C--N 1.308 -1.004 0 CA-C-N 115.021 -0.99 . . . . 0.0 112.028 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.9 t -107.29 108.37 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.7 m -91.3 117.47 29.68 Favored 'General case' 0 C--N 1.29 -2.02 0 CA-C-O 121.497 0.665 . . . . 0.0 111.011 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.434 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 17.7 tpt180 -105.44 120.84 42.62 Favored 'General case' 0 C--N 1.275 -2.646 0 CA-C-N 114.856 -1.066 . . . . 0.0 109.142 177.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.7 m -95.3 123.58 47.51 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.6 m -101.14 124.92 47.6 Favored 'General case' 0 C--N 1.29 -2.0 0 C-N-CA 119.653 -0.819 . . . . 0.0 109.532 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -131.22 112.66 13.01 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.444 -0.798 . . . . 0.0 108.901 -176.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 . . . . . 0 CA--C 1.545 0.782 0 CA-C-O 122.573 1.178 . . . . 0.0 109.984 177.185 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.496 0 N-CA-C 112.535 -0.226 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.23 120.9 51.43 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.093 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 177.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 85.2 m -105.45 135.61 46.53 Favored 'General case' 0 C--N 1.282 -2.362 0 C-N-CA 119.584 -0.846 . . . . 0.0 112.929 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -115.12 120.53 40.09 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.875 175.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.1 m -116.85 133.69 62.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 176.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 55.7 m -110.78 134.04 52.84 Favored 'General case' 0 C--N 1.284 -2.261 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.065 -178.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 65.0 mtm180 -132.24 116.63 17.18 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 59.75 33.93 21.89 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 122.048 0.928 . . . . 0.0 110.237 178.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.01 -2.88 87.2 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.844 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.7 t -101.96 114.8 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 107.683 -1.229 . . . . 0.0 107.683 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.7 m -92.49 126.84 37.75 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-O 121.682 0.753 . . . . 0.0 111.564 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.3 tpt85 -117.81 120.54 38.23 Favored 'General case' 0 C--N 1.287 -2.136 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.195 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.7 m -104.36 125.14 59.2 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.3 m -108.38 144.43 35.96 Favored 'General case' 0 C--N 1.284 -2.246 0 C-N-CA 119.744 -0.782 . . . . 0.0 111.182 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -142.64 120.35 11.87 Favored 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 175.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 . . . . . 0 N--CA 1.482 1.163 0 CA-C-O 122.254 1.026 . . . . 0.0 110.317 178.481 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.056 0 CA-C-O 120.062 -0.299 . . . . 0.0 113.315 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.9 t -128.49 124.96 62.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 88.3 m -96.03 121.87 38.25 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-O 121.516 0.674 . . . . 0.0 110.323 176.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -117.59 121.2 40.3 Favored 'General case' 0 C--N 1.279 -2.493 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.257 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p -107.89 134.83 48.52 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.2 m -115.29 136.69 52.83 Favored 'General case' 0 C--N 1.294 -1.838 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.942 -178.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -129.52 109.64 11.2 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.337 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 63.06 29.03 16.33 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.662 1.185 . . . . 0.0 110.032 178.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.73 -13.1 59.47 Favored Glycine 0 N--CA 1.434 -1.463 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.844 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.7 t -91.75 111.39 23.97 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.001 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 -177.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 77.3 m -93.82 131.07 39.57 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 119.691 -0.803 . . . . 0.0 111.944 -178.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 -123.45 121.72 36.43 Favored 'General case' 0 C--N 1.29 -1.994 0 CA-C-N 114.473 -1.239 . . . . 0.0 110.123 178.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.6 t -91.08 111.72 24.17 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.732 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 69.9 m -100.08 122.26 42.67 Favored 'General case' 0 C--N 1.289 -2.06 0 C-N-CA 119.524 -0.87 . . . . 0.0 109.662 178.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -146.69 131.0 17.52 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.559 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 . . . . . 0 CA--C 1.536 0.413 0 C-N-CA 125.594 1.558 . . . . 0.0 111.532 179.377 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.565 0 CA-C-O 120.31 -0.161 . . . . 0.0 113.254 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.5 t -106.76 121.73 59.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 77.2 m -100.56 132.36 45.99 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.705 0.764 . . . . 0.0 112.706 -176.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? -117.57 120.82 39.24 Favored 'General case' 0 C--N 1.292 -1.907 0 CA-C-N 114.56 -1.2 . . . . 0.0 108.485 177.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.4 t -115.94 121.94 68.49 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.9 m -101.81 128.07 48.33 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 120.273 -0.571 . . . . 0.0 111.019 -177.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 28.8 mmm180 -136.55 127.71 27.99 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.812 -179.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.2 tpp180 60.85 31.92 20.05 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 122.128 0.966 . . . . 0.0 110.629 175.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.81 14.61 81.85 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.584 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.3 t -122.02 119.82 59.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.7 m -91.19 119.28 31.15 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-O 121.933 0.873 . . . . 0.0 112.166 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -98.82 120.51 39.37 Favored 'General case' 0 C--N 1.279 -2.468 0 CA-C-N 113.96 -1.473 . . . . 0.0 108.337 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.4 t -112.58 139.56 36.85 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.038 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 177.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 70.0 m -125.11 133.88 52.68 Favored 'General case' 0 C--N 1.288 -2.102 0 C-N-CA 119.801 -0.76 . . . . 0.0 109.717 178.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -133.12 112.67 11.95 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -176.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 . . . . . 0 C--N 1.312 -1.051 0 C-N-CA 124.667 1.187 . . . . 0.0 110.737 177.328 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.29 0 CA-C-O 120.001 -0.333 . . . . 0.0 113.53 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.0 t -126.66 128.42 71.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 78.2 m -96.48 124.81 40.59 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.634 0.731 . . . . 0.0 111.669 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -103.09 128.41 50.0 Favored 'General case' 0 C--N 1.292 -1.897 0 CA-C-N 114.371 -1.286 . . . . 0.0 110.671 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.5 t -105.63 106.48 20.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 77.6 m -106.58 137.12 45.16 Favored 'General case' 0 C--N 1.288 -2.086 0 C-N-CA 120.306 -0.558 . . . . 0.0 110.13 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -145.15 119.3 9.46 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.16 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 59.57 35.58 22.63 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.927 0.891 . . . . 0.0 110.959 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.48 11.29 85.63 Favored Glycine 0 C--N 1.313 -0.73 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.442 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.92 114.33 46.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.0 m -101.35 131.62 47.33 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.748 0.785 . . . . 0.0 112.533 -178.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -119.33 130.58 55.44 Favored 'General case' 0 C--N 1.287 -2.118 0 CA-C-N 113.978 -1.465 . . . . 0.0 109.133 177.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m -111.01 126.36 68.39 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.284 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 177.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 62.2 m -104.08 124.8 49.72 Favored 'General case' 0 C--N 1.284 -2.242 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.093 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -138.31 127.99 25.06 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -176.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 . . . . . 0 C--N 1.318 -0.798 0 C-N-CA 124.411 1.084 . . . . 0.0 110.946 176.501 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.117 0 CA-C-O 120.383 -0.121 . . . . 0.0 112.973 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 55.3 t -118.2 128.12 75.27 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 79.8 m -92.89 130.19 38.56 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 121.312 0.577 . . . . 0.0 111.723 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -113.93 121.37 43.73 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.807 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p -105.53 138.52 30.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 56.9 m -113.7 130.76 56.37 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.085 -176.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.4 mtm180 -135.3 126.26 27.68 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 59.02 36.39 24.36 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-O 122.089 0.947 . . . . 0.0 110.504 177.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.86 14.32 78.44 Favored Glycine 0 C--O 1.245 0.795 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.67 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 51.0 t -118.69 118.8 59.06 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 78.8 m -93.2 130.07 39.01 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-O 121.64 0.733 . . . . 0.0 111.94 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -115.54 121.89 44.04 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.564 -1.198 . . . . 0.0 108.951 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 56.7 t -119.45 125.81 74.74 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.5 m -101.47 133.31 46.3 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 120.822 0.344 . . . . 0.0 110.891 -179.136 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 ptp180 -147.11 128.51 14.92 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.854 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 64.8 ttt180 . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 122.458 1.123 . . . . 0.0 110.862 177.217 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.449 0 CA-C-O 121.037 0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.4 t -114.91 120.16 63.75 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 -179.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.6 m -94.38 127.88 40.55 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 121.344 0.592 . . . . 0.0 110.52 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -124.85 122.96 38.89 Favored 'General case' 0 C--N 1.281 -2.376 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.842 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 41.8 t -98.95 119.53 47.06 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.781 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.496 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 59.7 m -98.62 123.4 42.79 Favored 'General case' 0 C--N 1.286 -2.165 0 C-N-CA 119.43 -0.908 . . . . 0.0 110.071 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.5 ptp180 -148.47 137.77 21.91 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.967 -177.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 42.3 ttt180 66.37 26.32 10.21 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 122.455 1.122 . . . . 0.0 109.735 176.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.01 15.69 81.44 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 114.567 -1.197 . . . . 0.0 112.573 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 84.1 t -129.11 129.86 67.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.496 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 72.3 m -92.19 125.68 36.96 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-O 121.555 0.693 . . . . 0.0 110.732 177.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? -115.58 120.8 40.63 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.551 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 m -101.43 121.05 51.86 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-O 121.471 0.653 . . . . 0.0 109.884 -179.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 70.1 m -102.44 134.82 45.14 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 116.202 -0.454 . . . . 0.0 109.83 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -153.5 131.39 11.68 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.206 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 . . . . . 0 CA--C 1.551 0.991 0 CA-C-O 122.632 1.206 . . . . 0.0 110.536 177.071 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.14 0 CA-C-O 120.278 -0.179 . . . . 0.0 112.937 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 60.1 t -110.46 121.06 62.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 61.4 m -88.53 113.9 24.6 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 122.726 1.25 . . . . 0.0 111.97 -178.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 32.1 tpt180 -99.54 122.83 43.17 Favored 'General case' 0 C--N 1.287 -2.148 0 CA-C-N 113.268 -1.787 . . . . 0.0 109.446 -176.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.1 t -104.84 115.65 47.13 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.605 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 176.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 49.2 m -99.15 135.58 40.34 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-O 120.944 0.402 . . . . 0.0 110.838 -178.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -139.19 120.35 14.69 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 58.83 36.59 24.78 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 122.174 0.988 . . . . 0.0 110.987 176.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.14 -2.25 87.62 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.262 -0.881 . . . . 0.0 113.444 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.7 t -109.35 126.08 66.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.3 m -99.63 131.54 45.55 Favored 'General case' 0 C--N 1.289 -2.061 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.641 -178.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -111.53 121.73 45.94 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.674 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -94.89 124.56 47.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.366 -179.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 36.3 m -95.01 124.06 38.84 Favored 'General case' 0 C--N 1.285 -2.226 0 CA-C-O 121.586 0.708 . . . . 0.0 110.422 -177.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 30.6 mmm180 -127.36 113.81 16.73 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 114.443 -1.253 . . . . 0.0 107.784 -175.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 . . . . . 0 CA--C 1.551 0.995 0 CA-C-O 122.267 1.032 . . . . 0.0 110.573 177.872 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.646 0 N-CA-C 112.367 -0.293 . . . . 0.0 112.367 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 56.9 t -116.99 113.18 42.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 82.6 m -86.44 131.56 34.16 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 121.642 0.734 . . . . 0.0 111.851 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 -127.1 121.93 32.85 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.994 -179.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 p -113.62 132.26 63.06 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.929 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 177.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 46.7 m -105.28 136.74 44.25 Favored 'General case' 0 C--N 1.287 -2.152 0 C-N-CA 119.771 -0.771 . . . . 0.0 111.051 -177.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 78.8 mtp180 -129.78 109.19 10.74 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 55.43 42.64 29.79 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 124.82 1.248 . . . . 0.0 111.187 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.9 -5.54 84.74 Favored Glycine 0 N--CA 1.442 -0.949 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.873 177.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 48.2 t -101.31 108.98 24.57 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -179.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 65.3 m -90.75 129.7 36.8 Favored 'General case' 0 C--N 1.296 -1.723 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.074 -179.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -119.65 124.3 45.95 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.251 179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.3 m -96.35 135.91 28.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 176.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 53.8 m -116.27 128.99 56.05 Favored 'General case' 0 C--N 1.281 -2.382 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.086 -177.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 -133.6 124.52 27.0 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.746 -177.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 . . . . . 0 CA--C 1.546 0.797 0 CA-C-O 122.204 1.002 . . . . 0.0 110.314 178.529 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.051 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 48.7 t -122.13 135.15 63.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -176.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.4 m -101.79 124.76 47.97 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 121.813 0.816 . . . . 0.0 111.012 177.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 5.2 tpm_? -111.82 120.86 43.41 Favored 'General case' 0 C--N 1.281 -2.378 0 CA-C-N 114.521 -1.218 . . . . 0.0 109.216 -178.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -97.88 112.37 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.096 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 50.2 m -96.64 127.91 43.08 Favored 'General case' 0 C--N 1.277 -2.564 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.831 -178.055 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -120.07 109.05 15.02 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.656 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 46.93 51.81 12.31 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 124.595 1.184 . . . . 0.0 111.169 178.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.55 -0.24 86.72 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.181 -0.918 . . . . 0.0 114.168 174.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.3 t -116.04 114.63 46.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 117.748 0.774 . . . . 0.0 108.916 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 74.2 m -91.0 127.5 36.45 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -115.94 124.93 51.8 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.743 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.6 m -117.05 135.51 57.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.5 m -112.41 139.24 48.15 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 120.211 -0.595 . . . . 0.0 110.029 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -159.06 140.49 13.17 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? . . . . . 0 N--CA 1.481 1.106 0 CA-C-O 122.296 1.046 . . . . 0.0 111.141 174.832 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.552 0 CA-C-O 120.432 -0.094 . . . . 0.0 113.224 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 57.6 t -94.16 114.01 29.94 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.813 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 73.4 m -97.92 126.91 43.54 Favored 'General case' 0 C--N 1.289 -2.047 0 CA-C-O 121.544 0.688 . . . . 0.0 112.724 -175.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 -111.79 123.13 49.6 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.465 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 99.3 t -94.76 106.32 18.02 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.569 -177.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.8 m -96.7 129.94 44.02 Favored 'General case' 0 C--N 1.293 -1.853 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -152.71 128.98 10.51 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.494 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 63.47 31.15 15.11 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 122.246 1.022 . . . . 0.0 110.473 176.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.69 10.03 86.2 Favored Glycine 0 C--N 1.31 -0.899 0 CA-C-N 115.318 -0.856 . . . . 0.0 112.083 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.5 t -115.98 120.5 65.03 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.013 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 73.2 m -100.41 116.35 32.17 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-O 121.85 0.833 . . . . 0.0 110.898 177.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -117.72 127.9 54.37 Favored 'General case' 0 C--N 1.278 -2.517 0 CA-C-N 114.299 -1.318 . . . . 0.0 109.215 -177.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -126.54 120.17 55.56 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 175.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 58.0 m -102.02 135.86 42.86 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.342 -177.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -128.05 109.55 11.65 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 . . . . . 0 N--CA 1.475 0.811 0 C-N-CA 124.437 1.095 . . . . 0.0 110.377 177.149 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.805 0 CA-C-O 120.815 0.12 . . . . 0.0 112.98 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 56.4 t -107.64 126.5 64.0 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 -176.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 71.3 m -102.67 115.7 31.1 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 121.665 0.745 . . . . 0.0 110.721 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 -100.56 128.82 46.5 Favored 'General case' 0 C--N 1.277 -2.584 0 CA-C-N 114.21 -1.359 . . . . 0.0 108.992 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . 0.461 ' HA ' ' O ' ' A' ' 13' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 34.9 m -112.81 141.68 27.62 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 35.3 m -114.62 133.44 55.83 Favored 'General case' 0 C--N 1.282 -2.339 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.244 -179.078 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -123.49 109.85 14.35 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 62.8 30.68 16.69 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 122.353 1.073 . . . . 0.0 109.263 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 93.47 -11.95 70.53 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 114.924 -1.035 . . . . 0.0 112.592 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.16 112.85 27.65 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.887 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -176.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 72.0 m -88.46 132.29 34.54 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-O 121.776 0.798 . . . . 0.0 113.04 -175.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.461 ' O ' ' HA ' ' A' ' 5' ' ' ABA . 16.3 tpp180 -108.09 121.37 44.69 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 113.881 -1.509 . . . . 0.0 107.257 173.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.4 p -131.52 133.76 61.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.83 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.7 m -106.81 135.29 48.6 Favored 'General case' 0 C--N 1.288 -2.08 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.145 178.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -153.6 128.55 9.57 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.485 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 56.8 ttt180 . . . . . 0 CA--C 1.553 1.071 0 CA-C-O 122.41 1.1 . . . . 0.0 110.298 177.958 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.558 0 N-CA-C 114.543 0.577 . . . . 0.0 114.543 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.6 t -106.15 115.93 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.693 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 74.7 m -95.89 132.11 41.52 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 119.722 -0.791 . . . . 0.0 112.841 -177.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.6 tpm_? -118.25 120.97 39.28 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.293 179.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.5 p -103.0 136.86 33.52 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 -177.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 29.1 m -105.8 138.58 41.75 Favored 'General case' 0 C--N 1.293 -1.88 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.729 -177.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -138.53 123.93 19.42 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.534 -178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 61.3 25.09 15.12 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 122.834 1.302 . . . . 0.0 110.428 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.94 -1.97 81.29 Favored Glycine 0 C--N 1.301 -1.404 0 CA-C-N 114.856 -1.065 . . . . 0.0 113.209 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 89.0 t -106.05 127.99 60.74 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.605 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 -179.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 66.6 m -94.62 129.82 41.33 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-O 121.714 0.768 . . . . 0.0 111.794 -177.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -119.28 124.12 45.9 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.509 -176.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t -101.94 122.57 54.32 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.597 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 60.5 m -109.39 131.87 54.66 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 119.851 -0.739 . . . . 0.0 110.153 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -114.02 108.06 16.51 Favored 'General case' 0 N--CA 1.428 -1.558 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 63.1 ttt180 . . . . . 0 CA--C 1.561 1.368 0 C-N-CA 125.345 1.458 . . . . 0.0 112.627 176.695 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.066 0 CA-C-O 120.176 -0.235 . . . . 0.0 113.536 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 70.8 t -120.18 126.55 75.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.16 0 CA-C-N 117.769 0.785 . . . . 0.0 109.447 -178.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 70.9 m -98.81 122.42 42.03 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-O 121.613 0.72 . . . . 0.0 110.072 176.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -118.85 121.85 40.98 Favored 'General case' 0 C--N 1.277 -2.555 0 CA-C-N 114.704 -1.134 . . . . 0.0 109.037 -177.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.4 m -99.76 129.83 49.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.566 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 34.7 m -100.18 121.72 41.89 Favored 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 119.545 -0.862 . . . . 0.0 110.98 -175.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -127.64 121.96 31.84 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 114.497 -1.229 . . . . 0.0 107.79 -176.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 64.32 27.7 13.75 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 122.228 1.013 . . . . 0.0 109.542 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.53 9.18 87.25 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.037 -0.983 . . . . 0.0 112.715 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.0 t -111.81 130.24 65.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 58.4 m -99.8 116.66 32.39 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 122.139 0.971 . . . . 0.0 112.203 -175.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -105.54 128.28 53.5 Favored 'General case' 0 C--N 1.288 -2.085 0 CA-C-N 113.88 -1.509 . . . . 0.0 109.887 -177.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.9 t -122.86 121.72 64.01 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 175.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.5 m -103.94 133.95 48.04 Favored 'General case' 0 C--N 1.295 -1.791 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.834 -178.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -151.4 127.12 10.21 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.199 -177.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 122.591 1.186 . . . . 0.0 111.568 176.821 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.223 0 CA-C-O 120.249 -0.195 . . . . 0.0 113.242 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.0 t -112.94 119.87 61.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 78.4 m -95.79 124.56 39.86 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 121.473 0.654 . . . . 0.0 110.948 177.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -110.28 120.52 42.69 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-N 114.572 -1.194 . . . . 0.0 108.296 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.0 m -130.3 167.79 24.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.599 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.358 -179.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 75.5 m -130.91 138.55 49.83 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -137.29 109.77 7.43 Favored 'General case' 0 N--CA 1.422 -1.87 0 CA-C-O 120.924 0.392 . . . . 0.0 110.273 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 57.41 41.15 26.7 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 122.772 1.272 . . . . 0.0 110.531 178.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 90.22 -9.13 78.43 Favored Glycine 0 N--CA 1.436 -1.301 0 CA-C-N 114.6 -1.182 . . . . 0.0 113.086 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.1 t -99.98 110.1 26.32 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 70.7 m -90.24 128.7 36.46 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-O 121.374 0.607 . . . . 0.0 110.742 178.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -129.99 137.73 50.44 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.886 -176.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 40.5 t -87.32 122.74 39.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.04 -175.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 85.8 m -102.12 131.06 48.84 Favored 'General case' 0 C--N 1.293 -1.864 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.026 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -145.17 117.59 8.51 Favored 'General case' 0 N--CA 1.435 -1.217 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.021 -175.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 tmm_? . . . . . 0 CA--C 1.545 0.782 0 CA-C-O 122.446 1.117 . . . . 0.0 110.697 178.163 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.912 0 N-CA-C 112.602 -0.199 . . . . 0.0 112.602 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.3 t -115.75 129.52 71.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 85.8 m -96.62 128.93 44.03 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-O 121.762 0.791 . . . . 0.0 111.325 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -117.65 131.17 56.69 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.736 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.7 m -90.16 123.36 42.31 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.278 0 CA-C-O 121.069 0.462 . . . . 0.0 110.32 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -94.17 136.27 34.64 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-O 122.166 0.984 . . . . 0.0 112.491 -178.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -135.37 116.67 14.55 Favored 'General case' 0 N--CA 1.416 -2.131 0 CA-C-N 113.508 -1.678 . . . . 0.0 108.054 177.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? 56.65 40.03 29.48 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 122.177 0.989 . . . . 0.0 110.578 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.12 0.97 90.2 Favored Glycine 0 C--N 1.314 -0.68 0 CA-C-N 115.18 -0.918 . . . . 0.0 113.413 176.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.3 t -112.68 120.27 62.4 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 6.0 m -86.58 129.8 34.73 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-O 122.533 1.159 . . . . 0.0 113.773 178.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -105.95 127.42 53.13 Favored 'General case' 0 C--N 1.278 -2.543 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.966 177.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.9 p -122.26 137.32 56.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 58.1 m -112.54 137.65 50.46 Favored 'General case' 0 C--N 1.292 -1.924 0 C-N-CA 119.67 -0.812 . . . . 0.0 110.233 -178.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -148.94 131.38 15.71 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 122.445 1.117 . . . . 0.0 110.469 178.853 . . . . . . . . 0 0 . 1 stop_ save_