data_6pin_residue ############################ # Computer software used # ############################ 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 6pin _Structure_validation_residue.Date_analyzed 2019-09-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt . . . . . 0 CA--C 1.506 -0.729 0 CA-C-O 121.372 0.606 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 22.8 t90 -88.16 124.24 33.62 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.295 -178.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 66.8 m -109.63 124.76 51.72 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.217 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -138.95 160.69 39.16 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.087 0.47 . . . . 0.0 111.874 -176.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -81.05 125.51 30.28 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.389 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.498 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 26.1 t -113.41 117.42 55.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -109.94 114.69 28.44 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-O 121.524 0.678 . . . . 0.0 109.827 178.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -114.9 99.74 7.7 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.678 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.8 mtm180 55.85 38.63 30.26 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.142 -0.936 . . . . 0.0 112.757 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.2 -15.4 62.44 Favored Glycine 0 N--CA 1.439 -1.13 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.91 177.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.7 mt -90.6 109.86 21.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 54.4 m -107.13 135.2 49.08 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 121.323 0.583 . . . . 0.0 111.239 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -141.48 151.03 42.98 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.241 176.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.407 ' HD3' ' HB3' ' A' ' 3' ' ' CYS . 3.5 tmm_? -97.92 124.0 42.15 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -178.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -123.32 146.48 47.87 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.145 -177.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 71.4 m -106.94 112.9 26.07 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.298 176.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -100.5 93.41 5.61 Favored 'General case' 0 N--CA 1.424 -1.766 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.086 0 N-CA-C 109.799 -1.32 . . . . 0.0 109.799 -175.52 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.0 mttm . . . . . 0 CA--C 1.512 -0.508 0 CA-C-O 121.269 0.556 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -105.73 128.81 53.91 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.448 -175.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 71.8 m -109.29 129.01 55.52 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 174.433 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.7 p90 -126.3 156.22 40.74 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-O 121.506 0.67 . . . . 0.0 111.417 -175.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 46.9 ttt180 -89.46 124.16 34.24 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 114.352 -1.294 . . . . 0.0 108.856 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.477 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 15.5 t -111.21 116.07 51.54 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.113 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.6 m -109.23 120.16 41.68 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 120.161 -0.615 . . . . 0.0 110.082 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -124.18 101.94 7.46 Favored 'General case' 0 N--CA 1.411 -2.397 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 65.44 32.99 9.16 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 125.021 1.329 . . . . 0.0 111.707 176.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.33 -21.85 42.54 Favored Glycine 0 C--N 1.316 -0.559 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.948 179.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.3 mt -87.8 115.75 28.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.9 m -109.44 130.28 55.51 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.687 -178.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -128.32 146.23 50.82 Favored 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.448 177.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -89.65 130.54 35.92 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -128.89 145.3 51.25 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 74.5 m -117.33 124.31 48.65 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 121.106 0.479 . . . . 0.0 110.831 -177.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 30.6 tpt180 -121.39 103.58 9.06 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.422 -2.265 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 -177.556 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp . . . . . 0 CA--C 1.505 -0.775 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 31.1 t90 -68.17 112.63 5.21 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 114.145 -1.389 . . . . 0.0 111.38 -177.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.9 m -108.81 125.14 51.64 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.049 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -131.47 159.08 39.13 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.143 -174.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -83.53 127.94 34.13 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.629 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.498 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.2 t -118.67 122.94 70.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 97.0 m -109.81 118.31 36.16 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-O 121.161 0.505 . . . . 0.0 109.665 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -131.17 109.35 10.37 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.281 -176.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 63.24 21.16 12.68 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.108 1.363 . . . . 0.0 111.871 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.33 -26.25 15.52 Favored Glycine 0 N--CA 1.437 -1.289 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.5 mt -83.4 112.78 21.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -179.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 61.7 m -104.74 125.26 50.64 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-O 121.238 0.542 . . . . 0.0 109.657 178.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -131.59 170.43 14.76 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.213 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.416 ' HD2' ' N ' ' A' ' 14' ' ' ARG . 8.4 mpt_? -106.66 132.57 52.5 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.407 ' HA ' ' NE ' ' A' ' 15' ' ' ARG . 5.3 mmp_? -123.7 154.78 38.94 Favored 'General case' 0 C--N 1.287 -2.13 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.5 m -127.01 111.32 13.93 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-O 121.136 0.494 . . . . 0.0 110.831 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -96.07 88.06 4.74 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.088 0 N-CA-C 108.945 -1.662 . . . . 0.0 108.945 -173.301 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt . . . . . 0 N--CA 1.442 -0.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.6 t90 -108.9 124.07 50.08 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.559 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.7 m -109.72 132.15 54.41 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 177.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -129.78 158.73 38.62 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 121.584 0.707 . . . . 0.0 111.817 -175.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -92.27 129.26 38.27 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.173 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.516 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.7 t -117.13 121.21 67.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.3 m -109.67 122.24 47.02 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 121.219 0.533 . . . . 0.0 110.344 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -128.78 105.06 7.99 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 115.467 -0.788 . . . . 0.0 108.912 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 62.79 23.64 14.09 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 124.583 1.153 . . . . 0.0 112.749 176.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.38 -16.39 38.06 Favored Glycine 0 C--N 1.311 -0.85 0 C-N-CA 121.021 -0.609 . . . . 0.0 111.618 -178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.9 mt -91.39 109.7 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.516 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.4 m -107.1 129.87 54.77 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -131.62 159.25 38.81 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.708 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -101.85 126.67 48.79 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.453 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.7 mmp_? -128.07 155.0 45.06 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 74.1 m -119.93 145.03 47.11 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.063 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -130.89 99.86 5.06 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.837 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -177.516 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.3 pttt . . . . . 0 N--CA 1.449 -0.524 0 CA-C-O 121.03 0.443 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.7 t90 -75.78 121.04 21.99 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.866 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 73.8 m -109.45 135.0 51.18 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.482 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -137.25 160.2 39.71 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 121.312 0.577 . . . . 0.0 111.852 -174.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -82.14 130.01 34.97 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.513 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.9 t -125.63 136.01 62.16 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 85.1 m -120.46 119.8 34.06 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.201 0.525 . . . . 0.0 110.046 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.437 ' HB2' ' HH ' ' A' ' 13' ' ' TYR . 59.6 t80 -111.27 101.76 10.22 Favored 'General case' 0 N--CA 1.422 -1.832 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 -177.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 63.79 22.32 13.01 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 124.446 1.099 . . . . 0.0 111.482 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.12 -25.02 17.2 Favored Glycine 0 N--CA 1.441 -0.979 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.894 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 65.5 mt -81.62 113.27 20.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 39.5 m -100.03 142.99 30.77 Favored 'General case' 0 C--N 1.302 -1.474 0 C-N-CA 120.081 -0.648 . . . . 0.0 111.282 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.437 ' HH ' ' HB2' ' A' ' 8' ' ' TYR . 15.0 p90 -145.56 170.61 16.08 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 124.043 0.937 . . . . 0.0 110.174 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -99.12 124.7 44.34 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.0 mmm180 -128.32 159.97 33.65 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 34.5 m -132.94 150.63 52.14 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 120.136 -0.625 . . . . 0.0 110.671 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -125.71 94.12 4.04 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.262 0 N-CA-C 110.244 -1.142 . . . . 0.0 110.244 -176.954 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt . . . . . 0 C--O 1.242 0.687 0 CA-C-O 121.961 0.886 . . . . 0.0 108.648 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -82.61 121.23 26.56 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.441 -173.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 79.3 m -118.9 133.06 56.08 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 175.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -133.38 160.65 36.74 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.599 -172.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -88.93 129.6 35.59 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.998 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 41.1 t -124.61 124.71 68.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.8 m -111.39 124.67 52.73 Favored 'General case' 0 C--N 1.288 -2.072 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -132.1 108.22 9.16 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.9 mtm180 65.52 19.93 11.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.64 1.176 . . . . 0.0 112.471 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.35 -20.76 29.85 Favored Glycine 0 C--N 1.307 -1.051 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.871 -179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -88.58 114.98 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.294 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 60.1 m -104.7 126.79 52.12 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.167 0.508 . . . . 0.0 110.179 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 10.6 p90 -125.56 159.6 31.67 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.204 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -95.53 121.87 37.68 Favored 'General case' 0 N--CA 1.425 -1.676 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -178.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -111.03 145.71 38.0 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.1 m -124.18 132.7 53.64 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 121.625 0.726 . . . . 0.0 111.269 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -126.02 75.71 1.53 Allowed 'General case' 0 N--CA 1.418 -2.027 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.679 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.032 -177.969 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 93.8 mttt . . . . . 0 CA--C 1.507 -0.684 0 CA-C-O 121.733 0.778 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.7 t90 -109.61 118.53 36.81 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.849 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.8 m -109.66 119.57 39.8 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.594 0.711 . . . . 0.0 109.7 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -126.18 160.24 30.77 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.665 -174.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -95.46 133.64 39.21 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.526 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 21.5 t -123.5 122.61 65.47 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 92.2 m -109.03 116.01 31.17 Favored 'General case' 0 C--N 1.288 -2.088 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -129.52 110.33 11.76 Favored 'General case' 0 N--CA 1.419 -1.995 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -176.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 64.78 22.23 12.51 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 124.099 0.959 . . . . 0.0 112.661 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.06 -22.49 33.15 Favored Glycine 0 CA--C 1.506 -0.502 0 N-CA-C 111.493 -0.643 . . . . 0.0 111.493 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 62.7 mt -87.78 114.9 27.29 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.526 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.5 m -104.59 130.48 52.57 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-O 121.182 0.515 . . . . 0.0 109.735 179.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -134.68 160.97 36.46 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.187 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -102.55 125.79 49.39 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.243 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.487 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.8 mmp_? -120.75 146.91 45.99 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 176.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.0 m -118.14 115.15 24.22 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 49.7 ttt180 -106.81 95.04 5.45 Favored 'General case' 0 N--CA 1.428 -1.571 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.923 0 N-CA-C 109.128 -1.589 . . . . 0.0 109.128 -175.222 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 64.1 pttt . . . . . 0 N--CA 1.449 -0.521 0 CA-C-O 120.876 0.37 . . . . 0.0 111.602 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -120.01 135.45 54.92 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.316 -176.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.7 m -116.94 123.42 46.91 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.094 178.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -123.86 159.4 29.69 Favored 'General case' 0 C--N 1.297 -1.706 0 C-N-CA 123.664 0.785 . . . . 0.0 110.252 -175.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.4 ttt180 -105.99 134.1 49.65 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 58.5 t -121.47 131.35 73.28 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.853 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -177.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 70.9 m -109.63 124.8 51.79 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 175.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -146.06 124.31 12.25 Favored 'General case' 0 N--CA 1.416 -2.152 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -177.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.2 mtm180 64.96 16.33 10.49 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.175 0.99 . . . . 0.0 112.466 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.73 -7.47 59.33 Favored Glycine 0 N--CA 1.436 -1.3 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 56.8 mt -102.2 125.14 56.45 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.112 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 47.7 m -108.69 134.66 51.11 Favored 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 176.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 p90 -137.42 149.21 46.73 Favored 'General case' 0 C--N 1.289 -2.034 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.144 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -91.52 118.5 30.64 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -118.97 158.22 26.19 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.6 m -131.88 150.48 52.14 Favored 'General case' 0 C--N 1.294 -1.825 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.026 -177.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -142.92 99.13 3.4 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.351 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.327 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.8 pttt . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.901 0.381 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.1 t90 -100.66 121.93 42.47 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.974 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 75.1 m -112.56 139.93 47.74 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.783 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -136.88 154.61 50.44 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.354 -174.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -97.09 129.62 44.48 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 123.824 0.85 . . . . 0.0 109.345 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 46.7 t -122.45 128.53 75.43 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.332 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 178.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.3 m -109.69 111.88 23.61 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.714 0.768 . . . . 0.0 111.057 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -108.17 96.31 6.28 Favored 'General case' 0 N--CA 1.423 -1.789 0 CA-C-N 114.482 -1.236 . . . . 0.0 108.798 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 57.31 32.3 21.54 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 124.511 1.124 . . . . 0.0 112.895 176.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.22 -23.5 20.65 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 121.066 -0.588 . . . . 0.0 111.824 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 60.5 mt -88.66 109.38 19.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 59.7 m -101.3 121.05 41.2 Favored 'General case' 0 C--N 1.283 -2.296 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.402 ' CE1' ' HB ' ' A' ' 6' ' ' VAL . 17.5 p90 -119.78 155.26 32.88 Favored 'General case' 0 C--N 1.277 -2.58 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.029 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -102.44 122.16 43.75 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 -177.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.9 mmm180 -117.44 156.06 28.59 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 78.6 m -128.82 139.15 52.31 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -178.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -130.31 94.5 3.69 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.859 0 N-CA-C 108.879 -1.689 . . . . 0.0 108.879 -174.05 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.8 mttm . . . . . 0 C--O 1.238 0.467 0 CA-C-O 122.103 0.954 . . . . 0.0 108.953 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.0 t90 -88.51 109.88 20.42 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 113.858 -1.519 . . . . 0.0 110.806 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 80.2 m -113.08 119.2 37.03 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.281 0.562 . . . . 0.0 110.033 178.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.7 p90 -118.43 150.59 39.3 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.365 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -87.64 123.46 32.52 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.624 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.458 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 60.4 t -112.99 125.69 70.28 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.7 m -109.27 119.46 39.55 Favored 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -134.21 113.2 11.76 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 63.5 29.43 15.38 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 124.302 1.041 . . . . 0.0 111.738 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.02 -28.14 15.92 Favored Glycine 0 N--CA 1.435 -1.37 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.641 177.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 40.0 mm -86.71 129.16 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.57 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.7 m -111.99 135.47 52.6 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.056 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.8 p90 -134.24 145.05 48.78 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.053 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.5 tpp180 -85.2 108.19 17.61 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.192 -179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -98.64 129.11 45.13 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 86.1 m -105.15 126.39 52.02 Favored 'General case' 0 C--N 1.282 -2.367 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.075 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -125.41 83.68 2.19 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.719 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -175.64 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.0 pttp . . . . . 0 C--O 1.237 0.404 0 CA-C-O 120.937 0.398 . . . . 0.0 111.413 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.0 t90 -110.19 114.74 28.48 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-O 121.085 0.469 . . . . 0.0 112.132 -175.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 74.2 m -108.61 128.14 54.58 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -140.29 153.14 46.37 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.849 -174.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.7 ttt180 -91.64 128.08 37.33 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.531 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 20.6 t -117.63 121.3 67.17 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.611 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.3 m -108.55 116.46 32.01 Favored 'General case' 0 C--N 1.281 -2.388 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 177.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -125.89 104.78 8.5 Favored 'General case' 0 N--CA 1.418 -2.033 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 -177.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 66.08 27.29 10.59 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.281 1.433 . . . . 0.0 111.264 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.78 -25.51 27.23 Favored Glycine 0 N--CA 1.44 -1.068 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.129 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.6 mt -82.66 111.92 19.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.1 m -104.39 129.62 52.32 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.105 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -130.83 147.4 52.48 Favored 'General case' 0 C--N 1.287 -2.122 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.682 178.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -95.24 116.18 28.41 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -178.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 23.8 mmt180 -105.53 157.15 17.58 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.875 -0.416 . . . . 0.0 109.875 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 97.2 m -134.18 109.26 8.77 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -99.26 89.45 4.22 Favored 'General case' 0 N--CA 1.415 -2.221 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 178.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.056 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 -177.235 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 59.4 pttt . . . . . 0 C--O 1.235 0.339 0 CA-C-O 121.356 0.598 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.0 t90 -106.25 131.04 53.95 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.597 178.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 96.5 m -121.55 139.25 53.75 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.154 0.502 . . . . 0.0 110.025 178.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -137.84 158.84 43.52 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.596 0.712 . . . . 0.0 112.127 -172.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -91.86 132.63 36.32 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.86 -1.063 . . . . 0.0 108.749 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.477 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 21.0 t -123.92 124.22 68.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.88 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.7 m -111.17 121.47 45.38 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 175.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -131.35 110.74 11.28 Favored 'General case' 0 N--CA 1.419 -1.985 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -176.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.8 mtm180 65.04 23.4 12.48 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 124.066 0.946 . . . . 0.0 112.199 178.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.03 -27.29 12.06 Favored Glycine 0 N--CA 1.438 -1.201 0 C-N-CA 120.959 -0.638 . . . . 0.0 113.02 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.1 mt -91.64 129.69 41.94 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.7 m -110.67 136.19 50.14 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.073 0.463 . . . . 0.0 109.956 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -139.26 161.13 38.17 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.872 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -98.37 129.41 45.03 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -178.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.6 mmt-85 -129.92 160.11 34.59 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 85.2 m -132.12 156.71 45.88 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 121.486 0.66 . . . . 0.0 111.533 -177.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -135.21 92.2 2.83 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 106.93 -1.507 . . . . 0.0 106.93 175.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.558 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.57 -179.511 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt . . . . . 0 N--CA 1.446 -0.645 0 CA-C-O 121.476 0.655 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 32.1 t90 -102.1 115.74 31.19 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.397 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.3 m -109.89 123.1 49.0 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.657 0.741 . . . . 0.0 110.611 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -122.46 149.48 43.81 Favored 'General case' 0 C--N 1.285 -2.199 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.474 -173.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 36.2 ttt180 -89.54 127.78 35.92 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.598 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 39.3 t -116.22 127.97 73.66 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.833 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -176.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 90.0 m -109.7 116.66 32.11 Favored 'General case' 0 C--N 1.29 -1.979 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -128.97 108.88 10.76 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 115.05 -0.977 . . . . 0.0 108.857 -176.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.8 mtp180 59.11 29.74 19.36 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 123.938 0.895 . . . . 0.0 112.195 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.34 -19.98 48.84 Favored Glycine 0 N--CA 1.435 -1.407 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.422 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.0 mt -89.4 115.86 29.83 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.598 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 56.4 m -106.06 122.97 47.25 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 177.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -128.98 161.92 28.8 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.255 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -99.17 124.31 44.12 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -178.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -119.36 152.0 37.53 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 75.3 m -127.2 132.04 50.53 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-O 120.953 0.406 . . . . 0.0 111.226 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -122.44 100.19 6.81 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 175.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.874 0 N-CA-C 109.079 -1.608 . . . . 0.0 109.079 -174.64 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 61.4 pttt . . . . . 0 C--O 1.244 0.799 0 CA-C-O 121.898 0.856 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -114.82 113.16 23.86 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.713 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.9 m -108.89 134.56 51.41 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.691 179.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.2 p90 -140.33 160.0 40.94 Favored 'General case' 0 C--N 1.287 -2.145 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.524 -176.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -107.51 130.63 54.84 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.447 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 51.7 t -125.78 132.2 71.05 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.1 m -112.15 116.7 30.91 Favored 'General case' 0 N--CA 1.422 -1.875 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 176.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -111.7 102.37 10.68 Favored 'General case' 0 N--CA 1.408 -2.566 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 -177.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 68.09 18.9 9.36 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.54 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.29 -20.82 25.26 Favored Glycine 0 C--N 1.309 -0.93 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.058 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 76.7 mt -84.1 116.37 27.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 30.9 m -106.69 123.36 48.01 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.109 -176.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -119.35 154.47 33.53 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.999 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -93.54 111.58 23.28 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.485 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -106.71 138.31 43.12 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.002 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 98.5 m -135.06 109.7 8.57 Favored 'General case' 0 C--N 1.286 -2.186 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.661 179.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.8 101.48 10.35 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 178.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.415 -2.727 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -176.642 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 pttp . . . . . 0 N--CA 1.45 -0.466 0 CA-C-O 120.648 0.261 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -94.15 124.15 37.98 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 121.01 0.433 . . . . 0.0 110.967 -177.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 64.2 m -117.75 118.96 33.49 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.432 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -118.15 158.27 25.38 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.785 -178.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 34.2 ttt180 -98.82 130.88 45.27 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.369 -175.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.7 t -126.12 126.49 69.65 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.0 m -109.58 118.92 37.85 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -123.18 105.82 10.22 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 63.27 25.3 14.67 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 123.808 0.843 . . . . 0.0 110.955 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.99 -17.24 57.49 Favored Glycine 0 N--CA 1.439 -1.161 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.928 -179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 71.3 mt -79.56 109.48 14.22 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.519 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 55.9 m -105.97 120.25 41.29 Favored 'General case' 0 C--N 1.285 -2.217 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.137 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.431 ' CE2' ' HB ' ' A' ' 6' ' ' VAL . 19.5 p90 -120.29 160.21 23.44 Favored 'General case' 0 C--N 1.281 -2.399 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.309 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -106.91 115.3 29.94 Favored 'General case' 0 C--N 1.291 -1.946 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.465 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 22.4 mmm180 -100.04 124.46 45.43 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 120.933 0.397 . . . . 0.0 110.225 178.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 93.9 m -105.65 113.62 27.29 Favored 'General case' 0 C--N 1.278 -2.527 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.433 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -113.24 102.64 10.55 Favored 'General case' 0 N--CA 1.416 -2.146 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.717 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -175.287 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 65.8 mttm . . . . . 0 CA--C 1.51 -0.561 0 CA-C-O 122.231 1.015 . . . . 0.0 109.657 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -114.19 110.02 19.32 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.421 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 72.0 m -109.6 145.6 36.14 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 175.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.6 p90 -140.22 156.05 46.65 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.163 0.506 . . . . 0.0 111.661 -175.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -100.91 130.66 46.95 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.502 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 60.8 t -129.28 124.09 59.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 87.9 m -108.68 116.57 32.22 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -120.58 100.2 6.99 Favored 'General case' 0 N--CA 1.418 -2.071 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -176.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.2 mtm180 57.91 34.23 24.1 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.779 1.232 . . . . 0.0 113.106 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.26 -20.08 31.05 Favored Glycine 0 N--CA 1.44 -1.058 0 C-N-CA 121.054 -0.593 . . . . 0.0 112.892 177.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 55.2 mt -97.4 113.08 30.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 55.7 m -102.6 128.04 49.44 Favored 'General case' 0 C--N 1.293 -1.88 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -126.24 148.63 49.44 Favored 'General case' 0 C--N 1.284 -2.25 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.697 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -92.82 115.41 28.09 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.455 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.6 mmp_? -114.34 148.07 38.16 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 94.3 m -128.73 142.18 51.09 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-O 121.046 0.451 . . . . 0.0 111.332 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -134.53 94.65 3.23 Favored 'General case' 0 N--CA 1.417 -2.078 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 174.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.471 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.259 -179.636 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.5 pttm . . . . . 0 N--CA 1.44 -0.968 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.2 t90 -95.88 117.64 30.98 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 121.338 0.589 . . . . 0.0 110.741 -177.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 67.1 m -108.96 120.43 42.5 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -135.35 161.25 35.95 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.795 -174.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.0 ttt180 -75.66 125.98 30.11 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.265 177.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.465 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 58.8 t -116.16 123.41 71.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.785 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 178.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.4 m -110.71 125.19 53.23 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 121.384 0.611 . . . . 0.0 110.239 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -130.89 104.71 7.3 Favored 'General case' 0 N--CA 1.42 -1.94 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.992 -177.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 62.71 26.78 15.81 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.941 0.896 . . . . 0.0 112.459 176.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.96 -20.64 38.0 Favored Glycine 0 C--O 1.244 0.72 0 N-CA-C 111.592 -0.603 . . . . 0.0 111.592 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 65.1 mt -88.79 117.67 32.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 61.7 m -107.25 129.15 54.91 Favored 'General case' 0 C--N 1.289 -2.03 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.715 179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -131.47 169.95 15.37 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.632 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -104.64 129.04 52.83 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 -178.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 24.4 mmm180 -127.28 142.11 51.55 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 120.683 0.277 . . . . 0.0 110.604 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.1 m -112.98 111.36 22.05 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.272 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -107.8 113.87 27.42 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 176.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.301 0 N-CA-C 108.628 -1.789 . . . . 0.0 108.628 -173.558 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.5 pttt . . . . . 0 N--CA 1.447 -0.577 0 CA-C-O 121.54 0.686 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.9 t90 -104.22 110.72 23.04 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.691 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 56.1 m -109.04 126.99 53.72 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -177.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -138.86 160.9 38.59 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.992 -175.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -77.35 130.21 36.84 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.232 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 32.4 t -125.68 121.78 60.78 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.754 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.3 m -109.02 118.75 37.61 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.407 ' HB2' ' HH ' ' A' ' 13' ' ' TYR . 58.5 t80 -125.47 105.12 8.82 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.194 -176.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.7 mtm180 63.82 28.09 14.66 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 124.479 1.111 . . . . 0.0 111.877 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.43 -28.64 10.56 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.199 178.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.0 mt -86.69 113.63 24.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -178.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 62.3 m -100.54 124.17 45.73 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.321 0.581 . . . . 0.0 110.098 178.332 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.407 ' HH ' ' HB2' ' A' ' 8' ' ' TYR . 18.0 p90 -128.69 163.97 23.95 Favored 'General case' 0 C--N 1.281 -2.383 0 CA-C-N 115.197 -0.911 . . . . 0.0 108.712 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -101.62 128.6 47.82 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.461 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 25.9 mmm180 -118.3 132.63 56.28 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 120.866 0.365 . . . . 0.0 111.201 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 97.2 m -99.96 110.06 22.4 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.39 175.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -102.67 95.51 6.26 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.277 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -174.637 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt . . . . . 0 N--CA 1.445 -0.7 0 CA-C-O 120.995 0.426 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.0 t90 -82.87 119.67 24.68 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.909 -178.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.0 m -109.43 131.1 55.38 Favored 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.906 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -138.31 151.8 47.91 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 124.162 0.985 . . . . 0.0 108.819 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -97.26 136.29 37.97 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -177.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.548 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 40.7 t -125.12 135.56 63.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -175.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -109.6 117.45 33.97 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 172.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -129.22 110.14 11.72 Favored 'General case' 0 N--CA 1.418 -2.062 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 -174.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 69.23 16.82 8.43 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.174 0.989 . . . . 0.0 111.37 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.43 -3.27 61.35 Favored Glycine 0 N--CA 1.441 -0.993 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 -178.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.1 mt -98.5 114.83 37.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 28.6 m -104.65 133.45 49.47 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 120.041 -0.664 . . . . 0.0 110.283 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -143.65 158.66 43.5 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.537 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.4 ttp180 -99.38 128.23 45.48 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -115.88 141.39 48.16 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 86.2 m -117.21 110.79 18.58 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 29.5 ttt180 -96.83 95.88 8.17 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.695 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -175.361 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.4 pttm . . . . . 0 N--CA 1.444 -0.728 0 CA-C-O 121.743 0.782 . . . . 0.0 109.842 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -91.4 108.97 20.26 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.615 177.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 74.3 m -110.46 119.62 39.77 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 10.6 p90 -129.7 160.12 34.35 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.988 -172.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -85.6 128.17 34.68 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.078 -0.964 . . . . 0.0 108.862 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.488 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 14.5 t -123.53 116.8 49.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 79.4 m -109.54 120.72 43.35 Favored 'General case' 0 C--N 1.289 -2.044 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -122.93 102.35 7.96 Favored 'General case' 0 N--CA 1.417 -2.092 0 N-CA-C 107.205 -1.405 . . . . 0.0 107.205 -176.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 65.04 22.18 12.36 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.29 1.036 . . . . 0.0 111.929 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.57 -20.94 26.8 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 121.054 -0.594 . . . . 0.0 111.793 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 50.0 mt -82.56 112.86 20.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -179.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.7 m -105.31 121.06 43.09 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 121.583 0.706 . . . . 0.0 110.598 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -126.85 150.72 49.09 Favored 'General case' 0 C--N 1.281 -2.372 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.701 177.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.3 ttm180 -100.53 125.97 46.92 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.452 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 26.8 mmm180 -119.97 153.42 35.99 Favored 'General case' 0 C--N 1.298 -1.643 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.568 -179.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.9 m -125.54 115.2 19.82 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 121.47 0.652 . . . . 0.0 110.985 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 73.2 ttt180 -107.49 99.4 8.91 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -0.853 0 N-CA-C 107.465 -2.254 . . . . 0.0 107.465 -172.18 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt . . . . . 0 CA--C 1.506 -0.729 0 CA-C-O 121.372 0.606 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 22.8 t90 -88.16 124.24 33.62 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.295 -178.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 66.8 m -109.63 124.76 51.72 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.217 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -138.95 160.69 39.16 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.087 0.47 . . . . 0.0 111.874 -176.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -81.05 125.51 30.28 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.389 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.498 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 26.1 t -113.41 117.42 55.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -109.94 114.69 28.44 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-O 121.524 0.678 . . . . 0.0 109.827 178.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -114.9 99.74 7.7 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.678 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.8 mtm180 55.85 38.63 30.26 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.142 -0.936 . . . . 0.0 112.757 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.2 -15.4 62.44 Favored Glycine 0 N--CA 1.439 -1.13 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.91 177.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.7 mt -90.6 109.86 21.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 54.4 m -107.13 135.2 49.08 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 121.323 0.583 . . . . 0.0 111.239 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -141.48 151.03 42.98 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.241 176.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.407 ' HD3' ' HB3' ' A' ' 3' ' ' CYS . 3.5 tmm_? -97.92 124.0 42.15 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -178.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -123.32 146.48 47.87 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.145 -177.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 71.4 m -106.94 112.9 26.07 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.298 176.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -100.5 93.41 5.61 Favored 'General case' 0 N--CA 1.424 -1.766 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.086 0 N-CA-C 109.799 -1.32 . . . . 0.0 109.799 -175.52 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.0 mttm . . . . . 0 CA--C 1.512 -0.508 0 CA-C-O 121.269 0.556 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -105.73 128.81 53.91 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.448 -175.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 71.8 m -109.29 129.01 55.52 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 174.433 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.7 p90 -126.3 156.22 40.74 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-O 121.506 0.67 . . . . 0.0 111.417 -175.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 46.9 ttt180 -89.46 124.16 34.24 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 114.352 -1.294 . . . . 0.0 108.856 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.477 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 15.5 t -111.21 116.07 51.54 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.113 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.6 m -109.23 120.16 41.68 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 120.161 -0.615 . . . . 0.0 110.082 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -124.18 101.94 7.46 Favored 'General case' 0 N--CA 1.411 -2.397 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 65.44 32.99 9.16 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 125.021 1.329 . . . . 0.0 111.707 176.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.33 -21.85 42.54 Favored Glycine 0 C--N 1.316 -0.559 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.948 179.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.3 mt -87.8 115.75 28.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.9 m -109.44 130.28 55.51 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.687 -178.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -128.32 146.23 50.82 Favored 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.448 177.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -89.65 130.54 35.92 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -128.89 145.3 51.25 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 74.5 m -117.33 124.31 48.65 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 121.106 0.479 . . . . 0.0 110.831 -177.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 30.6 tpt180 -121.39 103.58 9.06 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.422 -2.265 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 -177.556 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp . . . . . 0 CA--C 1.505 -0.775 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 31.1 t90 -68.17 112.63 5.21 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 114.145 -1.389 . . . . 0.0 111.38 -177.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.9 m -108.81 125.14 51.64 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.049 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -131.47 159.08 39.13 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.143 -174.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -83.53 127.94 34.13 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.629 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.498 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.2 t -118.67 122.94 70.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 97.0 m -109.81 118.31 36.16 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-O 121.161 0.505 . . . . 0.0 109.665 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -131.17 109.35 10.37 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.281 -176.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 63.24 21.16 12.68 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.108 1.363 . . . . 0.0 111.871 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.33 -26.25 15.52 Favored Glycine 0 N--CA 1.437 -1.289 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.5 mt -83.4 112.78 21.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -179.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 61.7 m -104.74 125.26 50.64 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-O 121.238 0.542 . . . . 0.0 109.657 178.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -131.59 170.43 14.76 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.213 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.416 ' HD2' ' N ' ' A' ' 14' ' ' ARG . 8.4 mpt_? -106.66 132.57 52.5 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.407 ' HA ' ' NE ' ' A' ' 15' ' ' ARG . 5.3 mmp_? -123.7 154.78 38.94 Favored 'General case' 0 C--N 1.287 -2.13 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.5 m -127.01 111.32 13.93 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-O 121.136 0.494 . . . . 0.0 110.831 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -96.07 88.06 4.74 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.088 0 N-CA-C 108.945 -1.662 . . . . 0.0 108.945 -173.301 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt . . . . . 0 N--CA 1.442 -0.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.6 t90 -108.9 124.07 50.08 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.559 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.7 m -109.72 132.15 54.41 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 177.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -129.78 158.73 38.62 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 121.584 0.707 . . . . 0.0 111.817 -175.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -92.27 129.26 38.27 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.173 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.516 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.7 t -117.13 121.21 67.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.3 m -109.67 122.24 47.02 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 121.219 0.533 . . . . 0.0 110.344 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -128.78 105.06 7.99 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 115.467 -0.788 . . . . 0.0 108.912 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 62.79 23.64 14.09 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 124.583 1.153 . . . . 0.0 112.749 176.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.38 -16.39 38.06 Favored Glycine 0 C--N 1.311 -0.85 0 C-N-CA 121.021 -0.609 . . . . 0.0 111.618 -178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.9 mt -91.39 109.7 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.516 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.4 m -107.1 129.87 54.77 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -131.62 159.25 38.81 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.708 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -101.85 126.67 48.79 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.453 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.7 mmp_? -128.07 155.0 45.06 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 74.1 m -119.93 145.03 47.11 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.063 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -130.89 99.86 5.06 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.837 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -177.516 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.3 pttt . . . . . 0 N--CA 1.449 -0.524 0 CA-C-O 121.03 0.443 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.7 t90 -75.78 121.04 21.99 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.866 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 73.8 m -109.45 135.0 51.18 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.482 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -137.25 160.2 39.71 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 121.312 0.577 . . . . 0.0 111.852 -174.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -82.14 130.01 34.97 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.513 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.9 t -125.63 136.01 62.16 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 85.1 m -120.46 119.8 34.06 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.201 0.525 . . . . 0.0 110.046 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.437 ' HB2' ' HH ' ' A' ' 13' ' ' TYR . 59.6 t80 -111.27 101.76 10.22 Favored 'General case' 0 N--CA 1.422 -1.832 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 -177.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 63.79 22.32 13.01 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 124.446 1.099 . . . . 0.0 111.482 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.12 -25.02 17.2 Favored Glycine 0 N--CA 1.441 -0.979 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.894 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 65.5 mt -81.62 113.27 20.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 39.5 m -100.03 142.99 30.77 Favored 'General case' 0 C--N 1.302 -1.474 0 C-N-CA 120.081 -0.648 . . . . 0.0 111.282 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.437 ' HH ' ' HB2' ' A' ' 8' ' ' TYR . 15.0 p90 -145.56 170.61 16.08 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 124.043 0.937 . . . . 0.0 110.174 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -99.12 124.7 44.34 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.0 mmm180 -128.32 159.97 33.65 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 34.5 m -132.94 150.63 52.14 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 120.136 -0.625 . . . . 0.0 110.671 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -125.71 94.12 4.04 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.262 0 N-CA-C 110.244 -1.142 . . . . 0.0 110.244 -176.954 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt . . . . . 0 C--O 1.242 0.687 0 CA-C-O 121.961 0.886 . . . . 0.0 108.648 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -82.61 121.23 26.56 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.441 -173.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 79.3 m -118.9 133.06 56.08 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 175.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -133.38 160.65 36.74 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.599 -172.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -88.93 129.6 35.59 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.998 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 41.1 t -124.61 124.71 68.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.8 m -111.39 124.67 52.73 Favored 'General case' 0 C--N 1.288 -2.072 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -132.1 108.22 9.16 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.9 mtm180 65.52 19.93 11.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.64 1.176 . . . . 0.0 112.471 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.35 -20.76 29.85 Favored Glycine 0 C--N 1.307 -1.051 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.871 -179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -88.58 114.98 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.294 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 60.1 m -104.7 126.79 52.12 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.167 0.508 . . . . 0.0 110.179 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 10.6 p90 -125.56 159.6 31.67 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.204 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -95.53 121.87 37.68 Favored 'General case' 0 N--CA 1.425 -1.676 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -178.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -111.03 145.71 38.0 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.1 m -124.18 132.7 53.64 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 121.625 0.726 . . . . 0.0 111.269 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -126.02 75.71 1.53 Allowed 'General case' 0 N--CA 1.418 -2.027 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.679 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.032 -177.969 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 93.8 mttt . . . . . 0 CA--C 1.507 -0.684 0 CA-C-O 121.733 0.778 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.7 t90 -109.61 118.53 36.81 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.849 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.8 m -109.66 119.57 39.8 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.594 0.711 . . . . 0.0 109.7 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -126.18 160.24 30.77 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.665 -174.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -95.46 133.64 39.21 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.526 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 21.5 t -123.5 122.61 65.47 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 92.2 m -109.03 116.01 31.17 Favored 'General case' 0 C--N 1.288 -2.088 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -129.52 110.33 11.76 Favored 'General case' 0 N--CA 1.419 -1.995 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -176.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 64.78 22.23 12.51 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 124.099 0.959 . . . . 0.0 112.661 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.06 -22.49 33.15 Favored Glycine 0 CA--C 1.506 -0.502 0 N-CA-C 111.493 -0.643 . . . . 0.0 111.493 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 62.7 mt -87.78 114.9 27.29 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.526 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.5 m -104.59 130.48 52.57 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-O 121.182 0.515 . . . . 0.0 109.735 179.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -134.68 160.97 36.46 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.187 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -102.55 125.79 49.39 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.243 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.487 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.8 mmp_? -120.75 146.91 45.99 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 176.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.0 m -118.14 115.15 24.22 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 49.7 ttt180 -106.81 95.04 5.45 Favored 'General case' 0 N--CA 1.428 -1.571 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.923 0 N-CA-C 109.128 -1.589 . . . . 0.0 109.128 -175.222 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 64.1 pttt . . . . . 0 N--CA 1.449 -0.521 0 CA-C-O 120.876 0.37 . . . . 0.0 111.602 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -120.01 135.45 54.92 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.316 -176.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.7 m -116.94 123.42 46.91 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.094 178.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -123.86 159.4 29.69 Favored 'General case' 0 C--N 1.297 -1.706 0 C-N-CA 123.664 0.785 . . . . 0.0 110.252 -175.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.4 ttt180 -105.99 134.1 49.65 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 58.5 t -121.47 131.35 73.28 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.853 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -177.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 70.9 m -109.63 124.8 51.79 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 175.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -146.06 124.31 12.25 Favored 'General case' 0 N--CA 1.416 -2.152 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -177.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.2 mtm180 64.96 16.33 10.49 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.175 0.99 . . . . 0.0 112.466 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.73 -7.47 59.33 Favored Glycine 0 N--CA 1.436 -1.3 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 56.8 mt -102.2 125.14 56.45 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.112 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 47.7 m -108.69 134.66 51.11 Favored 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 176.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 p90 -137.42 149.21 46.73 Favored 'General case' 0 C--N 1.289 -2.034 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.144 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -91.52 118.5 30.64 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -118.97 158.22 26.19 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.6 m -131.88 150.48 52.14 Favored 'General case' 0 C--N 1.294 -1.825 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.026 -177.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -142.92 99.13 3.4 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.351 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.327 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.8 pttt . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.901 0.381 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.1 t90 -100.66 121.93 42.47 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.974 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 75.1 m -112.56 139.93 47.74 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.783 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -136.88 154.61 50.44 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.354 -174.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -97.09 129.62 44.48 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 123.824 0.85 . . . . 0.0 109.345 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 46.7 t -122.45 128.53 75.43 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.332 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 178.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 71.3 m -109.69 111.88 23.61 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.714 0.768 . . . . 0.0 111.057 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -108.17 96.31 6.28 Favored 'General case' 0 N--CA 1.423 -1.789 0 CA-C-N 114.482 -1.236 . . . . 0.0 108.798 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 57.31 32.3 21.54 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 124.511 1.124 . . . . 0.0 112.895 176.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.22 -23.5 20.65 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 121.066 -0.588 . . . . 0.0 111.824 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 60.5 mt -88.66 109.38 19.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 59.7 m -101.3 121.05 41.2 Favored 'General case' 0 C--N 1.283 -2.296 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.402 ' CE1' ' HB ' ' A' ' 6' ' ' VAL . 17.5 p90 -119.78 155.26 32.88 Favored 'General case' 0 C--N 1.277 -2.58 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.029 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -102.44 122.16 43.75 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 -177.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.9 mmm180 -117.44 156.06 28.59 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 78.6 m -128.82 139.15 52.31 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -178.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -130.31 94.5 3.69 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.859 0 N-CA-C 108.879 -1.689 . . . . 0.0 108.879 -174.05 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.8 mttm . . . . . 0 C--O 1.238 0.467 0 CA-C-O 122.103 0.954 . . . . 0.0 108.953 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.0 t90 -88.51 109.88 20.42 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 113.858 -1.519 . . . . 0.0 110.806 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 80.2 m -113.08 119.2 37.03 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.281 0.562 . . . . 0.0 110.033 178.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.7 p90 -118.43 150.59 39.3 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.365 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -87.64 123.46 32.52 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.624 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.458 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 60.4 t -112.99 125.69 70.28 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.7 m -109.27 119.46 39.55 Favored 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -134.21 113.2 11.76 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 63.5 29.43 15.38 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 124.302 1.041 . . . . 0.0 111.738 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.02 -28.14 15.92 Favored Glycine 0 N--CA 1.435 -1.37 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.641 177.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 40.0 mm -86.71 129.16 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.57 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.7 m -111.99 135.47 52.6 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.056 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.8 p90 -134.24 145.05 48.78 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.053 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.5 tpp180 -85.2 108.19 17.61 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.192 -179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -98.64 129.11 45.13 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 86.1 m -105.15 126.39 52.02 Favored 'General case' 0 C--N 1.282 -2.367 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.075 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -125.41 83.68 2.19 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.719 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -175.64 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.0 pttp . . . . . 0 C--O 1.237 0.404 0 CA-C-O 120.937 0.398 . . . . 0.0 111.413 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.0 t90 -110.19 114.74 28.48 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-O 121.085 0.469 . . . . 0.0 112.132 -175.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 74.2 m -108.61 128.14 54.58 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -140.29 153.14 46.37 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.849 -174.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.7 ttt180 -91.64 128.08 37.33 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.531 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 20.6 t -117.63 121.3 67.17 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.611 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 94.3 m -108.55 116.46 32.01 Favored 'General case' 0 C--N 1.281 -2.388 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 177.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -125.89 104.78 8.5 Favored 'General case' 0 N--CA 1.418 -2.033 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 -177.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 66.08 27.29 10.59 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.281 1.433 . . . . 0.0 111.264 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.78 -25.51 27.23 Favored Glycine 0 N--CA 1.44 -1.068 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.129 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.6 mt -82.66 111.92 19.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.1 m -104.39 129.62 52.32 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.105 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -130.83 147.4 52.48 Favored 'General case' 0 C--N 1.287 -2.122 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.682 178.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -95.24 116.18 28.41 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -178.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 23.8 mmt180 -105.53 157.15 17.58 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.875 -0.416 . . . . 0.0 109.875 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 97.2 m -134.18 109.26 8.77 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -99.26 89.45 4.22 Favored 'General case' 0 N--CA 1.415 -2.221 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 178.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.056 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 -177.235 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 59.4 pttt . . . . . 0 C--O 1.235 0.339 0 CA-C-O 121.356 0.598 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.0 t90 -106.25 131.04 53.95 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.597 178.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 96.5 m -121.55 139.25 53.75 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.154 0.502 . . . . 0.0 110.025 178.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -137.84 158.84 43.52 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.596 0.712 . . . . 0.0 112.127 -172.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -91.86 132.63 36.32 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.86 -1.063 . . . . 0.0 108.749 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.477 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 21.0 t -123.92 124.22 68.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.88 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.7 m -111.17 121.47 45.38 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 175.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -131.35 110.74 11.28 Favored 'General case' 0 N--CA 1.419 -1.985 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -176.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.8 mtm180 65.04 23.4 12.48 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 124.066 0.946 . . . . 0.0 112.199 178.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.03 -27.29 12.06 Favored Glycine 0 N--CA 1.438 -1.201 0 C-N-CA 120.959 -0.638 . . . . 0.0 113.02 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.1 mt -91.64 129.69 41.94 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.7 m -110.67 136.19 50.14 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.073 0.463 . . . . 0.0 109.956 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -139.26 161.13 38.17 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.872 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -98.37 129.41 45.03 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -178.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.6 mmt-85 -129.92 160.11 34.59 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 85.2 m -132.12 156.71 45.88 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 121.486 0.66 . . . . 0.0 111.533 -177.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -135.21 92.2 2.83 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 106.93 -1.507 . . . . 0.0 106.93 175.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.558 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.57 -179.511 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt . . . . . 0 N--CA 1.446 -0.645 0 CA-C-O 121.476 0.655 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 32.1 t90 -102.1 115.74 31.19 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.397 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.3 m -109.89 123.1 49.0 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.657 0.741 . . . . 0.0 110.611 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -122.46 149.48 43.81 Favored 'General case' 0 C--N 1.285 -2.199 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.474 -173.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 36.2 ttt180 -89.54 127.78 35.92 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.598 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 39.3 t -116.22 127.97 73.66 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.833 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -176.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 90.0 m -109.7 116.66 32.11 Favored 'General case' 0 C--N 1.29 -1.979 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -128.97 108.88 10.76 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 115.05 -0.977 . . . . 0.0 108.857 -176.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.8 mtp180 59.11 29.74 19.36 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 123.938 0.895 . . . . 0.0 112.195 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.34 -19.98 48.84 Favored Glycine 0 N--CA 1.435 -1.407 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.422 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.0 mt -89.4 115.86 29.83 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.598 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 56.4 m -106.06 122.97 47.25 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 177.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -128.98 161.92 28.8 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.255 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -99.17 124.31 44.12 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -178.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -119.36 152.0 37.53 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 75.3 m -127.2 132.04 50.53 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-O 120.953 0.406 . . . . 0.0 111.226 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -122.44 100.19 6.81 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 175.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.874 0 N-CA-C 109.079 -1.608 . . . . 0.0 109.079 -174.64 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 61.4 pttt . . . . . 0 C--O 1.244 0.799 0 CA-C-O 121.898 0.856 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -114.82 113.16 23.86 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.713 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.9 m -108.89 134.56 51.41 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.691 179.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.2 p90 -140.33 160.0 40.94 Favored 'General case' 0 C--N 1.287 -2.145 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.524 -176.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -107.51 130.63 54.84 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.447 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 51.7 t -125.78 132.2 71.05 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.1 m -112.15 116.7 30.91 Favored 'General case' 0 N--CA 1.422 -1.875 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 176.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -111.7 102.37 10.68 Favored 'General case' 0 N--CA 1.408 -2.566 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 -177.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 68.09 18.9 9.36 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.54 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.29 -20.82 25.26 Favored Glycine 0 C--N 1.309 -0.93 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.058 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 76.7 mt -84.1 116.37 27.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 30.9 m -106.69 123.36 48.01 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.109 -176.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -119.35 154.47 33.53 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.999 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -93.54 111.58 23.28 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.485 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -106.71 138.31 43.12 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.002 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 98.5 m -135.06 109.7 8.57 Favored 'General case' 0 C--N 1.286 -2.186 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.661 179.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.8 101.48 10.35 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 178.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.415 -2.727 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -176.642 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 pttp . . . . . 0 N--CA 1.45 -0.466 0 CA-C-O 120.648 0.261 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -94.15 124.15 37.98 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 121.01 0.433 . . . . 0.0 110.967 -177.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 64.2 m -117.75 118.96 33.49 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.432 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -118.15 158.27 25.38 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.785 -178.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 34.2 ttt180 -98.82 130.88 45.27 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.369 -175.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.7 t -126.12 126.49 69.65 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.0 m -109.58 118.92 37.85 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -123.18 105.82 10.22 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 63.27 25.3 14.67 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 123.808 0.843 . . . . 0.0 110.955 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.99 -17.24 57.49 Favored Glycine 0 N--CA 1.439 -1.161 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.928 -179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 71.3 mt -79.56 109.48 14.22 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.519 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 55.9 m -105.97 120.25 41.29 Favored 'General case' 0 C--N 1.285 -2.217 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.137 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.431 ' CE2' ' HB ' ' A' ' 6' ' ' VAL . 19.5 p90 -120.29 160.21 23.44 Favored 'General case' 0 C--N 1.281 -2.399 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.309 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -106.91 115.3 29.94 Favored 'General case' 0 C--N 1.291 -1.946 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.465 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 22.4 mmm180 -100.04 124.46 45.43 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 120.933 0.397 . . . . 0.0 110.225 178.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 93.9 m -105.65 113.62 27.29 Favored 'General case' 0 C--N 1.278 -2.527 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.433 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -113.24 102.64 10.55 Favored 'General case' 0 N--CA 1.416 -2.146 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.717 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -175.287 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 65.8 mttm . . . . . 0 CA--C 1.51 -0.561 0 CA-C-O 122.231 1.015 . . . . 0.0 109.657 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -114.19 110.02 19.32 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.421 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 72.0 m -109.6 145.6 36.14 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 175.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.6 p90 -140.22 156.05 46.65 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.163 0.506 . . . . 0.0 111.661 -175.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -100.91 130.66 46.95 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.502 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 60.8 t -129.28 124.09 59.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 87.9 m -108.68 116.57 32.22 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -120.58 100.2 6.99 Favored 'General case' 0 N--CA 1.418 -2.071 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -176.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.2 mtm180 57.91 34.23 24.1 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.779 1.232 . . . . 0.0 113.106 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.26 -20.08 31.05 Favored Glycine 0 N--CA 1.44 -1.058 0 C-N-CA 121.054 -0.593 . . . . 0.0 112.892 177.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 55.2 mt -97.4 113.08 30.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 55.7 m -102.6 128.04 49.44 Favored 'General case' 0 C--N 1.293 -1.88 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -126.24 148.63 49.44 Favored 'General case' 0 C--N 1.284 -2.25 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.697 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -92.82 115.41 28.09 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.455 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.6 mmp_? -114.34 148.07 38.16 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 94.3 m -128.73 142.18 51.09 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-O 121.046 0.451 . . . . 0.0 111.332 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -134.53 94.65 3.23 Favored 'General case' 0 N--CA 1.417 -2.078 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 174.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.471 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.259 -179.636 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.5 pttm . . . . . 0 N--CA 1.44 -0.968 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.2 t90 -95.88 117.64 30.98 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 121.338 0.589 . . . . 0.0 110.741 -177.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 67.1 m -108.96 120.43 42.5 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -135.35 161.25 35.95 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.795 -174.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.0 ttt180 -75.66 125.98 30.11 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.265 177.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.465 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 58.8 t -116.16 123.41 71.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.785 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 178.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.4 m -110.71 125.19 53.23 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 121.384 0.611 . . . . 0.0 110.239 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -130.89 104.71 7.3 Favored 'General case' 0 N--CA 1.42 -1.94 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.992 -177.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 62.71 26.78 15.81 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.941 0.896 . . . . 0.0 112.459 176.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.96 -20.64 38.0 Favored Glycine 0 C--O 1.244 0.72 0 N-CA-C 111.592 -0.603 . . . . 0.0 111.592 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 65.1 mt -88.79 117.67 32.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 61.7 m -107.25 129.15 54.91 Favored 'General case' 0 C--N 1.289 -2.03 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.715 179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -131.47 169.95 15.37 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.632 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -104.64 129.04 52.83 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 -178.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 24.4 mmm180 -127.28 142.11 51.55 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 120.683 0.277 . . . . 0.0 110.604 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.1 m -112.98 111.36 22.05 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.272 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -107.8 113.87 27.42 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 176.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.301 0 N-CA-C 108.628 -1.789 . . . . 0.0 108.628 -173.558 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.5 pttt . . . . . 0 N--CA 1.447 -0.577 0 CA-C-O 121.54 0.686 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.9 t90 -104.22 110.72 23.04 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.691 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 56.1 m -109.04 126.99 53.72 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -177.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -138.86 160.9 38.59 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.992 -175.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -77.35 130.21 36.84 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.232 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 32.4 t -125.68 121.78 60.78 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.754 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.3 m -109.02 118.75 37.61 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.407 ' HB2' ' HH ' ' A' ' 13' ' ' TYR . 58.5 t80 -125.47 105.12 8.82 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.194 -176.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.7 mtm180 63.82 28.09 14.66 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 124.479 1.111 . . . . 0.0 111.877 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.43 -28.64 10.56 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.199 178.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.0 mt -86.69 113.63 24.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -178.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 62.3 m -100.54 124.17 45.73 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.321 0.581 . . . . 0.0 110.098 178.332 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.407 ' HH ' ' HB2' ' A' ' 8' ' ' TYR . 18.0 p90 -128.69 163.97 23.95 Favored 'General case' 0 C--N 1.281 -2.383 0 CA-C-N 115.197 -0.911 . . . . 0.0 108.712 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -101.62 128.6 47.82 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.461 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 25.9 mmm180 -118.3 132.63 56.28 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 120.866 0.365 . . . . 0.0 111.201 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 97.2 m -99.96 110.06 22.4 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.39 175.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -102.67 95.51 6.26 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.277 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -174.637 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt . . . . . 0 N--CA 1.445 -0.7 0 CA-C-O 120.995 0.426 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.0 t90 -82.87 119.67 24.68 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.909 -178.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.0 m -109.43 131.1 55.38 Favored 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.906 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -138.31 151.8 47.91 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 124.162 0.985 . . . . 0.0 108.819 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -97.26 136.29 37.97 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -177.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.548 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 40.7 t -125.12 135.56 63.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -175.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -109.6 117.45 33.97 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 172.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -129.22 110.14 11.72 Favored 'General case' 0 N--CA 1.418 -2.062 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 -174.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 69.23 16.82 8.43 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.174 0.989 . . . . 0.0 111.37 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.43 -3.27 61.35 Favored Glycine 0 N--CA 1.441 -0.993 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 -178.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.1 mt -98.5 114.83 37.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 28.6 m -104.65 133.45 49.47 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 120.041 -0.664 . . . . 0.0 110.283 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -143.65 158.66 43.5 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.537 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.4 ttp180 -99.38 128.23 45.48 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -115.88 141.39 48.16 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 86.2 m -117.21 110.79 18.58 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 29.5 ttt180 -96.83 95.88 8.17 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.695 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -175.361 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.4 pttm . . . . . 0 N--CA 1.444 -0.728 0 CA-C-O 121.743 0.782 . . . . 0.0 109.842 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -91.4 108.97 20.26 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.615 177.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 74.3 m -110.46 119.62 39.77 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 10.6 p90 -129.7 160.12 34.35 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.988 -172.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -85.6 128.17 34.68 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.078 -0.964 . . . . 0.0 108.862 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.488 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 14.5 t -123.53 116.8 49.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 79.4 m -109.54 120.72 43.35 Favored 'General case' 0 C--N 1.289 -2.044 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -122.93 102.35 7.96 Favored 'General case' 0 N--CA 1.417 -2.092 0 N-CA-C 107.205 -1.405 . . . . 0.0 107.205 -176.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 65.04 22.18 12.36 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.29 1.036 . . . . 0.0 111.929 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.57 -20.94 26.8 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 121.054 -0.594 . . . . 0.0 111.793 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 50.0 mt -82.56 112.86 20.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -179.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.7 m -105.31 121.06 43.09 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 121.583 0.706 . . . . 0.0 110.598 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -126.85 150.72 49.09 Favored 'General case' 0 C--N 1.281 -2.372 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.701 177.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.3 ttm180 -100.53 125.97 46.92 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.452 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 26.8 mmm180 -119.97 153.42 35.99 Favored 'General case' 0 C--N 1.298 -1.643 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.568 -179.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.9 m -125.54 115.2 19.82 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 121.47 0.652 . . . . 0.0 110.985 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 73.2 ttt180 -107.49 99.4 8.91 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -0.853 0 N-CA-C 107.465 -2.254 . . . . 0.0 107.465 -172.18 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt . . . . . 0 CA--C 1.506 -0.729 0 CA-C-O 121.372 0.606 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 22.8 t90 -88.16 124.24 33.62 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.295 -178.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 66.8 m -109.63 124.76 51.72 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.217 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -138.95 160.69 39.16 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.087 0.47 . . . . 0.0 111.874 -176.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -81.05 125.51 30.28 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.389 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.495 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 26.1 t -113.41 117.42 55.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -109.94 114.69 28.44 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-O 121.524 0.678 . . . . 0.0 109.827 178.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -114.9 99.74 7.7 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.678 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.8 mtm180 55.85 38.63 30.26 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.142 -0.936 . . . . 0.0 112.757 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.2 -15.4 62.44 Favored Glycine 0 N--CA 1.439 -1.13 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.91 177.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.7 mt -90.6 109.86 21.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 54.4 m -107.13 135.2 49.08 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 121.323 0.583 . . . . 0.0 111.239 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -141.48 151.03 42.98 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.241 176.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.457 ' HD3' ' HB3' ' A' ' 3' ' ' CYS . 3.5 tmm_? -97.92 124.0 42.15 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -178.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -123.32 146.48 47.87 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.145 -177.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 71.4 m -106.94 112.9 26.07 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.298 176.35 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -100.5 93.41 5.61 Favored 'General case' 0 N--CA 1.424 -1.766 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.086 0 N-CA-C 109.799 -1.32 . . . . 0.0 109.799 -175.52 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.0 mttm . . . . . 0 CA--C 1.512 -0.508 0 CA-C-O 121.269 0.556 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -105.73 128.81 53.91 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.448 -175.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 71.8 m -109.29 129.01 55.52 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 174.433 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.7 p90 -126.3 156.22 40.74 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-O 121.506 0.67 . . . . 0.0 111.417 -175.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 46.9 ttt180 -89.46 124.16 34.24 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 114.352 -1.294 . . . . 0.0 108.856 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.48 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 15.5 t -111.21 116.07 51.54 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.113 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.6 m -109.23 120.16 41.68 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 120.161 -0.615 . . . . 0.0 110.082 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -124.18 101.94 7.46 Favored 'General case' 0 N--CA 1.411 -2.397 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 65.44 32.99 9.16 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 125.021 1.329 . . . . 0.0 111.707 176.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.33 -21.85 42.54 Favored Glycine 0 C--N 1.316 -0.559 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.948 179.023 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.3 mt -87.8 115.75 28.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.9 m -109.44 130.28 55.51 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.687 -178.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -128.32 146.23 50.82 Favored 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.448 177.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -89.65 130.54 35.92 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -128.89 145.3 51.25 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 74.5 m -117.33 124.31 48.65 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 121.106 0.479 . . . . 0.0 110.831 -177.112 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.416 ' HA ' ' HD2' ' A' ' 17' ' ' ARG . 30.6 tpt180 -121.39 103.58 9.06 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.331 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.422 -2.265 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 -177.556 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp . . . . . 0 CA--C 1.505 -0.775 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 31.1 t90 -68.17 112.63 5.21 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 114.145 -1.389 . . . . 0.0 111.38 -177.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.9 m -108.81 125.14 51.64 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.049 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -131.47 159.08 39.13 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.143 -174.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -83.53 127.94 34.13 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.629 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.2 t -118.67 122.94 70.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 97.0 m -109.81 118.31 36.16 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-O 121.161 0.505 . . . . 0.0 109.665 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -131.17 109.35 10.37 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.281 -176.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 63.24 21.16 12.68 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.108 1.363 . . . . 0.0 111.871 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.33 -26.25 15.52 Favored Glycine 0 N--CA 1.437 -1.289 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.5 mt -83.4 112.78 21.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -179.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 61.7 m -104.74 125.26 50.64 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-O 121.238 0.542 . . . . 0.0 109.657 178.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -131.59 170.43 14.76 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.213 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 14' ' ' ARG . 8.4 mpt_? -106.66 132.57 52.5 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.449 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 5.3 mmp_? -123.7 154.78 38.94 Favored 'General case' 0 C--N 1.287 -2.13 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.5 m -127.01 111.32 13.93 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-O 121.136 0.494 . . . . 0.0 110.831 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -96.07 88.06 4.74 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.088 0 N-CA-C 108.945 -1.662 . . . . 0.0 108.945 -173.301 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt . . . . . 0 N--CA 1.442 -0.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.6 t90 -108.9 124.07 50.08 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.559 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.501 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.7 m -109.72 132.15 54.41 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 177.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -129.78 158.73 38.62 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 121.584 0.707 . . . . 0.0 111.817 -175.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -92.27 129.26 38.27 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.173 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.514 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.7 t -117.13 121.21 67.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.3 m -109.67 122.24 47.02 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 121.219 0.533 . . . . 0.0 110.344 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -128.78 105.06 7.99 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 115.467 -0.788 . . . . 0.0 108.912 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 62.79 23.64 14.09 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 124.583 1.153 . . . . 0.0 112.749 176.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.38 -16.39 38.06 Favored Glycine 0 C--N 1.311 -0.85 0 C-N-CA 121.021 -0.609 . . . . 0.0 111.618 -178.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.9 mt -91.39 109.7 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.4 m -107.1 129.87 54.77 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -131.62 159.25 38.81 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.708 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -101.85 126.67 48.79 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.49 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.7 mmp_? -128.07 155.0 45.06 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.501 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 74.1 m -119.93 145.03 47.11 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.063 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -130.89 99.86 5.06 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.837 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -177.516 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.3 pttt . . . . . 0 N--CA 1.449 -0.524 0 CA-C-O 121.03 0.443 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.7 t90 -75.78 121.04 21.99 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.866 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 73.8 m -109.45 135.0 51.18 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.482 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -137.25 160.2 39.71 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 121.312 0.577 . . . . 0.0 111.852 -174.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -82.14 130.01 34.97 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.513 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.412 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 27.9 t -125.63 136.01 62.16 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 177.465 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 85.1 m -120.46 119.8 34.06 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.201 0.525 . . . . 0.0 110.046 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -111.27 101.76 10.22 Favored 'General case' 0 N--CA 1.422 -1.832 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 -177.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 63.79 22.32 13.01 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 124.446 1.099 . . . . 0.0 111.482 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.12 -25.02 17.2 Favored Glycine 0 N--CA 1.441 -0.979 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.894 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 65.5 mt -81.62 113.27 20.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 39.5 m -100.03 142.99 30.77 Favored 'General case' 0 C--N 1.302 -1.474 0 C-N-CA 120.081 -0.648 . . . . 0.0 111.282 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -145.56 170.61 16.08 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 124.043 0.937 . . . . 0.0 110.174 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -99.12 124.7 44.34 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.0 mmm180 -128.32 159.97 33.65 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 34.5 m -132.94 150.63 52.14 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 120.136 -0.625 . . . . 0.0 110.671 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -125.71 94.12 4.04 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.262 0 N-CA-C 110.244 -1.142 . . . . 0.0 110.244 -176.954 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt . . . . . 0 C--O 1.242 0.687 0 CA-C-O 121.961 0.886 . . . . 0.0 108.648 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -82.61 121.23 26.56 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.441 -173.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 79.3 m -118.9 133.06 56.08 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 175.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -133.38 160.65 36.74 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.599 -172.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -88.93 129.6 35.59 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.998 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 41.1 t -124.61 124.71 68.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.8 m -111.39 124.67 52.73 Favored 'General case' 0 C--N 1.288 -2.072 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -132.1 108.22 9.16 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.9 mtm180 65.52 19.93 11.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.64 1.176 . . . . 0.0 112.471 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.35 -20.76 29.85 Favored Glycine 0 C--N 1.307 -1.051 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.871 -179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -88.58 114.98 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.294 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 60.1 m -104.7 126.79 52.12 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.167 0.508 . . . . 0.0 110.179 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 10.6 p90 -125.56 159.6 31.67 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.204 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -95.53 121.87 37.68 Favored 'General case' 0 N--CA 1.425 -1.676 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -178.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.409 ' HA ' ' HE ' ' A' ' 15' ' ' ARG . 1.4 mmp_? -111.03 145.71 38.0 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.1 m -124.18 132.7 53.64 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 121.625 0.726 . . . . 0.0 111.269 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -126.02 75.71 1.53 Allowed 'General case' 0 N--CA 1.418 -2.027 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.679 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.032 -177.969 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 93.8 mttt . . . . . 0 CA--C 1.507 -0.684 0 CA-C-O 121.733 0.778 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.7 t90 -109.61 118.53 36.81 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.849 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.8 m -109.66 119.57 39.8 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.594 0.711 . . . . 0.0 109.7 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -126.18 160.24 30.77 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.665 -174.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -95.46 133.64 39.21 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.522 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 21.5 t -123.5 122.61 65.47 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 92.2 m -109.03 116.01 31.17 Favored 'General case' 0 C--N 1.288 -2.088 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -129.52 110.33 11.76 Favored 'General case' 0 N--CA 1.419 -1.995 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -176.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 64.78 22.23 12.51 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 124.099 0.959 . . . . 0.0 112.661 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.06 -22.49 33.15 Favored Glycine 0 CA--C 1.506 -0.502 0 N-CA-C 111.493 -0.643 . . . . 0.0 111.493 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 62.7 mt -87.78 114.9 27.29 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.5 m -104.59 130.48 52.57 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-O 121.182 0.515 . . . . 0.0 109.735 179.028 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -134.68 160.97 36.46 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.187 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -102.55 125.79 49.39 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.243 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.525 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.8 mmp_? -120.75 146.91 45.99 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 176.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.0 m -118.14 115.15 24.22 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 49.7 ttt180 -106.81 95.04 5.45 Favored 'General case' 0 N--CA 1.428 -1.571 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.923 0 N-CA-C 109.128 -1.589 . . . . 0.0 109.128 -175.222 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 64.1 pttt . . . . . 0 N--CA 1.449 -0.521 0 CA-C-O 120.876 0.37 . . . . 0.0 111.602 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -120.01 135.45 54.92 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.316 -176.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.7 m -116.94 123.42 46.91 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.094 178.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -123.86 159.4 29.69 Favored 'General case' 0 C--N 1.297 -1.706 0 C-N-CA 123.664 0.785 . . . . 0.0 110.252 -175.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.4 ttt180 -105.99 134.1 49.65 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.512 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 58.5 t -121.47 131.35 73.28 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.853 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -177.404 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 70.9 m -109.63 124.8 51.79 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 175.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -146.06 124.31 12.25 Favored 'General case' 0 N--CA 1.416 -2.152 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -177.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.2 mtm180 64.96 16.33 10.49 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.175 0.99 . . . . 0.0 112.466 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.73 -7.47 59.33 Favored Glycine 0 N--CA 1.436 -1.3 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 56.8 mt -102.2 125.14 56.45 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.112 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 47.7 m -108.69 134.66 51.11 Favored 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 176.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 p90 -137.42 149.21 46.73 Favored 'General case' 0 C--N 1.289 -2.034 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.144 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -91.52 118.5 30.64 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -118.97 158.22 26.19 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.6 m -131.88 150.48 52.14 Favored 'General case' 0 C--N 1.294 -1.825 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.026 -177.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -142.92 99.13 3.4 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.351 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.327 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.8 pttt . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.901 0.381 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.1 t90 -100.66 121.93 42.47 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.974 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 75.1 m -112.56 139.93 47.74 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.783 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -136.88 154.61 50.44 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.354 -174.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -97.09 129.62 44.48 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 123.824 0.85 . . . . 0.0 109.345 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.473 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 46.7 t -122.45 128.53 75.43 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.332 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 178.612 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 71.3 m -109.69 111.88 23.61 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.714 0.768 . . . . 0.0 111.057 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -108.17 96.31 6.28 Favored 'General case' 0 N--CA 1.423 -1.789 0 CA-C-N 114.482 -1.236 . . . . 0.0 108.798 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 57.31 32.3 21.54 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 124.511 1.124 . . . . 0.0 112.895 176.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.22 -23.5 20.65 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 121.066 -0.588 . . . . 0.0 111.824 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 60.5 mt -88.66 109.38 19.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 59.7 m -101.3 121.05 41.2 Favored 'General case' 0 C--N 1.283 -2.296 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.475 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.406 ' CE1' ' HB ' ' A' ' 6' ' ' VAL . 17.5 p90 -119.78 155.26 32.88 Favored 'General case' 0 C--N 1.277 -2.58 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.029 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -102.44 122.16 43.75 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 -177.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.9 mmm180 -117.44 156.06 28.59 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 78.6 m -128.82 139.15 52.31 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -178.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -130.31 94.5 3.69 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.859 0 N-CA-C 108.879 -1.689 . . . . 0.0 108.879 -174.05 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.8 mttm . . . . . 0 C--O 1.238 0.467 0 CA-C-O 122.103 0.954 . . . . 0.0 108.953 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.0 t90 -88.51 109.88 20.42 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 113.858 -1.519 . . . . 0.0 110.806 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 80.2 m -113.08 119.2 37.03 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.281 0.562 . . . . 0.0 110.033 178.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.7 p90 -118.43 150.59 39.3 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.365 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -87.64 123.46 32.52 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.624 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.466 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 60.4 t -112.99 125.69 70.28 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.7 m -109.27 119.46 39.55 Favored 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -134.21 113.2 11.76 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 63.5 29.43 15.38 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 124.302 1.041 . . . . 0.0 111.738 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.02 -28.14 15.92 Favored Glycine 0 N--CA 1.435 -1.37 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.641 177.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 40.0 mm -86.71 129.16 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.57 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.7 m -111.99 135.47 52.6 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.056 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.8 p90 -134.24 145.05 48.78 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.053 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.5 tpp180 -85.2 108.19 17.61 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.192 -179.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -98.64 129.11 45.13 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 86.1 m -105.15 126.39 52.02 Favored 'General case' 0 C--N 1.282 -2.367 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.075 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -125.41 83.68 2.19 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.719 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -175.64 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.0 pttp . . . . . 0 C--O 1.237 0.404 0 CA-C-O 120.937 0.398 . . . . 0.0 111.413 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.0 t90 -110.19 114.74 28.48 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-O 121.085 0.469 . . . . 0.0 112.132 -175.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 74.2 m -108.61 128.14 54.58 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.34 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -140.29 153.14 46.37 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.849 -174.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.7 ttt180 -91.64 128.08 37.33 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.534 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 20.6 t -117.63 121.3 67.17 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.611 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 94.3 m -108.55 116.46 32.01 Favored 'General case' 0 C--N 1.281 -2.388 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 177.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -125.89 104.78 8.5 Favored 'General case' 0 N--CA 1.418 -2.033 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 -177.463 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 66.08 27.29 10.59 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.281 1.433 . . . . 0.0 111.264 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.78 -25.51 27.23 Favored Glycine 0 N--CA 1.44 -1.068 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.129 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.6 mt -82.66 111.92 19.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.1 m -104.39 129.62 52.32 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.105 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -130.83 147.4 52.48 Favored 'General case' 0 C--N 1.287 -2.122 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.682 178.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -95.24 116.18 28.41 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -178.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.421 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 23.8 mmt180 -105.53 157.15 17.58 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.875 -0.416 . . . . 0.0 109.875 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 97.2 m -134.18 109.26 8.77 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 176.788 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -99.26 89.45 4.22 Favored 'General case' 0 N--CA 1.415 -2.221 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 178.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.056 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 -177.235 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 59.4 pttt . . . . . 0 C--O 1.235 0.339 0 CA-C-O 121.356 0.598 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.0 t90 -106.25 131.04 53.95 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.597 178.633 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 96.5 m -121.55 139.25 53.75 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.154 0.502 . . . . 0.0 110.025 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -137.84 158.84 43.52 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.596 0.712 . . . . 0.0 112.127 -172.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -91.86 132.63 36.32 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.86 -1.063 . . . . 0.0 108.749 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 21.0 t -123.92 124.22 68.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.88 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.7 m -111.17 121.47 45.38 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 175.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -131.35 110.74 11.28 Favored 'General case' 0 N--CA 1.419 -1.985 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -176.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.8 mtm180 65.04 23.4 12.48 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 124.066 0.946 . . . . 0.0 112.199 178.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.03 -27.29 12.06 Favored Glycine 0 N--CA 1.438 -1.201 0 C-N-CA 120.959 -0.638 . . . . 0.0 113.02 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.1 mt -91.64 129.69 41.94 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.039 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.7 m -110.67 136.19 50.14 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.073 0.463 . . . . 0.0 109.956 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CE2' ' HB ' ' A' ' 6' ' ' VAL . 16.8 p90 -139.26 161.13 38.17 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.872 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -98.37 129.41 45.03 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -178.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.6 mmt-85 -129.92 160.11 34.59 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 85.2 m -132.12 156.71 45.88 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 121.486 0.66 . . . . 0.0 111.533 -177.276 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -135.21 92.2 2.83 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 106.93 -1.507 . . . . 0.0 106.93 175.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.558 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.57 -179.511 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt . . . . . 0 N--CA 1.446 -0.645 0 CA-C-O 121.476 0.655 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 32.1 t90 -102.1 115.74 31.19 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.397 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.3 m -109.89 123.1 49.0 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.657 0.741 . . . . 0.0 110.611 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -122.46 149.48 43.81 Favored 'General case' 0 C--N 1.285 -2.199 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.474 -173.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' A' ' 5' ' ' ARG . 36.2 ttt180 -89.54 127.78 35.92 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.603 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 39.3 t -116.22 127.97 73.66 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.833 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -176.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 90.0 m -109.7 116.66 32.11 Favored 'General case' 0 C--N 1.29 -1.979 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -128.97 108.88 10.76 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 115.05 -0.977 . . . . 0.0 108.857 -176.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.8 mtp180 59.11 29.74 19.36 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 123.938 0.895 . . . . 0.0 112.195 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.34 -19.98 48.84 Favored Glycine 0 N--CA 1.435 -1.407 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.422 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.0 mt -89.4 115.86 29.83 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.603 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 56.4 m -106.06 122.97 47.25 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 177.366 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -128.98 161.92 28.8 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.255 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -99.17 124.31 44.12 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -178.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -119.36 152.0 37.53 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 75.3 m -127.2 132.04 50.53 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-O 120.953 0.406 . . . . 0.0 111.226 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -122.44 100.19 6.81 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 175.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.874 0 N-CA-C 109.079 -1.608 . . . . 0.0 109.079 -174.64 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 61.4 pttt . . . . . 0 C--O 1.244 0.799 0 CA-C-O 121.898 0.856 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -114.82 113.16 23.86 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.713 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.9 m -108.89 134.56 51.41 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.691 179.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.2 p90 -140.33 160.0 40.94 Favored 'General case' 0 C--N 1.287 -2.145 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.524 -176.049 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -107.51 130.63 54.84 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 51.7 t -125.78 132.2 71.05 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.1 m -112.15 116.7 30.91 Favored 'General case' 0 N--CA 1.422 -1.875 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 176.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -111.7 102.37 10.68 Favored 'General case' 0 N--CA 1.408 -2.566 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 -177.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 68.09 18.9 9.36 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.54 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.29 -20.82 25.26 Favored Glycine 0 C--N 1.309 -0.93 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.058 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 76.7 mt -84.1 116.37 27.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 30.9 m -106.69 123.36 48.01 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.109 -176.46 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.403 ' HD2' ' HG2' ' A' ' 15' ' ' ARG . 5.9 p90 -119.35 154.47 33.53 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.999 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -93.54 111.58 23.28 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.485 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.403 ' HG2' ' HD2' ' A' ' 13' ' ' TYR . 27.4 mmm180 -106.71 138.31 43.12 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.002 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 98.5 m -135.06 109.7 8.57 Favored 'General case' 0 C--N 1.286 -2.186 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.661 179.238 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.8 101.48 10.35 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 178.323 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.415 -2.727 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -176.642 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 pttp . . . . . 0 N--CA 1.45 -0.466 0 CA-C-O 120.648 0.261 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -94.15 124.15 37.98 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 121.01 0.433 . . . . 0.0 110.967 -177.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 64.2 m -117.75 118.96 33.49 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.432 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -118.15 158.27 25.38 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.785 -178.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 5' ' ' ARG . 34.2 ttt180 -98.82 130.88 45.27 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.369 -175.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.7 t -126.12 126.49 69.65 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.0 m -109.58 118.92 37.85 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -123.18 105.82 10.22 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 63.27 25.3 14.67 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 123.808 0.843 . . . . 0.0 110.955 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.99 -17.24 57.49 Favored Glycine 0 N--CA 1.439 -1.161 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.928 -179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 71.3 mt -79.56 109.48 14.22 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.519 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 55.9 m -105.97 120.25 41.29 Favored 'General case' 0 C--N 1.285 -2.217 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.137 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.432 ' CE2' ' HB ' ' A' ' 6' ' ' VAL . 19.5 p90 -120.29 160.21 23.44 Favored 'General case' 0 C--N 1.281 -2.399 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.309 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -106.91 115.3 29.94 Favored 'General case' 0 C--N 1.291 -1.946 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.478 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 22.4 mmm180 -100.04 124.46 45.43 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 120.933 0.397 . . . . 0.0 110.225 178.555 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 93.9 m -105.65 113.62 27.29 Favored 'General case' 0 C--N 1.278 -2.527 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.433 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -113.24 102.64 10.55 Favored 'General case' 0 N--CA 1.416 -2.146 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.717 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -175.287 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 65.8 mttm . . . . . 0 CA--C 1.51 -0.561 0 CA-C-O 122.231 1.015 . . . . 0.0 109.657 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -114.19 110.02 19.32 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.421 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.0 m -109.6 145.6 36.14 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 175.584 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.6 p90 -140.22 156.05 46.65 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.163 0.506 . . . . 0.0 111.661 -175.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -100.91 130.66 46.95 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.502 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 60.8 t -129.28 124.09 59.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 87.9 m -108.68 116.57 32.22 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.304 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -120.58 100.2 6.99 Favored 'General case' 0 N--CA 1.418 -2.071 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -176.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.2 mtm180 57.91 34.23 24.1 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.779 1.232 . . . . 0.0 113.106 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.26 -20.08 31.05 Favored Glycine 0 N--CA 1.44 -1.058 0 C-N-CA 121.054 -0.593 . . . . 0.0 112.892 177.361 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 55.2 mt -97.4 113.08 30.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 55.7 m -102.6 128.04 49.44 Favored 'General case' 0 C--N 1.293 -1.88 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.005 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -126.24 148.63 49.44 Favored 'General case' 0 C--N 1.284 -2.25 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.697 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -92.82 115.41 28.09 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.481 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.6 mmp_? -114.34 148.07 38.16 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 94.3 m -128.73 142.18 51.09 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-O 121.046 0.451 . . . . 0.0 111.332 -179.627 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -134.53 94.65 3.23 Favored 'General case' 0 N--CA 1.417 -2.078 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 174.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.471 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.259 -179.636 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.5 pttm . . . . . 0 N--CA 1.44 -0.968 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.2 t90 -95.88 117.64 30.98 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 121.338 0.589 . . . . 0.0 110.741 -177.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 67.1 m -108.96 120.43 42.5 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -135.35 161.25 35.95 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.795 -174.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.0 ttt180 -75.66 125.98 30.11 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.265 177.413 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 58.8 t -116.16 123.41 71.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.785 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 178.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.4 m -110.71 125.19 53.23 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 121.384 0.611 . . . . 0.0 110.239 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -130.89 104.71 7.3 Favored 'General case' 0 N--CA 1.42 -1.94 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.992 -177.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 62.71 26.78 15.81 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.941 0.896 . . . . 0.0 112.459 176.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.96 -20.64 38.0 Favored Glycine 0 C--O 1.244 0.72 0 N-CA-C 111.592 -0.603 . . . . 0.0 111.592 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 65.1 mt -88.79 117.67 32.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 61.7 m -107.25 129.15 54.91 Favored 'General case' 0 C--N 1.289 -2.03 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.715 179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -131.47 169.95 15.37 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.632 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -104.64 129.04 52.83 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 -178.044 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.436 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 24.4 mmm180 -127.28 142.11 51.55 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 120.683 0.277 . . . . 0.0 110.604 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.1 m -112.98 111.36 22.05 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.272 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -107.8 113.87 27.42 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 176.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.301 0 N-CA-C 108.628 -1.789 . . . . 0.0 108.628 -173.558 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.5 pttt . . . . . 0 N--CA 1.447 -0.577 0 CA-C-O 121.54 0.686 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.9 t90 -104.22 110.72 23.04 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.691 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 56.1 m -109.04 126.99 53.72 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -177.546 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -138.86 160.9 38.59 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.992 -175.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -77.35 130.21 36.84 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.232 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 32.4 t -125.68 121.78 60.78 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.754 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.3 m -109.02 118.75 37.61 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -125.47 105.12 8.82 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.194 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.7 mtm180 63.82 28.09 14.66 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 124.479 1.111 . . . . 0.0 111.877 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.43 -28.64 10.56 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.199 178.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.0 mt -86.69 113.63 24.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -178.279 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 62.3 m -100.54 124.17 45.73 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.321 0.581 . . . . 0.0 110.098 178.332 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 18.0 p90 -128.69 163.97 23.95 Favored 'General case' 0 C--N 1.281 -2.383 0 CA-C-N 115.197 -0.911 . . . . 0.0 108.712 178.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -101.62 128.6 47.82 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 25.9 mmm180 -118.3 132.63 56.28 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 120.866 0.365 . . . . 0.0 111.201 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 97.2 m -99.96 110.06 22.4 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.39 175.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -102.67 95.51 6.26 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.277 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -174.637 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt . . . . . 0 N--CA 1.445 -0.7 0 CA-C-O 120.995 0.426 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.0 t90 -82.87 119.67 24.68 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.909 -178.056 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 64.0 m -109.43 131.1 55.38 Favored 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.906 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -138.31 151.8 47.91 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 124.162 0.985 . . . . 0.0 108.819 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -97.26 136.29 37.97 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -177.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.556 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 40.7 t -125.12 135.56 63.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -175.598 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -109.6 117.45 33.97 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 172.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -129.22 110.14 11.72 Favored 'General case' 0 N--CA 1.418 -2.062 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 -174.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 69.23 16.82 8.43 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.174 0.989 . . . . 0.0 111.37 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.43 -3.27 61.35 Favored Glycine 0 N--CA 1.441 -0.993 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 -178.326 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.1 mt -98.5 114.83 37.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 28.6 m -104.65 133.45 49.47 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 120.041 -0.664 . . . . 0.0 110.283 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -143.65 158.66 43.5 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.537 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.4 ttp180 -99.38 128.23 45.48 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.418 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 3.6 mmp_? -115.88 141.39 48.16 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 86.2 m -117.21 110.79 18.58 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 29.5 ttt180 -96.83 95.88 8.17 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.695 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -175.361 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.4 pttm . . . . . 0 N--CA 1.444 -0.728 0 CA-C-O 121.743 0.782 . . . . 0.0 109.842 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -91.4 108.97 20.26 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.615 177.427 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 74.3 m -110.46 119.62 39.77 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 10.6 p90 -129.7 160.12 34.35 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.988 -172.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -85.6 128.17 34.68 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.078 -0.964 . . . . 0.0 108.862 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.49 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 14.5 t -123.53 116.8 49.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 11' ' ' ILE . 79.4 m -109.54 120.72 43.35 Favored 'General case' 0 C--N 1.289 -2.044 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.214 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -122.93 102.35 7.96 Favored 'General case' 0 N--CA 1.417 -2.092 0 N-CA-C 107.205 -1.405 . . . . 0.0 107.205 -176.202 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 65.04 22.18 12.36 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.29 1.036 . . . . 0.0 111.929 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.57 -20.94 26.8 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 121.054 -0.594 . . . . 0.0 111.793 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 50.0 mt -82.56 112.86 20.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.7 m -105.31 121.06 43.09 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 121.583 0.706 . . . . 0.0 110.598 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -126.85 150.72 49.09 Favored 'General case' 0 C--N 1.281 -2.372 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.701 177.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.3 ttm180 -100.53 125.97 46.92 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 26.8 mmm180 -119.97 153.42 35.99 Favored 'General case' 0 C--N 1.298 -1.643 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.568 -179.22 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.9 m -125.54 115.2 19.82 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 121.47 0.652 . . . . 0.0 110.985 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 73.2 ttt180 -107.49 99.4 8.91 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -0.853 0 N-CA-C 107.465 -2.254 . . . . 0.0 107.465 -172.18 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt . . . . . 0 CA--C 1.506 -0.729 0 CA-C-O 121.372 0.606 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 22.8 t90 -88.16 124.24 33.62 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.295 -178.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 66.8 m -109.63 124.76 51.72 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.217 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -138.95 160.69 39.16 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.087 0.47 . . . . 0.0 111.874 -176.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -81.05 125.51 30.28 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.389 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.495 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 26.1 t -113.41 117.42 55.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -109.94 114.69 28.44 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-O 121.524 0.678 . . . . 0.0 109.827 178.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -114.9 99.74 7.7 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.678 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.8 mtm180 55.85 38.63 30.26 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.142 -0.936 . . . . 0.0 112.757 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.2 -15.4 62.44 Favored Glycine 0 N--CA 1.439 -1.13 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.91 177.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.7 mt -90.6 109.86 21.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 54.4 m -107.13 135.2 49.08 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 121.323 0.583 . . . . 0.0 111.239 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -141.48 151.03 42.98 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.241 176.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.457 ' HD3' ' HB3' ' A' ' 3' ' ' CYS . 3.5 tmm_? -97.92 124.0 42.15 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -178.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -123.32 146.48 47.87 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.145 -177.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 71.4 m -106.94 112.9 26.07 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.298 176.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -100.5 93.41 5.61 Favored 'General case' 0 N--CA 1.424 -1.766 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.086 0 N-CA-C 109.799 -1.32 . . . . 0.0 109.799 -175.52 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.0 mttm . . . . . 0 CA--C 1.512 -0.508 0 CA-C-O 121.269 0.556 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -105.73 128.81 53.91 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.448 -175.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 71.8 m -109.29 129.01 55.52 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 174.433 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.7 p90 -126.3 156.22 40.74 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-O 121.506 0.67 . . . . 0.0 111.417 -175.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 46.9 ttt180 -89.46 124.16 34.24 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 114.352 -1.294 . . . . 0.0 108.856 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.48 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 15.5 t -111.21 116.07 51.54 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.113 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.6 m -109.23 120.16 41.68 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 120.161 -0.615 . . . . 0.0 110.082 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -124.18 101.94 7.46 Favored 'General case' 0 N--CA 1.411 -2.397 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 65.44 32.99 9.16 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 125.021 1.329 . . . . 0.0 111.707 176.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.33 -21.85 42.54 Favored Glycine 0 C--N 1.316 -0.559 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.948 179.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.3 mt -87.8 115.75 28.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.9 m -109.44 130.28 55.51 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.687 -178.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -128.32 146.23 50.82 Favored 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.448 177.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -89.65 130.54 35.92 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -128.89 145.3 51.25 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 74.5 m -117.33 124.31 48.65 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 121.106 0.479 . . . . 0.0 110.831 -177.112 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.416 ' HA ' ' HD2' ' A' ' 17' ' ' ARG . 30.6 tpt180 -121.39 103.58 9.06 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.422 -2.265 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 -177.556 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp . . . . . 0 CA--C 1.505 -0.775 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 31.1 t90 -68.17 112.63 5.21 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 114.145 -1.389 . . . . 0.0 111.38 -177.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.9 m -108.81 125.14 51.64 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.049 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -131.47 159.08 39.13 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.143 -174.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -83.53 127.94 34.13 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.629 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.2 t -118.67 122.94 70.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 97.0 m -109.81 118.31 36.16 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-O 121.161 0.505 . . . . 0.0 109.665 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -131.17 109.35 10.37 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.281 -176.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 63.24 21.16 12.68 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.108 1.363 . . . . 0.0 111.871 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.33 -26.25 15.52 Favored Glycine 0 N--CA 1.437 -1.289 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.5 mt -83.4 112.78 21.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -179.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 61.7 m -104.74 125.26 50.64 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-O 121.238 0.542 . . . . 0.0 109.657 178.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -131.59 170.43 14.76 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.213 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 14' ' ' ARG . 8.4 mpt_? -106.66 132.57 52.5 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.449 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 5.3 mmp_? -123.7 154.78 38.94 Favored 'General case' 0 C--N 1.287 -2.13 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.5 m -127.01 111.32 13.93 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-O 121.136 0.494 . . . . 0.0 110.831 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -96.07 88.06 4.74 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.088 0 N-CA-C 108.945 -1.662 . . . . 0.0 108.945 -173.301 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt . . . . . 0 N--CA 1.442 -0.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.6 t90 -108.9 124.07 50.08 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.559 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.501 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.7 m -109.72 132.15 54.41 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 177.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -129.78 158.73 38.62 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 121.584 0.707 . . . . 0.0 111.817 -175.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -92.27 129.26 38.27 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.173 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.514 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.7 t -117.13 121.21 67.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.3 m -109.67 122.24 47.02 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 121.219 0.533 . . . . 0.0 110.344 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -128.78 105.06 7.99 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 115.467 -0.788 . . . . 0.0 108.912 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 62.79 23.64 14.09 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 124.583 1.153 . . . . 0.0 112.749 176.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.38 -16.39 38.06 Favored Glycine 0 C--N 1.311 -0.85 0 C-N-CA 121.021 -0.609 . . . . 0.0 111.618 -178.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.9 mt -91.39 109.7 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.4 m -107.1 129.87 54.77 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -131.62 159.25 38.81 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.708 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -101.85 126.67 48.79 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.49 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.7 mmp_? -128.07 155.0 45.06 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.501 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 74.1 m -119.93 145.03 47.11 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.063 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -130.89 99.86 5.06 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.837 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -177.516 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.3 pttt . . . . . 0 N--CA 1.449 -0.524 0 CA-C-O 121.03 0.443 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.7 t90 -75.78 121.04 21.99 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.866 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 73.8 m -109.45 135.0 51.18 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.482 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -137.25 160.2 39.71 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 121.312 0.577 . . . . 0.0 111.852 -174.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -82.14 130.01 34.97 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.513 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.412 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 27.9 t -125.63 136.01 62.16 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 177.465 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 85.1 m -120.46 119.8 34.06 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.201 0.525 . . . . 0.0 110.046 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -111.27 101.76 10.22 Favored 'General case' 0 N--CA 1.422 -1.832 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 -177.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 63.79 22.32 13.01 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 124.446 1.099 . . . . 0.0 111.482 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.12 -25.02 17.2 Favored Glycine 0 N--CA 1.441 -0.979 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.894 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 65.5 mt -81.62 113.27 20.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 39.5 m -100.03 142.99 30.77 Favored 'General case' 0 C--N 1.302 -1.474 0 C-N-CA 120.081 -0.648 . . . . 0.0 111.282 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -145.56 170.61 16.08 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 124.043 0.937 . . . . 0.0 110.174 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -99.12 124.7 44.34 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.0 mmm180 -128.32 159.97 33.65 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 34.5 m -132.94 150.63 52.14 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 120.136 -0.625 . . . . 0.0 110.671 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -125.71 94.12 4.04 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.262 0 N-CA-C 110.244 -1.142 . . . . 0.0 110.244 -176.954 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt . . . . . 0 C--O 1.242 0.687 0 CA-C-O 121.961 0.886 . . . . 0.0 108.648 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -82.61 121.23 26.56 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.441 -173.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 79.3 m -118.9 133.06 56.08 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 175.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -133.38 160.65 36.74 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.599 -172.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -88.93 129.6 35.59 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.998 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 41.1 t -124.61 124.71 68.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.8 m -111.39 124.67 52.73 Favored 'General case' 0 C--N 1.288 -2.072 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -132.1 108.22 9.16 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.9 mtm180 65.52 19.93 11.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.64 1.176 . . . . 0.0 112.471 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.35 -20.76 29.85 Favored Glycine 0 C--N 1.307 -1.051 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.871 -179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -88.58 114.98 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.294 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 60.1 m -104.7 126.79 52.12 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.167 0.508 . . . . 0.0 110.179 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 10.6 p90 -125.56 159.6 31.67 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.204 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -95.53 121.87 37.68 Favored 'General case' 0 N--CA 1.425 -1.676 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -178.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.409 ' HA ' ' HE ' ' A' ' 15' ' ' ARG . 1.4 mmp_? -111.03 145.71 38.0 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.1 m -124.18 132.7 53.64 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 121.625 0.726 . . . . 0.0 111.269 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -126.02 75.71 1.53 Allowed 'General case' 0 N--CA 1.418 -2.027 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.679 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.032 -177.969 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 93.8 mttt . . . . . 0 CA--C 1.507 -0.684 0 CA-C-O 121.733 0.778 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.7 t90 -109.61 118.53 36.81 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.849 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.8 m -109.66 119.57 39.8 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.594 0.711 . . . . 0.0 109.7 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -126.18 160.24 30.77 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.665 -174.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -95.46 133.64 39.21 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.522 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 21.5 t -123.5 122.61 65.47 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 92.2 m -109.03 116.01 31.17 Favored 'General case' 0 C--N 1.288 -2.088 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -129.52 110.33 11.76 Favored 'General case' 0 N--CA 1.419 -1.995 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -176.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 64.78 22.23 12.51 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 124.099 0.959 . . . . 0.0 112.661 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.06 -22.49 33.15 Favored Glycine 0 CA--C 1.506 -0.502 0 N-CA-C 111.493 -0.643 . . . . 0.0 111.493 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 62.7 mt -87.78 114.9 27.29 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.5 m -104.59 130.48 52.57 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-O 121.182 0.515 . . . . 0.0 109.735 179.028 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -134.68 160.97 36.46 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.187 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -102.55 125.79 49.39 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.243 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.525 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.8 mmp_? -120.75 146.91 45.99 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 176.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.0 m -118.14 115.15 24.22 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 49.7 ttt180 -106.81 95.04 5.45 Favored 'General case' 0 N--CA 1.428 -1.571 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.923 0 N-CA-C 109.128 -1.589 . . . . 0.0 109.128 -175.222 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 64.1 pttt . . . . . 0 N--CA 1.449 -0.521 0 CA-C-O 120.876 0.37 . . . . 0.0 111.602 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -120.01 135.45 54.92 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.316 -176.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.7 m -116.94 123.42 46.91 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.094 178.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -123.86 159.4 29.69 Favored 'General case' 0 C--N 1.297 -1.706 0 C-N-CA 123.664 0.785 . . . . 0.0 110.252 -175.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.4 ttt180 -105.99 134.1 49.65 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.512 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 58.5 t -121.47 131.35 73.28 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.853 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -177.404 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 70.9 m -109.63 124.8 51.79 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 175.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -146.06 124.31 12.25 Favored 'General case' 0 N--CA 1.416 -2.152 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -177.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.2 mtm180 64.96 16.33 10.49 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.175 0.99 . . . . 0.0 112.466 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.73 -7.47 59.33 Favored Glycine 0 N--CA 1.436 -1.3 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 56.8 mt -102.2 125.14 56.45 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.112 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 47.7 m -108.69 134.66 51.11 Favored 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 176.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 p90 -137.42 149.21 46.73 Favored 'General case' 0 C--N 1.289 -2.034 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.144 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -91.52 118.5 30.64 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -118.97 158.22 26.19 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.6 m -131.88 150.48 52.14 Favored 'General case' 0 C--N 1.294 -1.825 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.026 -177.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -142.92 99.13 3.4 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.351 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.327 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.8 pttt . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.901 0.381 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.1 t90 -100.66 121.93 42.47 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.974 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 75.1 m -112.56 139.93 47.74 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.783 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -136.88 154.61 50.44 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.354 -174.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -97.09 129.62 44.48 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 123.824 0.85 . . . . 0.0 109.345 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.473 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 46.7 t -122.45 128.53 75.43 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.332 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 178.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 71.3 m -109.69 111.88 23.61 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.714 0.768 . . . . 0.0 111.057 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -108.17 96.31 6.28 Favored 'General case' 0 N--CA 1.423 -1.789 0 CA-C-N 114.482 -1.236 . . . . 0.0 108.798 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 57.31 32.3 21.54 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 124.511 1.124 . . . . 0.0 112.895 176.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.22 -23.5 20.65 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 121.066 -0.588 . . . . 0.0 111.824 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 60.5 mt -88.66 109.38 19.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 59.7 m -101.3 121.05 41.2 Favored 'General case' 0 C--N 1.283 -2.296 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.406 ' CE1' ' HB ' ' A' ' 6' ' ' VAL . 17.5 p90 -119.78 155.26 32.88 Favored 'General case' 0 C--N 1.277 -2.58 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.029 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -102.44 122.16 43.75 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 -177.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.9 mmm180 -117.44 156.06 28.59 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 78.6 m -128.82 139.15 52.31 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -178.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -130.31 94.5 3.69 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.859 0 N-CA-C 108.879 -1.689 . . . . 0.0 108.879 -174.05 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.8 mttm . . . . . 0 C--O 1.238 0.467 0 CA-C-O 122.103 0.954 . . . . 0.0 108.953 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.0 t90 -88.51 109.88 20.42 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 113.858 -1.519 . . . . 0.0 110.806 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 80.2 m -113.08 119.2 37.03 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.281 0.562 . . . . 0.0 110.033 178.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.7 p90 -118.43 150.59 39.3 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.365 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -87.64 123.46 32.52 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.624 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.466 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 60.4 t -112.99 125.69 70.28 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.7 m -109.27 119.46 39.55 Favored 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -134.21 113.2 11.76 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 63.5 29.43 15.38 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 124.302 1.041 . . . . 0.0 111.738 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.02 -28.14 15.92 Favored Glycine 0 N--CA 1.435 -1.37 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.641 177.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 40.0 mm -86.71 129.16 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.57 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.7 m -111.99 135.47 52.6 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.056 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.8 p90 -134.24 145.05 48.78 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.053 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.5 tpp180 -85.2 108.19 17.61 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.192 -179.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -98.64 129.11 45.13 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 86.1 m -105.15 126.39 52.02 Favored 'General case' 0 C--N 1.282 -2.367 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.075 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -125.41 83.68 2.19 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.719 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -175.64 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.0 pttp . . . . . 0 C--O 1.237 0.404 0 CA-C-O 120.937 0.398 . . . . 0.0 111.413 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.0 t90 -110.19 114.74 28.48 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-O 121.085 0.469 . . . . 0.0 112.132 -175.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 74.2 m -108.61 128.14 54.58 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -140.29 153.14 46.37 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.849 -174.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.7 ttt180 -91.64 128.08 37.33 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.534 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 20.6 t -117.63 121.3 67.17 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.611 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 94.3 m -108.55 116.46 32.01 Favored 'General case' 0 C--N 1.281 -2.388 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 177.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -125.89 104.78 8.5 Favored 'General case' 0 N--CA 1.418 -2.033 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 -177.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 66.08 27.29 10.59 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.281 1.433 . . . . 0.0 111.264 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.78 -25.51 27.23 Favored Glycine 0 N--CA 1.44 -1.068 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.129 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.6 mt -82.66 111.92 19.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.1 m -104.39 129.62 52.32 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.105 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -130.83 147.4 52.48 Favored 'General case' 0 C--N 1.287 -2.122 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.682 178.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -95.24 116.18 28.41 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -178.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.421 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 23.8 mmt180 -105.53 157.15 17.58 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.875 -0.416 . . . . 0.0 109.875 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 97.2 m -134.18 109.26 8.77 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 176.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -99.26 89.45 4.22 Favored 'General case' 0 N--CA 1.415 -2.221 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 178.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.056 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 -177.235 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 59.4 pttt . . . . . 0 C--O 1.235 0.339 0 CA-C-O 121.356 0.598 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.0 t90 -106.25 131.04 53.95 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.597 178.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 96.5 m -121.55 139.25 53.75 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.154 0.502 . . . . 0.0 110.025 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -137.84 158.84 43.52 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.596 0.712 . . . . 0.0 112.127 -172.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -91.86 132.63 36.32 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.86 -1.063 . . . . 0.0 108.749 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 21.0 t -123.92 124.22 68.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.88 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.7 m -111.17 121.47 45.38 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 175.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -131.35 110.74 11.28 Favored 'General case' 0 N--CA 1.419 -1.985 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -176.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.8 mtm180 65.04 23.4 12.48 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 124.066 0.946 . . . . 0.0 112.199 178.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.03 -27.29 12.06 Favored Glycine 0 N--CA 1.438 -1.201 0 C-N-CA 120.959 -0.638 . . . . 0.0 113.02 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.1 mt -91.64 129.69 41.94 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.7 m -110.67 136.19 50.14 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.073 0.463 . . . . 0.0 109.956 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CE2' ' HB ' ' A' ' 6' ' ' VAL . 16.8 p90 -139.26 161.13 38.17 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.872 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -98.37 129.41 45.03 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -178.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.6 mmt-85 -129.92 160.11 34.59 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 85.2 m -132.12 156.71 45.88 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 121.486 0.66 . . . . 0.0 111.533 -177.276 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -135.21 92.2 2.83 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 106.93 -1.507 . . . . 0.0 106.93 175.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.558 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.57 -179.511 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt . . . . . 0 N--CA 1.446 -0.645 0 CA-C-O 121.476 0.655 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 32.1 t90 -102.1 115.74 31.19 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.397 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.3 m -109.89 123.1 49.0 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.657 0.741 . . . . 0.0 110.611 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -122.46 149.48 43.81 Favored 'General case' 0 C--N 1.285 -2.199 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.474 -173.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' A' ' 5' ' ' ARG . 36.2 ttt180 -89.54 127.78 35.92 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.603 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 39.3 t -116.22 127.97 73.66 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.833 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -176.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 90.0 m -109.7 116.66 32.11 Favored 'General case' 0 C--N 1.29 -1.979 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -128.97 108.88 10.76 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 115.05 -0.977 . . . . 0.0 108.857 -176.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.8 mtp180 59.11 29.74 19.36 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 123.938 0.895 . . . . 0.0 112.195 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.34 -19.98 48.84 Favored Glycine 0 N--CA 1.435 -1.407 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.422 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.0 mt -89.4 115.86 29.83 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.603 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 56.4 m -106.06 122.97 47.25 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 177.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -128.98 161.92 28.8 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.255 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -99.17 124.31 44.12 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -178.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -119.36 152.0 37.53 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 75.3 m -127.2 132.04 50.53 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-O 120.953 0.406 . . . . 0.0 111.226 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -122.44 100.19 6.81 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 175.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.874 0 N-CA-C 109.079 -1.608 . . . . 0.0 109.079 -174.64 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 61.4 pttt . . . . . 0 C--O 1.244 0.799 0 CA-C-O 121.898 0.856 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -114.82 113.16 23.86 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.713 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.9 m -108.89 134.56 51.41 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.691 179.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.2 p90 -140.33 160.0 40.94 Favored 'General case' 0 C--N 1.287 -2.145 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.524 -176.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -107.51 130.63 54.84 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 51.7 t -125.78 132.2 71.05 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.1 m -112.15 116.7 30.91 Favored 'General case' 0 N--CA 1.422 -1.875 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 176.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -111.7 102.37 10.68 Favored 'General case' 0 N--CA 1.408 -2.566 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 -177.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 68.09 18.9 9.36 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.54 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.29 -20.82 25.26 Favored Glycine 0 C--N 1.309 -0.93 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.058 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 76.7 mt -84.1 116.37 27.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 30.9 m -106.69 123.36 48.01 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.109 -176.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.403 ' HD2' ' HG2' ' A' ' 15' ' ' ARG . 5.9 p90 -119.35 154.47 33.53 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.999 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -93.54 111.58 23.28 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.485 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.403 ' HG2' ' HD2' ' A' ' 13' ' ' TYR . 27.4 mmm180 -106.71 138.31 43.12 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.002 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 98.5 m -135.06 109.7 8.57 Favored 'General case' 0 C--N 1.286 -2.186 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.661 179.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.8 101.48 10.35 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 178.323 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.415 -2.727 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -176.642 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 pttp . . . . . 0 N--CA 1.45 -0.466 0 CA-C-O 120.648 0.261 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -94.15 124.15 37.98 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 121.01 0.433 . . . . 0.0 110.967 -177.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 64.2 m -117.75 118.96 33.49 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.432 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -118.15 158.27 25.38 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.785 -178.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 5' ' ' ARG . 34.2 ttt180 -98.82 130.88 45.27 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.369 -175.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.7 t -126.12 126.49 69.65 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.0 m -109.58 118.92 37.85 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -123.18 105.82 10.22 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 63.27 25.3 14.67 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 123.808 0.843 . . . . 0.0 110.955 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.99 -17.24 57.49 Favored Glycine 0 N--CA 1.439 -1.161 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.928 -179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 71.3 mt -79.56 109.48 14.22 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.519 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 55.9 m -105.97 120.25 41.29 Favored 'General case' 0 C--N 1.285 -2.217 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.137 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.432 ' CE2' ' HB ' ' A' ' 6' ' ' VAL . 19.5 p90 -120.29 160.21 23.44 Favored 'General case' 0 C--N 1.281 -2.399 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.309 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -106.91 115.3 29.94 Favored 'General case' 0 C--N 1.291 -1.946 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.478 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 22.4 mmm180 -100.04 124.46 45.43 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 120.933 0.397 . . . . 0.0 110.225 178.555 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 93.9 m -105.65 113.62 27.29 Favored 'General case' 0 C--N 1.278 -2.527 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.433 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -113.24 102.64 10.55 Favored 'General case' 0 N--CA 1.416 -2.146 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.717 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -175.287 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 65.8 mttm . . . . . 0 CA--C 1.51 -0.561 0 CA-C-O 122.231 1.015 . . . . 0.0 109.657 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -114.19 110.02 19.32 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.421 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.0 m -109.6 145.6 36.14 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 175.584 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.6 p90 -140.22 156.05 46.65 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.163 0.506 . . . . 0.0 111.661 -175.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -100.91 130.66 46.95 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.502 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 60.8 t -129.28 124.09 59.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 87.9 m -108.68 116.57 32.22 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -120.58 100.2 6.99 Favored 'General case' 0 N--CA 1.418 -2.071 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -176.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.2 mtm180 57.91 34.23 24.1 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.779 1.232 . . . . 0.0 113.106 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.26 -20.08 31.05 Favored Glycine 0 N--CA 1.44 -1.058 0 C-N-CA 121.054 -0.593 . . . . 0.0 112.892 177.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 55.2 mt -97.4 113.08 30.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 55.7 m -102.6 128.04 49.44 Favored 'General case' 0 C--N 1.293 -1.88 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.005 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -126.24 148.63 49.44 Favored 'General case' 0 C--N 1.284 -2.25 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.697 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -92.82 115.41 28.09 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.481 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.6 mmp_? -114.34 148.07 38.16 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 94.3 m -128.73 142.18 51.09 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-O 121.046 0.451 . . . . 0.0 111.332 -179.627 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -134.53 94.65 3.23 Favored 'General case' 0 N--CA 1.417 -2.078 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 174.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.471 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.259 -179.636 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.5 pttm . . . . . 0 N--CA 1.44 -0.968 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.2 t90 -95.88 117.64 30.98 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 121.338 0.589 . . . . 0.0 110.741 -177.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 67.1 m -108.96 120.43 42.5 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -135.35 161.25 35.95 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.795 -174.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.0 ttt180 -75.66 125.98 30.11 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.265 177.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 58.8 t -116.16 123.41 71.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.785 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 178.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.4 m -110.71 125.19 53.23 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 121.384 0.611 . . . . 0.0 110.239 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -130.89 104.71 7.3 Favored 'General case' 0 N--CA 1.42 -1.94 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.992 -177.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 62.71 26.78 15.81 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.941 0.896 . . . . 0.0 112.459 176.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.96 -20.64 38.0 Favored Glycine 0 C--O 1.244 0.72 0 N-CA-C 111.592 -0.603 . . . . 0.0 111.592 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 65.1 mt -88.79 117.67 32.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 61.7 m -107.25 129.15 54.91 Favored 'General case' 0 C--N 1.289 -2.03 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.715 179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -131.47 169.95 15.37 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.632 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -104.64 129.04 52.83 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 -178.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.436 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 24.4 mmm180 -127.28 142.11 51.55 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 120.683 0.277 . . . . 0.0 110.604 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.1 m -112.98 111.36 22.05 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.272 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -107.8 113.87 27.42 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 176.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.301 0 N-CA-C 108.628 -1.789 . . . . 0.0 108.628 -173.558 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.5 pttt . . . . . 0 N--CA 1.447 -0.577 0 CA-C-O 121.54 0.686 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.9 t90 -104.22 110.72 23.04 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.691 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 56.1 m -109.04 126.99 53.72 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -177.546 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -138.86 160.9 38.59 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.992 -175.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -77.35 130.21 36.84 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.232 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 32.4 t -125.68 121.78 60.78 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.754 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.3 m -109.02 118.75 37.61 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -125.47 105.12 8.82 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.194 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.7 mtm180 63.82 28.09 14.66 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 124.479 1.111 . . . . 0.0 111.877 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.43 -28.64 10.56 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.199 178.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.0 mt -86.69 113.63 24.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -178.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 62.3 m -100.54 124.17 45.73 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.321 0.581 . . . . 0.0 110.098 178.332 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 18.0 p90 -128.69 163.97 23.95 Favored 'General case' 0 C--N 1.281 -2.383 0 CA-C-N 115.197 -0.911 . . . . 0.0 108.712 178.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -101.62 128.6 47.82 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 25.9 mmm180 -118.3 132.63 56.28 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 120.866 0.365 . . . . 0.0 111.201 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 97.2 m -99.96 110.06 22.4 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.39 175.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -102.67 95.51 6.26 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.277 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -174.637 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt . . . . . 0 N--CA 1.445 -0.7 0 CA-C-O 120.995 0.426 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.0 t90 -82.87 119.67 24.68 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.909 -178.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 64.0 m -109.43 131.1 55.38 Favored 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.906 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -138.31 151.8 47.91 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 124.162 0.985 . . . . 0.0 108.819 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -97.26 136.29 37.97 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -177.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.556 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 40.7 t -125.12 135.56 63.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -175.598 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -109.6 117.45 33.97 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 172.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -129.22 110.14 11.72 Favored 'General case' 0 N--CA 1.418 -2.062 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 -174.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 69.23 16.82 8.43 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.174 0.989 . . . . 0.0 111.37 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.43 -3.27 61.35 Favored Glycine 0 N--CA 1.441 -0.993 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 -178.326 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.1 mt -98.5 114.83 37.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 28.6 m -104.65 133.45 49.47 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 120.041 -0.664 . . . . 0.0 110.283 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -143.65 158.66 43.5 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.537 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.4 ttp180 -99.38 128.23 45.48 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 3.6 mmp_? -115.88 141.39 48.16 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 86.2 m -117.21 110.79 18.58 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 29.5 ttt180 -96.83 95.88 8.17 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.695 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -175.361 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.4 pttm . . . . . 0 N--CA 1.444 -0.728 0 CA-C-O 121.743 0.782 . . . . 0.0 109.842 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -91.4 108.97 20.26 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.615 177.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 74.3 m -110.46 119.62 39.77 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 10.6 p90 -129.7 160.12 34.35 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.988 -172.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -85.6 128.17 34.68 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.078 -0.964 . . . . 0.0 108.862 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.49 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 14.5 t -123.53 116.8 49.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 11' ' ' ILE . 79.4 m -109.54 120.72 43.35 Favored 'General case' 0 C--N 1.289 -2.044 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.214 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -122.93 102.35 7.96 Favored 'General case' 0 N--CA 1.417 -2.092 0 N-CA-C 107.205 -1.405 . . . . 0.0 107.205 -176.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 65.04 22.18 12.36 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.29 1.036 . . . . 0.0 111.929 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.57 -20.94 26.8 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 121.054 -0.594 . . . . 0.0 111.793 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 50.0 mt -82.56 112.86 20.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.7 m -105.31 121.06 43.09 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 121.583 0.706 . . . . 0.0 110.598 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -126.85 150.72 49.09 Favored 'General case' 0 C--N 1.281 -2.372 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.701 177.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.3 ttm180 -100.53 125.97 46.92 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 26.8 mmm180 -119.97 153.42 35.99 Favored 'General case' 0 C--N 1.298 -1.643 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.568 -179.22 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.9 m -125.54 115.2 19.82 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 121.47 0.652 . . . . 0.0 110.985 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 73.2 ttt180 -107.49 99.4 8.91 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -0.853 0 N-CA-C 107.465 -2.254 . . . . 0.0 107.465 -172.18 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt . . . . . 0 CA--C 1.506 -0.729 0 CA-C-O 121.372 0.606 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 22.8 t90 -88.16 124.24 33.62 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.295 -178.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 66.8 m -109.63 124.76 51.72 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.217 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -138.95 160.69 39.16 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.087 0.47 . . . . 0.0 111.874 -176.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -81.05 125.51 30.28 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.389 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.495 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 26.1 t -113.41 117.42 55.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -109.94 114.69 28.44 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-O 121.524 0.678 . . . . 0.0 109.827 178.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -114.9 99.74 7.7 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.678 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.8 mtm180 55.85 38.63 30.26 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.142 -0.936 . . . . 0.0 112.757 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.2 -15.4 62.44 Favored Glycine 0 N--CA 1.439 -1.13 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.91 177.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.7 mt -90.6 109.86 21.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 54.4 m -107.13 135.2 49.08 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 121.323 0.583 . . . . 0.0 111.239 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -141.48 151.03 42.98 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.241 176.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.457 ' HD3' ' HB3' ' A' ' 3' ' ' CYS . 3.5 tmm_? -97.92 124.0 42.15 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -178.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -123.32 146.48 47.87 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.145 -177.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 71.4 m -106.94 112.9 26.07 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.298 176.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -100.5 93.41 5.61 Favored 'General case' 0 N--CA 1.424 -1.766 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.086 0 N-CA-C 109.799 -1.32 . . . . 0.0 109.799 -175.52 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.0 mttm . . . . . 0 CA--C 1.512 -0.508 0 CA-C-O 121.269 0.556 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -105.73 128.81 53.91 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.448 -175.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 71.8 m -109.29 129.01 55.52 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 174.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.7 p90 -126.3 156.22 40.74 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-O 121.506 0.67 . . . . 0.0 111.417 -175.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 46.9 ttt180 -89.46 124.16 34.24 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 114.352 -1.294 . . . . 0.0 108.856 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.48 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 15.5 t -111.21 116.07 51.54 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.113 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.6 m -109.23 120.16 41.68 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 120.161 -0.615 . . . . 0.0 110.082 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -124.18 101.94 7.46 Favored 'General case' 0 N--CA 1.411 -2.397 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 65.44 32.99 9.16 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 125.021 1.329 . . . . 0.0 111.707 176.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.33 -21.85 42.54 Favored Glycine 0 C--N 1.316 -0.559 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.948 179.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.3 mt -87.8 115.75 28.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.9 m -109.44 130.28 55.51 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.687 -178.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -128.32 146.23 50.82 Favored 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.448 177.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -89.65 130.54 35.92 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -128.89 145.3 51.25 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 74.5 m -117.33 124.31 48.65 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 121.106 0.479 . . . . 0.0 110.831 -177.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.416 ' HA ' ' HD2' ' A' ' 17' ' ' ARG . 30.6 tpt180 -121.39 103.58 9.06 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.422 -2.265 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 -177.556 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp . . . . . 0 CA--C 1.505 -0.775 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 31.1 t90 -68.17 112.63 5.21 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 114.145 -1.389 . . . . 0.0 111.38 -177.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.9 m -108.81 125.14 51.64 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.049 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -131.47 159.08 39.13 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.143 -174.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -83.53 127.94 34.13 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.629 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.2 t -118.67 122.94 70.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 97.0 m -109.81 118.31 36.16 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-O 121.161 0.505 . . . . 0.0 109.665 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -131.17 109.35 10.37 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.281 -176.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 63.24 21.16 12.68 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.108 1.363 . . . . 0.0 111.871 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.33 -26.25 15.52 Favored Glycine 0 N--CA 1.437 -1.289 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.5 mt -83.4 112.78 21.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -179.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 61.7 m -104.74 125.26 50.64 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-O 121.238 0.542 . . . . 0.0 109.657 178.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -131.59 170.43 14.76 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.213 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 14' ' ' ARG . 8.4 mpt_? -106.66 132.57 52.5 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.449 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 5.3 mmp_? -123.7 154.78 38.94 Favored 'General case' 0 C--N 1.287 -2.13 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.5 m -127.01 111.32 13.93 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-O 121.136 0.494 . . . . 0.0 110.831 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -96.07 88.06 4.74 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.088 0 N-CA-C 108.945 -1.662 . . . . 0.0 108.945 -173.301 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt . . . . . 0 N--CA 1.442 -0.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.6 t90 -108.9 124.07 50.08 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.559 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.501 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.7 m -109.72 132.15 54.41 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 177.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -129.78 158.73 38.62 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 121.584 0.707 . . . . 0.0 111.817 -175.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -92.27 129.26 38.27 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.173 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.514 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.7 t -117.13 121.21 67.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.3 m -109.67 122.24 47.02 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 121.219 0.533 . . . . 0.0 110.344 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -128.78 105.06 7.99 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 115.467 -0.788 . . . . 0.0 108.912 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 62.79 23.64 14.09 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 124.583 1.153 . . . . 0.0 112.749 176.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.38 -16.39 38.06 Favored Glycine 0 C--N 1.311 -0.85 0 C-N-CA 121.021 -0.609 . . . . 0.0 111.618 -178.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.9 mt -91.39 109.7 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.4 m -107.1 129.87 54.77 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -131.62 159.25 38.81 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.708 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -101.85 126.67 48.79 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.49 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.7 mmp_? -128.07 155.0 45.06 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.501 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 74.1 m -119.93 145.03 47.11 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.063 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -130.89 99.86 5.06 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.837 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -177.516 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.3 pttt . . . . . 0 N--CA 1.449 -0.524 0 CA-C-O 121.03 0.443 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.7 t90 -75.78 121.04 21.99 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.866 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 73.8 m -109.45 135.0 51.18 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.482 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -137.25 160.2 39.71 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 121.312 0.577 . . . . 0.0 111.852 -174.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -82.14 130.01 34.97 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.513 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.412 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 27.9 t -125.63 136.01 62.16 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 177.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 85.1 m -120.46 119.8 34.06 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.201 0.525 . . . . 0.0 110.046 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -111.27 101.76 10.22 Favored 'General case' 0 N--CA 1.422 -1.832 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 -177.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 63.79 22.32 13.01 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 124.446 1.099 . . . . 0.0 111.482 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.12 -25.02 17.2 Favored Glycine 0 N--CA 1.441 -0.979 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.894 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 65.5 mt -81.62 113.27 20.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 39.5 m -100.03 142.99 30.77 Favored 'General case' 0 C--N 1.302 -1.474 0 C-N-CA 120.081 -0.648 . . . . 0.0 111.282 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -145.56 170.61 16.08 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 124.043 0.937 . . . . 0.0 110.174 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -99.12 124.7 44.34 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.0 mmm180 -128.32 159.97 33.65 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 34.5 m -132.94 150.63 52.14 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 120.136 -0.625 . . . . 0.0 110.671 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -125.71 94.12 4.04 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.262 0 N-CA-C 110.244 -1.142 . . . . 0.0 110.244 -176.954 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt . . . . . 0 C--O 1.242 0.687 0 CA-C-O 121.961 0.886 . . . . 0.0 108.648 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -82.61 121.23 26.56 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.441 -173.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 79.3 m -118.9 133.06 56.08 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 175.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -133.38 160.65 36.74 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.599 -172.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -88.93 129.6 35.59 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.998 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 41.1 t -124.61 124.71 68.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.8 m -111.39 124.67 52.73 Favored 'General case' 0 C--N 1.288 -2.072 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -132.1 108.22 9.16 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.9 mtm180 65.52 19.93 11.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.64 1.176 . . . . 0.0 112.471 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.35 -20.76 29.85 Favored Glycine 0 C--N 1.307 -1.051 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.871 -179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -88.58 114.98 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.294 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 60.1 m -104.7 126.79 52.12 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.167 0.508 . . . . 0.0 110.179 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 10.6 p90 -125.56 159.6 31.67 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.204 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -95.53 121.87 37.68 Favored 'General case' 0 N--CA 1.425 -1.676 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -178.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.409 ' HA ' ' HE ' ' A' ' 15' ' ' ARG . 1.4 mmp_? -111.03 145.71 38.0 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.1 m -124.18 132.7 53.64 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 121.625 0.726 . . . . 0.0 111.269 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -126.02 75.71 1.53 Allowed 'General case' 0 N--CA 1.418 -2.027 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.679 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.032 -177.969 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 93.8 mttt . . . . . 0 CA--C 1.507 -0.684 0 CA-C-O 121.733 0.778 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.7 t90 -109.61 118.53 36.81 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.849 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.8 m -109.66 119.57 39.8 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.594 0.711 . . . . 0.0 109.7 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -126.18 160.24 30.77 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.665 -174.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -95.46 133.64 39.21 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.522 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 21.5 t -123.5 122.61 65.47 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 92.2 m -109.03 116.01 31.17 Favored 'General case' 0 C--N 1.288 -2.088 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -129.52 110.33 11.76 Favored 'General case' 0 N--CA 1.419 -1.995 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -176.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 64.78 22.23 12.51 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 124.099 0.959 . . . . 0.0 112.661 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.06 -22.49 33.15 Favored Glycine 0 CA--C 1.506 -0.502 0 N-CA-C 111.493 -0.643 . . . . 0.0 111.493 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 62.7 mt -87.78 114.9 27.29 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.5 m -104.59 130.48 52.57 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-O 121.182 0.515 . . . . 0.0 109.735 179.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -134.68 160.97 36.46 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.187 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -102.55 125.79 49.39 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.243 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.525 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.8 mmp_? -120.75 146.91 45.99 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 176.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.0 m -118.14 115.15 24.22 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 49.7 ttt180 -106.81 95.04 5.45 Favored 'General case' 0 N--CA 1.428 -1.571 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.923 0 N-CA-C 109.128 -1.589 . . . . 0.0 109.128 -175.222 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 64.1 pttt . . . . . 0 N--CA 1.449 -0.521 0 CA-C-O 120.876 0.37 . . . . 0.0 111.602 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -120.01 135.45 54.92 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.316 -176.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.7 m -116.94 123.42 46.91 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.094 178.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -123.86 159.4 29.69 Favored 'General case' 0 C--N 1.297 -1.706 0 C-N-CA 123.664 0.785 . . . . 0.0 110.252 -175.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.4 ttt180 -105.99 134.1 49.65 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.512 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 58.5 t -121.47 131.35 73.28 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.853 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -177.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 70.9 m -109.63 124.8 51.79 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 175.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -146.06 124.31 12.25 Favored 'General case' 0 N--CA 1.416 -2.152 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -177.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.2 mtm180 64.96 16.33 10.49 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.175 0.99 . . . . 0.0 112.466 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.73 -7.47 59.33 Favored Glycine 0 N--CA 1.436 -1.3 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 56.8 mt -102.2 125.14 56.45 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.112 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 47.7 m -108.69 134.66 51.11 Favored 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 176.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 p90 -137.42 149.21 46.73 Favored 'General case' 0 C--N 1.289 -2.034 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.144 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -91.52 118.5 30.64 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -118.97 158.22 26.19 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.6 m -131.88 150.48 52.14 Favored 'General case' 0 C--N 1.294 -1.825 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.026 -177.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -142.92 99.13 3.4 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.351 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.327 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.8 pttt . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.901 0.381 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.1 t90 -100.66 121.93 42.47 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.974 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 75.1 m -112.56 139.93 47.74 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.783 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -136.88 154.61 50.44 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.354 -174.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -97.09 129.62 44.48 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 123.824 0.85 . . . . 0.0 109.345 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.473 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 46.7 t -122.45 128.53 75.43 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.332 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 178.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 71.3 m -109.69 111.88 23.61 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.714 0.768 . . . . 0.0 111.057 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -108.17 96.31 6.28 Favored 'General case' 0 N--CA 1.423 -1.789 0 CA-C-N 114.482 -1.236 . . . . 0.0 108.798 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 57.31 32.3 21.54 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 124.511 1.124 . . . . 0.0 112.895 176.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.22 -23.5 20.65 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 121.066 -0.588 . . . . 0.0 111.824 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 60.5 mt -88.66 109.38 19.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 59.7 m -101.3 121.05 41.2 Favored 'General case' 0 C--N 1.283 -2.296 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.406 ' CE1' ' HB ' ' A' ' 6' ' ' VAL . 17.5 p90 -119.78 155.26 32.88 Favored 'General case' 0 C--N 1.277 -2.58 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.029 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -102.44 122.16 43.75 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 -177.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.9 mmm180 -117.44 156.06 28.59 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 78.6 m -128.82 139.15 52.31 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -178.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -130.31 94.5 3.69 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.859 0 N-CA-C 108.879 -1.689 . . . . 0.0 108.879 -174.05 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.8 mttm . . . . . 0 C--O 1.238 0.467 0 CA-C-O 122.103 0.954 . . . . 0.0 108.953 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.0 t90 -88.51 109.88 20.42 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 113.858 -1.519 . . . . 0.0 110.806 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 80.2 m -113.08 119.2 37.03 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.281 0.562 . . . . 0.0 110.033 178.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.7 p90 -118.43 150.59 39.3 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.365 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -87.64 123.46 32.52 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.624 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.466 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 60.4 t -112.99 125.69 70.28 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.7 m -109.27 119.46 39.55 Favored 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -134.21 113.2 11.76 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 63.5 29.43 15.38 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 124.302 1.041 . . . . 0.0 111.738 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.02 -28.14 15.92 Favored Glycine 0 N--CA 1.435 -1.37 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.641 177.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 40.0 mm -86.71 129.16 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.57 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.7 m -111.99 135.47 52.6 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.056 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.8 p90 -134.24 145.05 48.78 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.053 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.5 tpp180 -85.2 108.19 17.61 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.192 -179.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -98.64 129.11 45.13 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 86.1 m -105.15 126.39 52.02 Favored 'General case' 0 C--N 1.282 -2.367 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.075 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -125.41 83.68 2.19 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.719 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -175.64 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.0 pttp . . . . . 0 C--O 1.237 0.404 0 CA-C-O 120.937 0.398 . . . . 0.0 111.413 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.0 t90 -110.19 114.74 28.48 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-O 121.085 0.469 . . . . 0.0 112.132 -175.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 74.2 m -108.61 128.14 54.58 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -140.29 153.14 46.37 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.849 -174.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.7 ttt180 -91.64 128.08 37.33 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.534 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 20.6 t -117.63 121.3 67.17 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.611 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 94.3 m -108.55 116.46 32.01 Favored 'General case' 0 C--N 1.281 -2.388 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 177.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -125.89 104.78 8.5 Favored 'General case' 0 N--CA 1.418 -2.033 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 -177.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 66.08 27.29 10.59 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.281 1.433 . . . . 0.0 111.264 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.78 -25.51 27.23 Favored Glycine 0 N--CA 1.44 -1.068 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.129 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.6 mt -82.66 111.92 19.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.1 m -104.39 129.62 52.32 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.105 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -130.83 147.4 52.48 Favored 'General case' 0 C--N 1.287 -2.122 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.682 178.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -95.24 116.18 28.41 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -178.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.421 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 23.8 mmt180 -105.53 157.15 17.58 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.875 -0.416 . . . . 0.0 109.875 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 97.2 m -134.18 109.26 8.77 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 176.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -99.26 89.45 4.22 Favored 'General case' 0 N--CA 1.415 -2.221 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 178.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.056 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 -177.235 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 59.4 pttt . . . . . 0 C--O 1.235 0.339 0 CA-C-O 121.356 0.598 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.0 t90 -106.25 131.04 53.95 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.597 178.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 96.5 m -121.55 139.25 53.75 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.154 0.502 . . . . 0.0 110.025 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -137.84 158.84 43.52 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.596 0.712 . . . . 0.0 112.127 -172.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -91.86 132.63 36.32 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.86 -1.063 . . . . 0.0 108.749 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 21.0 t -123.92 124.22 68.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.88 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.7 m -111.17 121.47 45.38 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 175.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -131.35 110.74 11.28 Favored 'General case' 0 N--CA 1.419 -1.985 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -176.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.8 mtm180 65.04 23.4 12.48 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 124.066 0.946 . . . . 0.0 112.199 178.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.03 -27.29 12.06 Favored Glycine 0 N--CA 1.438 -1.201 0 C-N-CA 120.959 -0.638 . . . . 0.0 113.02 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.1 mt -91.64 129.69 41.94 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.7 m -110.67 136.19 50.14 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.073 0.463 . . . . 0.0 109.956 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CE2' ' HB ' ' A' ' 6' ' ' VAL . 16.8 p90 -139.26 161.13 38.17 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.872 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -98.37 129.41 45.03 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -178.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.6 mmt-85 -129.92 160.11 34.59 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 85.2 m -132.12 156.71 45.88 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 121.486 0.66 . . . . 0.0 111.533 -177.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -135.21 92.2 2.83 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 106.93 -1.507 . . . . 0.0 106.93 175.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.558 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.57 -179.511 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt . . . . . 0 N--CA 1.446 -0.645 0 CA-C-O 121.476 0.655 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 32.1 t90 -102.1 115.74 31.19 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.397 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.3 m -109.89 123.1 49.0 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.657 0.741 . . . . 0.0 110.611 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -122.46 149.48 43.81 Favored 'General case' 0 C--N 1.285 -2.199 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.474 -173.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' A' ' 5' ' ' ARG . 36.2 ttt180 -89.54 127.78 35.92 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.603 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 39.3 t -116.22 127.97 73.66 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.833 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -176.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 90.0 m -109.7 116.66 32.11 Favored 'General case' 0 C--N 1.29 -1.979 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -128.97 108.88 10.76 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 115.05 -0.977 . . . . 0.0 108.857 -176.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.8 mtp180 59.11 29.74 19.36 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 123.938 0.895 . . . . 0.0 112.195 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.34 -19.98 48.84 Favored Glycine 0 N--CA 1.435 -1.407 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.422 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.0 mt -89.4 115.86 29.83 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.603 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 56.4 m -106.06 122.97 47.25 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 177.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -128.98 161.92 28.8 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.255 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -99.17 124.31 44.12 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -178.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -119.36 152.0 37.53 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 75.3 m -127.2 132.04 50.53 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-O 120.953 0.406 . . . . 0.0 111.226 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -122.44 100.19 6.81 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 175.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.874 0 N-CA-C 109.079 -1.608 . . . . 0.0 109.079 -174.64 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 61.4 pttt . . . . . 0 C--O 1.244 0.799 0 CA-C-O 121.898 0.856 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -114.82 113.16 23.86 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.713 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.9 m -108.89 134.56 51.41 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.691 179.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.2 p90 -140.33 160.0 40.94 Favored 'General case' 0 C--N 1.287 -2.145 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.524 -176.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -107.51 130.63 54.84 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 51.7 t -125.78 132.2 71.05 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.1 m -112.15 116.7 30.91 Favored 'General case' 0 N--CA 1.422 -1.875 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 176.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -111.7 102.37 10.68 Favored 'General case' 0 N--CA 1.408 -2.566 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 -177.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 68.09 18.9 9.36 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.54 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.29 -20.82 25.26 Favored Glycine 0 C--N 1.309 -0.93 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.058 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 76.7 mt -84.1 116.37 27.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 30.9 m -106.69 123.36 48.01 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.109 -176.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.403 ' HD2' ' HG2' ' A' ' 15' ' ' ARG . 5.9 p90 -119.35 154.47 33.53 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.999 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -93.54 111.58 23.28 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.485 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.403 ' HG2' ' HD2' ' A' ' 13' ' ' TYR . 27.4 mmm180 -106.71 138.31 43.12 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.002 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 98.5 m -135.06 109.7 8.57 Favored 'General case' 0 C--N 1.286 -2.186 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.661 179.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.8 101.48 10.35 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 178.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.415 -2.727 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -176.642 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 pttp . . . . . 0 N--CA 1.45 -0.466 0 CA-C-O 120.648 0.261 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -94.15 124.15 37.98 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 121.01 0.433 . . . . 0.0 110.967 -177.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 64.2 m -117.75 118.96 33.49 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.432 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -118.15 158.27 25.38 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.785 -178.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 5' ' ' ARG . 34.2 ttt180 -98.82 130.88 45.27 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.369 -175.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.7 t -126.12 126.49 69.65 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.0 m -109.58 118.92 37.85 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -123.18 105.82 10.22 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 63.27 25.3 14.67 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 123.808 0.843 . . . . 0.0 110.955 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.99 -17.24 57.49 Favored Glycine 0 N--CA 1.439 -1.161 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.928 -179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 71.3 mt -79.56 109.48 14.22 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.519 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 55.9 m -105.97 120.25 41.29 Favored 'General case' 0 C--N 1.285 -2.217 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.137 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.432 ' CE2' ' HB ' ' A' ' 6' ' ' VAL . 19.5 p90 -120.29 160.21 23.44 Favored 'General case' 0 C--N 1.281 -2.399 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.309 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -106.91 115.3 29.94 Favored 'General case' 0 C--N 1.291 -1.946 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.478 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 22.4 mmm180 -100.04 124.46 45.43 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 120.933 0.397 . . . . 0.0 110.225 178.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 93.9 m -105.65 113.62 27.29 Favored 'General case' 0 C--N 1.278 -2.527 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.433 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -113.24 102.64 10.55 Favored 'General case' 0 N--CA 1.416 -2.146 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.717 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -175.287 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 65.8 mttm . . . . . 0 CA--C 1.51 -0.561 0 CA-C-O 122.231 1.015 . . . . 0.0 109.657 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -114.19 110.02 19.32 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.421 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.0 m -109.6 145.6 36.14 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 175.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.6 p90 -140.22 156.05 46.65 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.163 0.506 . . . . 0.0 111.661 -175.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -100.91 130.66 46.95 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.502 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 60.8 t -129.28 124.09 59.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 87.9 m -108.68 116.57 32.22 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -120.58 100.2 6.99 Favored 'General case' 0 N--CA 1.418 -2.071 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -176.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.2 mtm180 57.91 34.23 24.1 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.779 1.232 . . . . 0.0 113.106 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.26 -20.08 31.05 Favored Glycine 0 N--CA 1.44 -1.058 0 C-N-CA 121.054 -0.593 . . . . 0.0 112.892 177.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 55.2 mt -97.4 113.08 30.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 55.7 m -102.6 128.04 49.44 Favored 'General case' 0 C--N 1.293 -1.88 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -126.24 148.63 49.44 Favored 'General case' 0 C--N 1.284 -2.25 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.697 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -92.82 115.41 28.09 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.481 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.6 mmp_? -114.34 148.07 38.16 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 94.3 m -128.73 142.18 51.09 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-O 121.046 0.451 . . . . 0.0 111.332 -179.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -134.53 94.65 3.23 Favored 'General case' 0 N--CA 1.417 -2.078 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 174.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.471 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.259 -179.636 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.5 pttm . . . . . 0 N--CA 1.44 -0.968 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.2 t90 -95.88 117.64 30.98 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 121.338 0.589 . . . . 0.0 110.741 -177.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 67.1 m -108.96 120.43 42.5 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -135.35 161.25 35.95 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.795 -174.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.0 ttt180 -75.66 125.98 30.11 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.265 177.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 58.8 t -116.16 123.41 71.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.785 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 178.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.4 m -110.71 125.19 53.23 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 121.384 0.611 . . . . 0.0 110.239 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -130.89 104.71 7.3 Favored 'General case' 0 N--CA 1.42 -1.94 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.992 -177.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 62.71 26.78 15.81 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.941 0.896 . . . . 0.0 112.459 176.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.96 -20.64 38.0 Favored Glycine 0 C--O 1.244 0.72 0 N-CA-C 111.592 -0.603 . . . . 0.0 111.592 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 65.1 mt -88.79 117.67 32.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 61.7 m -107.25 129.15 54.91 Favored 'General case' 0 C--N 1.289 -2.03 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.715 179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -131.47 169.95 15.37 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.632 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -104.64 129.04 52.83 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 -178.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.436 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 24.4 mmm180 -127.28 142.11 51.55 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 120.683 0.277 . . . . 0.0 110.604 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.1 m -112.98 111.36 22.05 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.272 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -107.8 113.87 27.42 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 176.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.301 0 N-CA-C 108.628 -1.789 . . . . 0.0 108.628 -173.558 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.5 pttt . . . . . 0 N--CA 1.447 -0.577 0 CA-C-O 121.54 0.686 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.9 t90 -104.22 110.72 23.04 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.691 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 56.1 m -109.04 126.99 53.72 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -177.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -138.86 160.9 38.59 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.992 -175.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -77.35 130.21 36.84 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.232 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 32.4 t -125.68 121.78 60.78 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.754 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.3 m -109.02 118.75 37.61 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -125.47 105.12 8.82 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.194 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.7 mtm180 63.82 28.09 14.66 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 124.479 1.111 . . . . 0.0 111.877 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.43 -28.64 10.56 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.199 178.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.0 mt -86.69 113.63 24.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -178.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 62.3 m -100.54 124.17 45.73 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.321 0.581 . . . . 0.0 110.098 178.332 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 18.0 p90 -128.69 163.97 23.95 Favored 'General case' 0 C--N 1.281 -2.383 0 CA-C-N 115.197 -0.911 . . . . 0.0 108.712 178.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -101.62 128.6 47.82 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 25.9 mmm180 -118.3 132.63 56.28 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 120.866 0.365 . . . . 0.0 111.201 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 97.2 m -99.96 110.06 22.4 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.39 175.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -102.67 95.51 6.26 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.277 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -174.637 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt . . . . . 0 N--CA 1.445 -0.7 0 CA-C-O 120.995 0.426 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.0 t90 -82.87 119.67 24.68 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.909 -178.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 64.0 m -109.43 131.1 55.38 Favored 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.906 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -138.31 151.8 47.91 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 124.162 0.985 . . . . 0.0 108.819 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -97.26 136.29 37.97 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -177.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.556 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 40.7 t -125.12 135.56 63.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -175.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -109.6 117.45 33.97 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 172.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -129.22 110.14 11.72 Favored 'General case' 0 N--CA 1.418 -2.062 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 -174.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 69.23 16.82 8.43 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.174 0.989 . . . . 0.0 111.37 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.43 -3.27 61.35 Favored Glycine 0 N--CA 1.441 -0.993 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 -178.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.1 mt -98.5 114.83 37.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 28.6 m -104.65 133.45 49.47 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 120.041 -0.664 . . . . 0.0 110.283 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -143.65 158.66 43.5 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.537 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.4 ttp180 -99.38 128.23 45.48 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.418 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 3.6 mmp_? -115.88 141.39 48.16 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 86.2 m -117.21 110.79 18.58 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 29.5 ttt180 -96.83 95.88 8.17 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.695 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -175.361 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.4 pttm . . . . . 0 N--CA 1.444 -0.728 0 CA-C-O 121.743 0.782 . . . . 0.0 109.842 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -91.4 108.97 20.26 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.615 177.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 74.3 m -110.46 119.62 39.77 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 10.6 p90 -129.7 160.12 34.35 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.988 -172.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -85.6 128.17 34.68 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.078 -0.964 . . . . 0.0 108.862 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.49 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 14.5 t -123.53 116.8 49.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 11' ' ' ILE . 79.4 m -109.54 120.72 43.35 Favored 'General case' 0 C--N 1.289 -2.044 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.214 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -122.93 102.35 7.96 Favored 'General case' 0 N--CA 1.417 -2.092 0 N-CA-C 107.205 -1.405 . . . . 0.0 107.205 -176.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 65.04 22.18 12.36 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.29 1.036 . . . . 0.0 111.929 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.57 -20.94 26.8 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 121.054 -0.594 . . . . 0.0 111.793 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 50.0 mt -82.56 112.86 20.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.7 m -105.31 121.06 43.09 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 121.583 0.706 . . . . 0.0 110.598 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -126.85 150.72 49.09 Favored 'General case' 0 C--N 1.281 -2.372 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.701 177.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.3 ttm180 -100.53 125.97 46.92 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 26.8 mmm180 -119.97 153.42 35.99 Favored 'General case' 0 C--N 1.298 -1.643 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.568 -179.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.9 m -125.54 115.2 19.82 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 121.47 0.652 . . . . 0.0 110.985 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 73.2 ttt180 -107.49 99.4 8.91 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -0.853 0 N-CA-C 107.465 -2.254 . . . . 0.0 107.465 -172.18 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt . . . . . 0 CA--C 1.506 -0.729 0 CA-C-O 121.372 0.606 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 22.8 t90 -88.16 124.24 33.62 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.295 -178.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 66.8 m -109.63 124.76 51.72 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.217 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -138.95 160.69 39.16 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.087 0.47 . . . . 0.0 111.874 -176.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 -81.05 125.51 30.28 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.389 178.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.495 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 26.1 t -113.41 117.42 55.36 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.628 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -109.94 114.69 28.44 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-O 121.524 0.678 . . . . 0.0 109.827 178.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -114.9 99.74 7.7 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.678 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.8 mtm180 55.85 38.63 30.26 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.142 -0.936 . . . . 0.0 112.757 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.2 -15.4 62.44 Favored Glycine 0 N--CA 1.439 -1.13 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.91 177.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.7 mt -90.6 109.86 21.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 54.4 m -107.13 135.2 49.08 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 121.323 0.583 . . . . 0.0 111.239 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -141.48 151.03 42.98 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.241 176.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.457 ' HD3' ' HB3' ' A' ' 3' ' ' CYS . 3.5 tmm_? -97.92 124.0 42.15 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -178.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -123.32 146.48 47.87 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.145 -177.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 71.4 m -106.94 112.9 26.07 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.298 176.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -100.5 93.41 5.61 Favored 'General case' 0 N--CA 1.424 -1.766 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.086 0 N-CA-C 109.799 -1.32 . . . . 0.0 109.799 -175.52 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.0 mttm . . . . . 0 CA--C 1.512 -0.508 0 CA-C-O 121.269 0.556 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -105.73 128.81 53.91 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.448 -175.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 71.8 m -109.29 129.01 55.52 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 174.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.7 p90 -126.3 156.22 40.74 Favored 'General case' 0 C--N 1.288 -2.092 0 CA-C-O 121.506 0.67 . . . . 0.0 111.417 -175.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 46.9 ttt180 -89.46 124.16 34.24 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 114.352 -1.294 . . . . 0.0 108.856 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.48 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 15.5 t -111.21 116.07 51.54 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.113 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.6 m -109.23 120.16 41.68 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 120.161 -0.615 . . . . 0.0 110.082 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -124.18 101.94 7.46 Favored 'General case' 0 N--CA 1.411 -2.397 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 65.44 32.99 9.16 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 125.021 1.329 . . . . 0.0 111.707 176.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.33 -21.85 42.54 Favored Glycine 0 C--N 1.316 -0.559 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.948 179.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.3 mt -87.8 115.75 28.71 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.9 m -109.44 130.28 55.51 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.687 -178.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -128.32 146.23 50.82 Favored 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.448 177.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -89.65 130.54 35.92 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -128.89 145.3 51.25 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 74.5 m -117.33 124.31 48.65 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 121.106 0.479 . . . . 0.0 110.831 -177.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.416 ' HA ' ' HD2' ' A' ' 17' ' ' ARG . 30.6 tpt180 -121.39 103.58 9.06 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.422 -2.265 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 -177.556 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp . . . . . 0 CA--C 1.505 -0.775 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 31.1 t90 -68.17 112.63 5.21 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 114.145 -1.389 . . . . 0.0 111.38 -177.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.9 m -108.81 125.14 51.64 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.049 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -131.47 159.08 39.13 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.143 -174.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -83.53 127.94 34.13 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.629 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.2 t -118.67 122.94 70.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 97.0 m -109.81 118.31 36.16 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-O 121.161 0.505 . . . . 0.0 109.665 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -131.17 109.35 10.37 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.281 -176.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 63.24 21.16 12.68 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.108 1.363 . . . . 0.0 111.871 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.33 -26.25 15.52 Favored Glycine 0 N--CA 1.437 -1.289 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.5 mt -83.4 112.78 21.45 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -179.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 61.7 m -104.74 125.26 50.64 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-O 121.238 0.542 . . . . 0.0 109.657 178.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -131.59 170.43 14.76 Favored 'General case' 0 C--N 1.289 -2.022 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.213 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 14' ' ' ARG . 8.4 mpt_? -106.66 132.57 52.5 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.449 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 5.3 mmp_? -123.7 154.78 38.94 Favored 'General case' 0 C--N 1.287 -2.13 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.5 m -127.01 111.32 13.93 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-O 121.136 0.494 . . . . 0.0 110.831 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -96.07 88.06 4.74 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.088 0 N-CA-C 108.945 -1.662 . . . . 0.0 108.945 -173.301 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt . . . . . 0 N--CA 1.442 -0.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.6 t90 -108.9 124.07 50.08 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.559 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.501 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 76.7 m -109.72 132.15 54.41 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 177.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -129.78 158.73 38.62 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 121.584 0.707 . . . . 0.0 111.817 -175.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -92.27 129.26 38.27 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.173 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.514 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.7 t -117.13 121.21 67.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 91.3 m -109.67 122.24 47.02 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-O 121.219 0.533 . . . . 0.0 110.344 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -128.78 105.06 7.99 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 115.467 -0.788 . . . . 0.0 108.912 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 62.79 23.64 14.09 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 124.583 1.153 . . . . 0.0 112.749 176.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.38 -16.39 38.06 Favored Glycine 0 C--N 1.311 -0.85 0 C-N-CA 121.021 -0.609 . . . . 0.0 111.618 -178.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 70.9 mt -91.39 109.7 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.4 m -107.1 129.87 54.77 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -131.62 159.25 38.81 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.708 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -101.85 126.67 48.79 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.49 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.7 mmp_? -128.07 155.0 45.06 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.501 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 74.1 m -119.93 145.03 47.11 Favored 'General case' 0 C--N 1.299 -1.588 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.063 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -130.89 99.86 5.06 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.837 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -177.516 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.3 pttt . . . . . 0 N--CA 1.449 -0.524 0 CA-C-O 121.03 0.443 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.7 t90 -75.78 121.04 21.99 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.866 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 73.8 m -109.45 135.0 51.18 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.482 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -137.25 160.2 39.71 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-O 121.312 0.577 . . . . 0.0 111.852 -174.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -82.14 130.01 34.97 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.513 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.412 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 27.9 t -125.63 136.01 62.16 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 177.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 85.1 m -120.46 119.8 34.06 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.201 0.525 . . . . 0.0 110.046 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -111.27 101.76 10.22 Favored 'General case' 0 N--CA 1.422 -1.832 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 -177.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 63.79 22.32 13.01 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 124.446 1.099 . . . . 0.0 111.482 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.12 -25.02 17.2 Favored Glycine 0 N--CA 1.441 -0.979 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.894 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 65.5 mt -81.62 113.27 20.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 39.5 m -100.03 142.99 30.77 Favored 'General case' 0 C--N 1.302 -1.474 0 C-N-CA 120.081 -0.648 . . . . 0.0 111.282 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -145.56 170.61 16.08 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 124.043 0.937 . . . . 0.0 110.174 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -99.12 124.7 44.34 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.0 mmm180 -128.32 159.97 33.65 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 34.5 m -132.94 150.63 52.14 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 120.136 -0.625 . . . . 0.0 110.671 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -125.71 94.12 4.04 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.262 0 N-CA-C 110.244 -1.142 . . . . 0.0 110.244 -176.954 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt . . . . . 0 C--O 1.242 0.687 0 CA-C-O 121.961 0.886 . . . . 0.0 108.648 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -82.61 121.23 26.56 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.441 -173.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 79.3 m -118.9 133.06 56.08 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 175.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -133.38 160.65 36.74 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.599 -172.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -88.93 129.6 35.59 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.998 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 41.1 t -124.61 124.71 68.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 73.8 m -111.39 124.67 52.73 Favored 'General case' 0 C--N 1.288 -2.072 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -132.1 108.22 9.16 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.9 mtm180 65.52 19.93 11.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.64 1.176 . . . . 0.0 112.471 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.35 -20.76 29.85 Favored Glycine 0 C--N 1.307 -1.051 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.871 -179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -88.58 114.98 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.294 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 60.1 m -104.7 126.79 52.12 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.167 0.508 . . . . 0.0 110.179 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 10.6 p90 -125.56 159.6 31.67 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.204 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -95.53 121.87 37.68 Favored 'General case' 0 N--CA 1.425 -1.676 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -178.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.409 ' HA ' ' HE ' ' A' ' 15' ' ' ARG . 1.4 mmp_? -111.03 145.71 38.0 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.1 m -124.18 132.7 53.64 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 121.625 0.726 . . . . 0.0 111.269 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -126.02 75.71 1.53 Allowed 'General case' 0 N--CA 1.418 -2.027 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.679 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.032 -177.969 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 93.8 mttt . . . . . 0 CA--C 1.507 -0.684 0 CA-C-O 121.733 0.778 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.7 t90 -109.61 118.53 36.81 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.849 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.8 m -109.66 119.57 39.8 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.594 0.711 . . . . 0.0 109.7 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -126.18 160.24 30.77 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.665 -174.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -95.46 133.64 39.21 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.522 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 21.5 t -123.5 122.61 65.47 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 92.2 m -109.03 116.01 31.17 Favored 'General case' 0 C--N 1.288 -2.088 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -129.52 110.33 11.76 Favored 'General case' 0 N--CA 1.419 -1.995 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -176.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 64.78 22.23 12.51 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 124.099 0.959 . . . . 0.0 112.661 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.06 -22.49 33.15 Favored Glycine 0 CA--C 1.506 -0.502 0 N-CA-C 111.493 -0.643 . . . . 0.0 111.493 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 62.7 mt -87.78 114.9 27.29 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.5 m -104.59 130.48 52.57 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-O 121.182 0.515 . . . . 0.0 109.735 179.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -134.68 160.97 36.46 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.187 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -102.55 125.79 49.39 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.243 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.525 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.8 mmp_? -120.75 146.91 45.99 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 176.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.0 m -118.14 115.15 24.22 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 49.7 ttt180 -106.81 95.04 5.45 Favored 'General case' 0 N--CA 1.428 -1.571 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.923 0 N-CA-C 109.128 -1.589 . . . . 0.0 109.128 -175.222 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 64.1 pttt . . . . . 0 N--CA 1.449 -0.521 0 CA-C-O 120.876 0.37 . . . . 0.0 111.602 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -120.01 135.45 54.92 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.316 -176.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.7 m -116.94 123.42 46.91 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.094 178.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 20.7 p90 -123.86 159.4 29.69 Favored 'General case' 0 C--N 1.297 -1.706 0 C-N-CA 123.664 0.785 . . . . 0.0 110.252 -175.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.4 ttt180 -105.99 134.1 49.65 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.512 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 58.5 t -121.47 131.35 73.28 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.853 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -177.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 70.9 m -109.63 124.8 51.79 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 175.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -146.06 124.31 12.25 Favored 'General case' 0 N--CA 1.416 -2.152 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 -177.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.2 mtm180 64.96 16.33 10.49 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.175 0.99 . . . . 0.0 112.466 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.73 -7.47 59.33 Favored Glycine 0 N--CA 1.436 -1.3 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 56.8 mt -102.2 125.14 56.45 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.112 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 47.7 m -108.69 134.66 51.11 Favored 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 176.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 p90 -137.42 149.21 46.73 Favored 'General case' 0 C--N 1.289 -2.034 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.144 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -91.52 118.5 30.64 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -118.97 158.22 26.19 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.6 m -131.88 150.48 52.14 Favored 'General case' 0 C--N 1.294 -1.825 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.026 -177.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -142.92 99.13 3.4 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.351 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.327 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.8 pttt . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.901 0.381 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.1 t90 -100.66 121.93 42.47 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.974 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 75.1 m -112.56 139.93 47.74 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.783 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -136.88 154.61 50.44 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.354 -174.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -97.09 129.62 44.48 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 123.824 0.85 . . . . 0.0 109.345 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.473 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 46.7 t -122.45 128.53 75.43 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.332 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 178.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 71.3 m -109.69 111.88 23.61 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.714 0.768 . . . . 0.0 111.057 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -108.17 96.31 6.28 Favored 'General case' 0 N--CA 1.423 -1.789 0 CA-C-N 114.482 -1.236 . . . . 0.0 108.798 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 57.31 32.3 21.54 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 124.511 1.124 . . . . 0.0 112.895 176.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.22 -23.5 20.65 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 121.066 -0.588 . . . . 0.0 111.824 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 60.5 mt -88.66 109.38 19.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 59.7 m -101.3 121.05 41.2 Favored 'General case' 0 C--N 1.283 -2.296 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.406 ' CE1' ' HB ' ' A' ' 6' ' ' VAL . 17.5 p90 -119.78 155.26 32.88 Favored 'General case' 0 C--N 1.277 -2.58 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.029 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -102.44 122.16 43.75 Favored 'General case' 0 C--N 1.288 -2.082 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 -177.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.9 mmm180 -117.44 156.06 28.59 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 78.6 m -128.82 139.15 52.31 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -178.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -130.31 94.5 3.69 Favored 'General case' 0 C--N 1.288 -2.066 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.859 0 N-CA-C 108.879 -1.689 . . . . 0.0 108.879 -174.05 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 66.8 mttm . . . . . 0 C--O 1.238 0.467 0 CA-C-O 122.103 0.954 . . . . 0.0 108.953 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.0 t90 -88.51 109.88 20.42 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 113.858 -1.519 . . . . 0.0 110.806 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 80.2 m -113.08 119.2 37.03 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.281 0.562 . . . . 0.0 110.033 178.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.7 p90 -118.43 150.59 39.3 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.365 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -87.64 123.46 32.52 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.624 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.466 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 60.4 t -112.99 125.69 70.28 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.7 m -109.27 119.46 39.55 Favored 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -134.21 113.2 11.76 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 63.5 29.43 15.38 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 124.302 1.041 . . . . 0.0 111.738 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.02 -28.14 15.92 Favored Glycine 0 N--CA 1.435 -1.37 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.641 177.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 40.0 mm -86.71 129.16 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.57 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.7 m -111.99 135.47 52.6 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.056 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.8 p90 -134.24 145.05 48.78 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.053 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.5 tpp180 -85.2 108.19 17.61 Favored 'General case' 0 C--N 1.301 -1.523 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.192 -179.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -98.64 129.11 45.13 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 86.1 m -105.15 126.39 52.02 Favored 'General case' 0 C--N 1.282 -2.367 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.075 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -125.41 83.68 2.19 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.719 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -175.64 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.0 pttp . . . . . 0 C--O 1.237 0.404 0 CA-C-O 120.937 0.398 . . . . 0.0 111.413 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.0 t90 -110.19 114.74 28.48 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-O 121.085 0.469 . . . . 0.0 112.132 -175.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 74.2 m -108.61 128.14 54.58 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -140.29 153.14 46.37 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.849 -174.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.7 ttt180 -91.64 128.08 37.33 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.534 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 20.6 t -117.63 121.3 67.17 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.611 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 94.3 m -108.55 116.46 32.01 Favored 'General case' 0 C--N 1.281 -2.388 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 177.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -125.89 104.78 8.5 Favored 'General case' 0 N--CA 1.418 -2.033 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 -177.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 66.08 27.29 10.59 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.281 1.433 . . . . 0.0 111.264 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.78 -25.51 27.23 Favored Glycine 0 N--CA 1.44 -1.068 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.129 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.6 mt -82.66 111.92 19.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.534 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.1 m -104.39 129.62 52.32 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.105 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -130.83 147.4 52.48 Favored 'General case' 0 C--N 1.287 -2.122 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.682 178.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 tpp180 -95.24 116.18 28.41 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -178.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.421 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 23.8 mmt180 -105.53 157.15 17.58 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.875 -0.416 . . . . 0.0 109.875 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 97.2 m -134.18 109.26 8.77 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 176.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -99.26 89.45 4.22 Favored 'General case' 0 N--CA 1.415 -2.221 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 178.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.056 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 -177.235 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 59.4 pttt . . . . . 0 C--O 1.235 0.339 0 CA-C-O 121.356 0.598 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.0 t90 -106.25 131.04 53.95 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.597 178.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 96.5 m -121.55 139.25 53.75 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.154 0.502 . . . . 0.0 110.025 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -137.84 158.84 43.52 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 121.596 0.712 . . . . 0.0 112.127 -172.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -91.86 132.63 36.32 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 114.86 -1.063 . . . . 0.0 108.749 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 21.0 t -123.92 124.22 68.59 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.88 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.7 m -111.17 121.47 45.38 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 175.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -131.35 110.74 11.28 Favored 'General case' 0 N--CA 1.419 -1.985 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -176.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.8 mtm180 65.04 23.4 12.48 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 124.066 0.946 . . . . 0.0 112.199 178.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.03 -27.29 12.06 Favored Glycine 0 N--CA 1.438 -1.201 0 C-N-CA 120.959 -0.638 . . . . 0.0 113.02 178.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.1 mt -91.64 129.69 41.94 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 57.7 m -110.67 136.19 50.14 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.073 0.463 . . . . 0.0 109.956 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CE2' ' HB ' ' A' ' 6' ' ' VAL . 16.8 p90 -139.26 161.13 38.17 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.872 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -98.37 129.41 45.03 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -178.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.6 mmt-85 -129.92 160.11 34.59 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 85.2 m -132.12 156.71 45.88 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-O 121.486 0.66 . . . . 0.0 111.533 -177.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -135.21 92.2 2.83 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 106.93 -1.507 . . . . 0.0 106.93 175.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.558 0 CA-C-N 115.342 -0.845 . . . . 0.0 111.57 -179.511 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt . . . . . 0 N--CA 1.446 -0.645 0 CA-C-O 121.476 0.655 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 32.1 t90 -102.1 115.74 31.19 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.397 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.3 m -109.89 123.1 49.0 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.657 0.741 . . . . 0.0 110.611 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -122.46 149.48 43.81 Favored 'General case' 0 C--N 1.285 -2.199 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.474 -173.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' A' ' 5' ' ' ARG . 36.2 ttt180 -89.54 127.78 35.92 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.603 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 39.3 t -116.22 127.97 73.66 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.833 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -176.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 90.0 m -109.7 116.66 32.11 Favored 'General case' 0 C--N 1.29 -1.979 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -128.97 108.88 10.76 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 115.05 -0.977 . . . . 0.0 108.857 -176.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.8 mtp180 59.11 29.74 19.36 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 123.938 0.895 . . . . 0.0 112.195 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.34 -19.98 48.84 Favored Glycine 0 N--CA 1.435 -1.407 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.422 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.0 mt -89.4 115.86 29.83 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.603 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 56.4 m -106.06 122.97 47.25 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 177.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.2 p90 -128.98 161.92 28.8 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.255 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -99.17 124.31 44.12 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -178.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -119.36 152.0 37.53 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 176.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 75.3 m -127.2 132.04 50.53 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-O 120.953 0.406 . . . . 0.0 111.226 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -122.44 100.19 6.81 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 175.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.874 0 N-CA-C 109.079 -1.608 . . . . 0.0 109.079 -174.64 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 61.4 pttt . . . . . 0 C--O 1.244 0.799 0 CA-C-O 121.898 0.856 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -114.82 113.16 23.86 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.713 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.9 m -108.89 134.56 51.41 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.691 179.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.2 p90 -140.33 160.0 40.94 Favored 'General case' 0 C--N 1.287 -2.145 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.524 -176.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -107.51 130.63 54.84 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 51.7 t -125.78 132.2 71.05 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.1 m -112.15 116.7 30.91 Favored 'General case' 0 N--CA 1.422 -1.875 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 176.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -111.7 102.37 10.68 Favored 'General case' 0 N--CA 1.408 -2.566 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 -177.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 68.09 18.9 9.36 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.54 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.29 -20.82 25.26 Favored Glycine 0 C--N 1.309 -0.93 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.058 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 76.7 mt -84.1 116.37 27.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 30.9 m -106.69 123.36 48.01 Favored 'General case' 0 C--N 1.297 -1.679 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.109 -176.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.403 ' HD2' ' HG2' ' A' ' 15' ' ' ARG . 5.9 p90 -119.35 154.47 33.53 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.999 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -93.54 111.58 23.28 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.485 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.403 ' HG2' ' HD2' ' A' ' 13' ' ' TYR . 27.4 mmm180 -106.71 138.31 43.12 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.002 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 98.5 m -135.06 109.7 8.57 Favored 'General case' 0 C--N 1.286 -2.186 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.661 179.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.8 101.48 10.35 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 178.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.415 -2.727 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -176.642 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 pttp . . . . . 0 N--CA 1.45 -0.466 0 CA-C-O 120.648 0.261 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -94.15 124.15 37.98 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 121.01 0.433 . . . . 0.0 110.967 -177.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 64.2 m -117.75 118.96 33.49 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.432 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -118.15 158.27 25.38 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.785 -178.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 5' ' ' ARG . 34.2 ttt180 -98.82 130.88 45.27 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.369 -175.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.519 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 38.7 t -126.12 126.49 69.65 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.271 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 72.0 m -109.58 118.92 37.85 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -123.18 105.82 10.22 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 63.27 25.3 14.67 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 123.808 0.843 . . . . 0.0 110.955 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.99 -17.24 57.49 Favored Glycine 0 N--CA 1.439 -1.161 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.928 -179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 71.3 mt -79.56 109.48 14.22 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.519 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 55.9 m -105.97 120.25 41.29 Favored 'General case' 0 C--N 1.285 -2.217 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.137 -179.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.432 ' CE2' ' HB ' ' A' ' 6' ' ' VAL . 19.5 p90 -120.29 160.21 23.44 Favored 'General case' 0 C--N 1.281 -2.399 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.309 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -106.91 115.3 29.94 Favored 'General case' 0 C--N 1.291 -1.946 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.478 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 22.4 mmm180 -100.04 124.46 45.43 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 120.933 0.397 . . . . 0.0 110.225 178.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 93.9 m -105.65 113.62 27.29 Favored 'General case' 0 C--N 1.278 -2.527 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.433 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -113.24 102.64 10.55 Favored 'General case' 0 N--CA 1.416 -2.146 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.717 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -175.287 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 65.8 mttm . . . . . 0 CA--C 1.51 -0.561 0 CA-C-O 122.231 1.015 . . . . 0.0 109.657 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -114.19 110.02 19.32 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.421 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 72.0 m -109.6 145.6 36.14 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 175.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.6 p90 -140.22 156.05 46.65 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.163 0.506 . . . . 0.0 111.661 -175.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.8 ttt180 -100.91 130.66 46.95 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.502 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 60.8 t -129.28 124.09 59.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 87.9 m -108.68 116.57 32.22 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 176.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -120.58 100.2 6.99 Favored 'General case' 0 N--CA 1.418 -2.071 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 -176.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.2 mtm180 57.91 34.23 24.1 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.779 1.232 . . . . 0.0 113.106 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.26 -20.08 31.05 Favored Glycine 0 N--CA 1.44 -1.058 0 C-N-CA 121.054 -0.593 . . . . 0.0 112.892 177.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 55.2 mt -97.4 113.08 30.89 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 55.7 m -102.6 128.04 49.44 Favored 'General case' 0 C--N 1.293 -1.88 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -126.24 148.63 49.44 Favored 'General case' 0 C--N 1.284 -2.25 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.697 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -92.82 115.41 28.09 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.481 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 4.6 mmp_? -114.34 148.07 38.16 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 94.3 m -128.73 142.18 51.09 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-O 121.046 0.451 . . . . 0.0 111.332 -179.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -134.53 94.65 3.23 Favored 'General case' 0 N--CA 1.417 -2.078 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 174.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.471 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.259 -179.636 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.5 pttm . . . . . 0 N--CA 1.44 -0.968 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 25.2 t90 -95.88 117.64 30.98 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 121.338 0.589 . . . . 0.0 110.741 -177.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 67.1 m -108.96 120.43 42.5 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -135.35 161.25 35.95 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.795 -174.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.0 ttt180 -75.66 125.98 30.11 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.265 177.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 58.8 t -116.16 123.41 71.33 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.785 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 178.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.4 m -110.71 125.19 53.23 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-O 121.384 0.611 . . . . 0.0 110.239 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -130.89 104.71 7.3 Favored 'General case' 0 N--CA 1.42 -1.94 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.992 -177.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 62.71 26.78 15.81 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.941 0.896 . . . . 0.0 112.459 176.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.96 -20.64 38.0 Favored Glycine 0 C--O 1.244 0.72 0 N-CA-C 111.592 -0.603 . . . . 0.0 111.592 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 65.1 mt -88.79 117.67 32.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 61.7 m -107.25 129.15 54.91 Favored 'General case' 0 C--N 1.289 -2.03 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.715 179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -131.47 169.95 15.37 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.632 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -104.64 129.04 52.83 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 -178.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.436 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 24.4 mmm180 -127.28 142.11 51.55 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 120.683 0.277 . . . . 0.0 110.604 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 84.1 m -112.98 111.36 22.05 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.272 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -107.8 113.87 27.42 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 176.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.301 0 N-CA-C 108.628 -1.789 . . . . 0.0 108.628 -173.558 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.5 pttt . . . . . 0 N--CA 1.447 -0.577 0 CA-C-O 121.54 0.686 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.9 t90 -104.22 110.72 23.04 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.691 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 56.1 m -109.04 126.99 53.72 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -177.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -138.86 160.9 38.59 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.992 -175.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.8 ttt180 -77.35 130.21 36.84 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.232 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 32.4 t -125.68 121.78 60.78 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.754 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 82.3 m -109.02 118.75 37.61 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -125.47 105.12 8.82 Favored 'General case' 0 N--CA 1.419 -1.98 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.194 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.7 mtm180 63.82 28.09 14.66 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 124.479 1.111 . . . . 0.0 111.877 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.43 -28.64 10.56 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.199 178.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.0 mt -86.69 113.63 24.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -178.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 62.3 m -100.54 124.17 45.73 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.321 0.581 . . . . 0.0 110.098 178.332 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 18.0 p90 -128.69 163.97 23.95 Favored 'General case' 0 C--N 1.281 -2.383 0 CA-C-N 115.197 -0.911 . . . . 0.0 108.712 178.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -101.62 128.6 47.82 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 25.9 mmm180 -118.3 132.63 56.28 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-O 120.866 0.365 . . . . 0.0 111.201 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 97.2 m -99.96 110.06 22.4 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.39 175.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -102.67 95.51 6.26 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.277 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -174.637 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt . . . . . 0 N--CA 1.445 -0.7 0 CA-C-O 120.995 0.426 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.0 t90 -82.87 119.67 24.68 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.909 -178.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 16' ' ' CYS . 64.0 m -109.43 131.1 55.38 Favored 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.906 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -138.31 151.8 47.91 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 124.162 0.985 . . . . 0.0 108.819 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -97.26 136.29 37.97 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -177.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.556 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 40.7 t -125.12 135.56 63.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -175.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.1 m -109.6 117.45 33.97 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 172.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -129.22 110.14 11.72 Favored 'General case' 0 N--CA 1.418 -2.062 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 -174.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 69.23 16.82 8.43 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.174 0.989 . . . . 0.0 111.37 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.43 -3.27 61.35 Favored Glycine 0 N--CA 1.441 -0.993 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 -178.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.1 mt -98.5 114.83 37.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 28.6 m -104.65 133.45 49.47 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 120.041 -0.664 . . . . 0.0 110.283 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -143.65 158.66 43.5 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.537 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.4 ttp180 -99.38 128.23 45.48 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 3.6 mmp_? -115.88 141.39 48.16 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 86.2 m -117.21 110.79 18.58 Favored 'General case' 0 C--N 1.289 -2.047 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 29.5 ttt180 -96.83 95.88 8.17 Favored 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.695 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -175.361 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.4 pttm . . . . . 0 N--CA 1.444 -0.728 0 CA-C-O 121.743 0.782 . . . . 0.0 109.842 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -91.4 108.97 20.26 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 115.206 -0.907 . . . . 0.0 108.615 177.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 15' ' ' ARG . 74.3 m -110.46 119.62 39.77 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 10.6 p90 -129.7 160.12 34.35 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.988 -172.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -85.6 128.17 34.68 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.078 -0.964 . . . . 0.0 108.862 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.49 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 14.5 t -123.53 116.8 49.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 11' ' ' ILE . 79.4 m -109.54 120.72 43.35 Favored 'General case' 0 C--N 1.289 -2.044 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.214 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -122.93 102.35 7.96 Favored 'General case' 0 N--CA 1.417 -2.092 0 N-CA-C 107.205 -1.405 . . . . 0.0 107.205 -176.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 65.04 22.18 12.36 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.29 1.036 . . . . 0.0 111.929 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.57 -20.94 26.8 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 121.054 -0.594 . . . . 0.0 111.793 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 50.0 mt -82.56 112.86 20.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 58.7 m -105.31 121.06 43.09 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 121.583 0.706 . . . . 0.0 110.598 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -126.85 150.72 49.09 Favored 'General case' 0 C--N 1.281 -2.372 0 CA-C-N 114.905 -1.043 . . . . 0.0 108.701 177.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 26.3 ttm180 -100.53 125.97 46.92 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 -177.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 26.8 mmm180 -119.97 153.42 35.99 Favored 'General case' 0 C--N 1.298 -1.643 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.568 -179.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 77.9 m -125.54 115.2 19.82 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 121.47 0.652 . . . . 0.0 110.985 -178.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 73.2 ttt180 -107.49 99.4 8.91 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -0.853 0 N-CA-C 107.465 -2.254 . . . . 0.0 107.465 -172.18 . . . . . . . . 0 0 . 1 stop_ save_