data_1ma5_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1ma5 _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 2' ' ' TRP . . . . . . . . . . . . . 15.6 m95 . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 120.528 0.204 . . . . 7.0700000000000003 110.572 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 t -45.0 -29.91 0.93 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.799 0.333 . . . . 2.77 111.137 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.406 ' O ' ' CD ' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 169.23 -3.86 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.173 -0.467 . . . . 7.6100000000000003 111.891 179.713 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.406 ' CD ' ' O ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 38.14 43.17 0.55 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.021 0.439 . . . . 8.9700000000000006 111.311 -179.728 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 34.8 m -52.31 119.74 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.875 -0.602 . . . . 3.8799999999999999 111.262 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.476 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 74.2 m 66.03 41.14 3.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.912 -0.585 . . . . 2.7200000000000002 110.102 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.421 ' CE2' ' HG2' ' A' ' 9' ' ' ARG . 79.0 t80 -175.27 167.01 3.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.578 -0.737 . . . . 5.9100000000000001 110.378 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.421 ' HG2' ' CE2' ' A' ' 8' ' ' TYR . 0.3 OUTLIER 35.23 36.89 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.298 -0.41 . . . . 6.2999999999999998 111.685 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.475 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 158.64 -66.42 0.29 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.579 -0.819 . . . . 2.3199999999999998 112.748 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.475 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 172.84 -178.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 120.864 0.364 . . . . 2.6299999999999999 111.182 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.476 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 1.7 m -77.18 110.11 11.6 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.96 -0.564 . . . . 2.1099999999999999 110.299 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -137.54 68.67 1.41 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 4.1600000000000001 111.519 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -55.49 97.77 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.432 -0.349 . . . . 6.4800000000000004 111.039 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.404 ' O ' ' CD2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 179.21 50.59 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.955 0.407 . . . . 6.1799999999999997 111.099 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.38 -21.27 63.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.329 -0.396 . . . . 2.2400000000000002 111.083 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.246 -0.883 . . . . 8.2400000000000002 110.897 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.412 ' N ' ' OH ' ' A' ' 8' ' ' TYR . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.142 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -50.08 -29.82 9.68 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.306 0.574 . . . . 0.0 110.003 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.462 ' O ' ' CB ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -178.01 -63.54 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.157 -0.928 . . . . 0.0 108.697 179.624 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.462 ' CB ' ' O ' ' A' ' 4' ' ' PHE . 8.3 ptt-85 154.01 45.92 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.173 178.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.507 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 4.5 m -105.65 116.25 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-O 121.369 0.604 . . . . 0.0 111.781 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.657 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 13.5 m 76.57 25.95 0.9 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.879 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.497 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.0 OUTLIER 171.69 -176.06 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.127 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.495 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 15.94 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.51 ' O ' ' CG1' ' A' ' 11' ' ' ILE . . . 131.54 15.8 1.56 Allowed Glycine 0 CA--C 1.524 0.638 0 C-N-CA 120.078 -1.058 . . . . 0.0 114.35 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.51 ' CG1' ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 80.79 -169.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 117.247 0.523 . . . . 0.0 111.434 179.57 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.657 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 1.9 t -122.81 133.08 54.46 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.455 ' CE2' ' HG3' ' A' ' 5' ' ' ARG . 5.8 p90 -147.53 25.81 1.06 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.908 177.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.411 ' N ' HG12 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 33.84 92.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.697 -1.138 . . . . 0.0 112.347 178.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.447 ' O ' HG13 ' A' ' 6' ' ' VAL . 0.3 OUTLIER 176.65 156.7 0.27 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.405 ' N ' ' HG3' ' A' ' 15' ' ' ARG . 40.2 t -145.64 84.25 1.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.658 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.969 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.859 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.57 ' HB2' ' CZ ' ' A' ' 8' ' ' TYR . 4.0 m0 . . . . . 0 N--CA 1.471 0.616 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 2' ' ' TRP . 1.8 t 95.25 -71.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.474 ' HB2' HG11 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -119.5 -19.56 8.12 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -177.198 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.606 ' HA ' ' CE1' ' A' ' 8' ' ' TYR . 2.0 mtp180 69.55 41.35 1.27 Allowed 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.726 -0.39 . . . . 0.0 110.187 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.561 ' CG1' ' HA ' ' A' ' 14' ' ' ARG . 28.5 m -90.51 91.31 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -178.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.802 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.8 OUTLIER 76.12 56.26 0.05 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.125 178.439 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.606 ' CE1' ' HA ' ' A' ' 5' ' ' ARG . 31.5 p90 175.0 171.08 0.27 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.794 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.571 ' HD3' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 47.23 21.66 0.2 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.77 0.795 . . . . 0.0 110.751 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 146.69 -62.27 0.45 Allowed Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.981 179.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.416 ' CD1' ' HB2' ' A' ' 13' ' ' TYR . 1.5 pp -170.22 176.52 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 117.51 0.655 . . . . 0.0 112.505 -178.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.802 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -66.99 77.05 0.13 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.163 -0.472 . . . . 0.0 109.997 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.519 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 1.5 t80 -104.76 118.33 36.29 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.97 -178.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.561 ' HA ' ' CG1' ' A' ' 6' ' ' VAL . 0.2 OUTLIER -100.15 126.16 46.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.253 179.496 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.44 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -149.34 -78.14 0.14 Allowed 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.269 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.468 ' N ' ' HB3' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -26.17 136.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.111 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.1 mmp_? . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.923 179.998 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.446 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.746 0.307 . . . . 0.0 110.696 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 46.52 38.02 5.04 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.958 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 56.24 -102.66 0.16 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.766 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.6 30.57 1.1 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.152 0.501 . . . . 0.0 110.601 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.517 ' O ' ' N ' ' A' ' 8' ' ' TYR . 3.5 m -83.29 -174.17 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.061 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.604 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 3.6 m -41.09 86.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.725 -179.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.557 ' O ' ' C ' ' A' ' 9' ' ' ARG . 86.3 t80 164.47 162.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.576 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.557 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 1.32 77.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.196 0.598 . . . . 0.0 112.385 179.581 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.45 -77.12 0.29 Allowed Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.054 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.4 pp -158.08 -172.58 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.467 0.175 . . . . 0.0 110.739 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.604 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 16.2 t -134.39 84.29 2.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.758 0.313 . . . . 0.0 111.794 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.51 ' O ' ' O ' ' A' ' 14' ' ' ARG . 7.9 p90 -98.84 12.22 36.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.453 0.645 . . . . 0.0 110.152 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.51 ' O ' ' O ' ' A' ' 13' ' ' TYR . 7.2 mtm-85 41.38 178.76 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.465 -1.243 . . . . 0.0 112.503 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 68.29 59.7 0.41 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.859 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.6 t -82.52 132.68 35.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.787 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.872 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.429 ' O ' ' C ' ' A' ' 3' ' ' CYS . 5.6 m95 . . . . . 0 CA--C 1.532 0.263 0 CA-C-O 120.521 0.2 . . . . 0.0 111.323 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.429 ' C ' ' O ' ' A' ' 2' ' ' TRP . 1.0 OUTLIER -25.52 -53.96 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.033 -0.531 . . . . 0.0 112.429 -179.773 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.566 ' CE2' ' CE1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 179.45 -32.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.715 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.472 ' HD2' ' HB2' ' A' ' 9' ' ' ARG . 5.7 mtm-85 62.87 115.96 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.969 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.518 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 2.6 m -118.65 86.65 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.014 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.637 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 64.6 m 93.37 44.15 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.295 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.433 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 7.6 t80 -179.88 165.82 1.27 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.446 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.472 ' HB2' ' HD2' ' A' ' 5' ' ' ARG . 2.8 ptt180 31.46 38.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.285 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.414 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 156.55 -68.63 0.29 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.207 -0.997 . . . . 0.0 113.529 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.414 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 177.94 -178.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 120.522 0.201 . . . . 0.0 111.146 -179.396 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.637 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 15.2 m -82.12 65.8 7.42 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.375 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.566 ' CE1' ' CE2' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -63.48 -154.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.838 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.607 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER 162.69 109.2 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.421 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.607 ' HB2' ' O ' ' A' ' 14' ' ' ARG . 6.2 mmp_? 110.03 78.64 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.562 0.745 . . . . 0.0 111.301 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.405 ' HA ' ' CG ' ' A' ' 4' ' ' PHE . 29.7 t -69.59 -80.46 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.006 0.431 . . . . 0.0 110.655 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.335 -0.84 . . . . 0.0 110.921 179.914 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.427 ' CE2' ' HG2' ' A' ' 9' ' ' ARG . 10.9 m-90 . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.898 0.38 . . . . 0.0 111.291 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB3' ' CG2' ' A' ' 6' ' ' VAL . 2.7 t -144.47 65.84 1.28 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.776 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.48 ' CD1' ' OH ' ' A' ' 13' ' ' TYR . 1.6 t80 57.47 21.03 6.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.9 mtm-85 62.7 38.62 11.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.767 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.518 ' CG1' ' CE2' ' A' ' 13' ' ' TYR . 1.5 m -77.16 -104.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.966 -0.294 . . . . 0.0 110.425 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.2 m -77.26 146.78 36.67 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 122.161 -0.337 . . . . 0.0 110.2 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.501 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 49.2 p90 49.7 176.61 0.01 OUTLIER 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.984 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.427 ' HG2' ' CE2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 34.28 34.73 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.974 0.416 . . . . 0.0 111.259 -179.189 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.473 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 166.59 -64.11 0.21 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.491 -179.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.473 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER -178.04 -104.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 179.765 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.0 OUTLIER 168.35 62.64 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.637 0.256 . . . . 0.0 110.713 -179.631 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.533 ' O ' ' CD1' ' A' ' 13' ' ' TYR . 7.0 p90 -98.88 27.95 4.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.511 0.672 . . . . 0.0 110.779 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 44.61 -165.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.601 178.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.95 46.42 1.22 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.074 0.464 . . . . 0.0 110.695 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.1 t -100.83 -77.11 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.803 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.897 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.466 ' CE2' ' CB ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.146 0 CA-C-O 120.568 0.223 . . . . 0.0 110.607 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -103.73 -76.06 0.6 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.228 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.438 ' CE1' ' HD3' ' A' ' 14' ' ' ARG . 1.4 t80 -94.47 -34.16 12.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.129 0.49 . . . . 0.0 110.827 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.52 ' O ' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -89.58 32.09 0.89 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.802 178.886 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.457 ' CG2' ' CE1' ' A' ' 13' ' ' TYR . 10.1 p -60.07 -4.48 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 8' ' ' TYR . 0.5 OUTLIER -66.36 66.18 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.528 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.52 ' CE1' ' O ' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 175.01 -94.42 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 178.643 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.508 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 13.1 mmp_? -62.4 79.23 0.02 OUTLIER 'General case' 0 C--O 1.233 0.228 0 CA-C-O 120.984 0.421 . . . . 0.0 109.889 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 116.56 48.06 0.48 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.539 -0.624 . . . . 0.0 111.539 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.411 ' CD1' ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 45.82 -168.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-O 120.629 0.252 . . . . 0.0 111.569 -179.56 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.3 m -105.35 128.5 53.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.03 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.49 ' CD2' ' O ' ' A' ' 13' ' ' TYR . 7.5 p90 -172.24 44.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.264 0.554 . . . . 0.0 111.048 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.438 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 61.2 mtt85 -34.05 110.59 0.09 Allowed 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.948 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -160.18 73.09 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.71 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t -131.55 132.21 43.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.628 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.939 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.907 0.384 . . . . 0.0 110.923 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER 178.79 -68.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.43 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -166.22 35.74 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.325 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 65.04 34.58 8.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.639 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.436 ' O ' ' O ' ' A' ' 11' ' ' ILE . 16.5 m -66.87 178.42 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.515 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 20.3 m -35.5 129.41 0.56 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.048 0.451 . . . . 0.0 111.647 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.434 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 1.3 t80 82.85 -175.53 0.03 OUTLIER 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.829 -178.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 37.56 37.26 0.1 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.801 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.411 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 137.83 -70.6 0.48 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.434 -0.889 . . . . 0.0 113.318 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.436 ' O ' ' O ' ' A' ' 6' ' ' VAL . 1.4 pt -157.59 -163.9 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.67 0.235 . . . . 0.0 111.084 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 m -113.44 123.16 49.38 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-O 121.212 0.529 . . . . 0.0 111.321 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -153.11 54.21 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.428 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -45.54 114.06 0.69 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.572 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 17' ' ' ARG . 17.5 tpp85 -178.52 -91.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.716 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.9 t 43.91 -92.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.63 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 15' ' ' ARG . 5.7 tmm_? . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.791 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 7.3 p-90 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.983 0.42 . . . . 0.0 111.127 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.9 t -134.19 -79.68 0.46 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.953 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.536 ' O ' ' C ' ' A' ' 5' ' ' ARG . 1.5 p90 -147.09 -48.78 0.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.293 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.536 ' C ' ' O ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 4.94 89.14 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.491 -179.702 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.563 HG12 ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -54.22 -167.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.437 -179.542 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.61 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 64.2 m -19.39 87.28 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.795 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.726 ' O ' ' N ' ' A' ' 10' ' ' GLY . 54.1 t80 -177.33 -86.46 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.017 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.3 mmt-85 -48.27 70.13 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.92 0.39 . . . . 0.0 111.705 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.726 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 58.84 12.47 14.79 Favored Glycine 0 CA--C 1.521 0.428 0 CA-C-N 116.122 -0.49 . . . . 0.0 113.496 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.605 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.9 OUTLIER 166.68 -177.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-N 117.225 0.512 . . . . 0.0 111.32 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.64 ' O ' ' HB3' ' A' ' 13' ' ' TYR . 3.1 m -106.71 -158.56 0.66 Allowed 'General case' 0 C--O 1.23 0.05 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.197 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.64 ' HB3' ' O ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER 107.0 152.03 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.458 1.103 . . . . 0.0 111.034 179.71 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.483 ' HA ' ' HB2' ' A' ' 4' ' ' PHE . 6.9 mtp180 -150.17 110.22 4.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.327 -178.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -126.36 -82.13 0.62 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.925 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 15' ' ' ARG . 1.2 m 20.16 -89.05 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.272 0.629 . . . . 0.0 112.528 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.9 ptp85 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.481 179.903 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.409 ' CZ2' ' HG2' ' A' ' 5' ' ' ARG . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.134 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' ' CB ' ' A' ' 4' ' ' PHE . 7.6 t -48.65 -23.83 1.15 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.441 0.163 . . . . 0.0 111.386 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.473 ' CB ' ' O ' ' A' ' 3' ' ' CYS . 0.6 OUTLIER 85.42 97.96 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.972 179.85 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.41 ' C ' ' CG2' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -90.97 49.62 1.67 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.503 179.592 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.435 ' O ' ' C ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 47.49 -178.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.456 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.627 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 90.8 m 19.86 59.21 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 114.963 -1.017 . . . . 0.0 113.018 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.467 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 3.1 t80 174.38 170.77 0.23 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.314 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 mmt180 43.57 26.49 0.12 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.166 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.415 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 147.3 -63.55 0.43 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 119.958 -1.115 . . . . 0.0 113.923 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.415 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -174.17 -172.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 117.057 0.428 . . . . 0.0 111.661 -178.91 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.627 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 21.5 m -99.71 103.54 15.21 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.898 0.38 . . . . 0.0 111.699 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.607 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 1.2 p90 -139.84 95.54 2.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.492 0.663 . . . . 0.0 110.019 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -66.38 94.28 0.26 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.359 -178.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.87 70.06 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.035 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.2 -28.01 9.26 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.759 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.965 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.471 ' O ' ' N ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.526 0.05 0 CA-C-O 120.542 0.21 . . . . 0.0 111.197 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.433 ' HB3' ' CD1' ' A' ' 4' ' ' PHE . 56.7 m 43.27 -89.65 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.471 ' N ' ' O ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -164.13 48.09 0.12 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.247 0.546 . . . . 0.0 109.635 179.101 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 4' ' ' PHE . 15.2 mtm-85 81.55 56.63 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.805 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.498 ' CG1' ' CE2' ' A' ' 13' ' ' TYR . 26.8 m -111.87 -139.31 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.395 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -54.11 149.31 9.64 Favored 'General case' 0 CA--C 1.52 -0.206 0 O-C-N 122.049 -0.407 . . . . 0.0 110.776 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.528 ' O ' ' N ' ' A' ' 10' ' ' GLY . 5.2 t80 72.21 -136.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.424 ' HD2' ' CD2' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -39.29 89.55 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.856 0.36 . . . . 0.0 111.174 179.395 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 135.48 -70.78 0.5 Allowed Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.503 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.508 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -179.71 -100.36 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 O-C-N 122.97 -0.135 . . . . 0.0 111.167 179.921 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 176.25 62.81 0.01 OUTLIER 'General case' 0 C--N 1.342 0.253 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.662 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.543 ' O ' ' CD1' ' A' ' 13' ' ' TYR . 1.5 p90 -102.49 96.55 6.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.721 0.772 . . . . 0.0 109.316 178.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -57.02 117.05 3.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.716 -178.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 1.5 mmm180 -159.08 -91.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.54 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.437 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 31.69 61.85 0.28 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 111.939 179.547 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.936 -179.91 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.416 ' CH2' ' HG3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.448 0 CA-C-O 120.982 0.42 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 t 177.43 122.55 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.644 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.482 ' C ' ' HG2' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 54.22 -165.3 0.09 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.98 -179.41 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.482 ' HG2' ' C ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 45.07 40.04 4.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.015 0.436 . . . . 0.0 110.401 179.564 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.411 ' CG1' ' O ' ' A' ' 13' ' ' TYR . 31.0 m -40.77 162.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.413 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.619 ' HA ' ' O ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER 74.23 143.23 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.817 -179.662 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.56 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 35.1 t80 97.27 173.5 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.798 -178.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 35.3 37.71 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.984 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.421 ' C ' HG13 ' A' ' 11' ' ' ILE . . . 154.48 -68.64 0.3 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.251 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.619 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -173.06 -89.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 116.748 0.274 . . . . 0.0 111.562 -179.545 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -168.13 120.93 0.87 Allowed 'General case' 0 CA--C 1.522 -0.107 0 CA-C-O 120.747 0.308 . . . . 0.0 110.321 179.699 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.411 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 0.2 OUTLIER -99.76 175.29 5.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.413 179.899 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.406 ' HD3' ' N ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -151.13 26.65 0.7 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.619 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.22 122.38 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.6 t -77.87 64.12 3.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.974 0.416 . . . . 0.0 110.828 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 ptp85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.862 179.952 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.483 ' HB2' ' CE2' ' A' ' 8' ' ' TYR . 87.8 m95 . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.57 ' O ' ' HG2' ' A' ' 5' ' ' ARG . 1.6 t 69.6 -57.76 0.53 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 122.147 0.179 . . . . 0.0 111.401 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.425 ' O ' ' O ' ' A' ' 15' ' ' ARG . 0.1 OUTLIER -43.32 -30.02 0.47 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.77 0.319 . . . . 0.0 111.682 -179.447 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.579 ' HA ' ' CD2' ' A' ' 8' ' ' TYR . 4.0 ptp180 37.73 35.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.746 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.496 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 1.7 m -109.22 77.77 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.452 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.655 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 62.0 m 83.45 44.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.487 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.589 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.0 OUTLIER -147.81 147.13 29.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.722 -1.127 . . . . 0.0 109.004 179.089 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.53 ' HB2' ' CD1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 33.59 -85.68 0.0 OUTLIER 'General case' 0 CA--C 1.522 -0.105 0 CA-C-O 121.647 0.737 . . . . 0.0 111.895 179.312 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . -51.64 -75.27 0.23 Allowed Glycine 0 C--N 1.297 -1.623 0 CA-C-N 114.348 -1.297 . . . . 0.0 113.571 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.458 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -177.35 -174.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-N 116.823 0.312 . . . . 0.0 111.401 -179.063 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.655 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 23.8 m -84.13 60.0 5.65 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.252 0.548 . . . . 0.0 109.651 178.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.462 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 2.6 t80 -87.27 105.02 16.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.792 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.471 ' HA ' HG12 ' A' ' 6' ' ' VAL . 36.4 mtp85 -66.59 64.48 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.859 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.428 ' O ' ' CG ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER 170.04 -163.49 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.259 179.585 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -145.06 56.88 1.26 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.919 0.39 . . . . 0.0 110.666 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.93 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.422 ' CD1' ' HG3' ' A' ' 5' ' ' ARG . 4.5 m95 . . . . . 0 N--CA 1.466 0.325 0 CA-C-O 120.707 0.289 . . . . 0.0 111.058 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -69.16 -54.97 12.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.914 0.387 . . . . 0.0 110.149 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -140.59 -58.5 0.52 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.368 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.422 ' HG3' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 47.54 93.76 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.81 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.535 ' O ' ' C ' ' A' ' 7' ' ' CYS . 0.9 OUTLIER -55.0 -174.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.101 -179.694 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.637 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 98.9 m 0.72 71.97 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.607 0.763 . . . . 0.0 112.671 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.484 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 177.71 -165.21 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.081 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.479 ' C ' ' O ' ' A' ' 8' ' ' TYR . 4.5 mmm-85 -17.52 83.66 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.568 0 O-C-N 123.692 0.62 . . . . 0.0 112.557 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.484 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 124.07 -78.1 0.36 Allowed Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.792 -0.718 . . . . 0.0 113.177 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.467 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.9 OUTLIER -170.99 -172.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 122.18 0.192 . . . . 0.0 110.584 -179.424 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.637 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 72.4 m -92.92 73.97 4.82 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 120.775 0.322 . . . . 0.0 110.192 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.498 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -112.24 108.93 18.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.118 0.485 . . . . 0.0 111.977 -179.649 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.531 ' HA ' ' CG1' ' A' ' 6' ' ' VAL . 3.6 mtt180 -76.42 101.35 5.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.239 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.51 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 170.22 -157.55 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.177 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.427 ' HA ' ' HB2' ' A' ' 4' ' ' PHE . 0.8 OUTLIER 169.05 -30.23 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.916 0.389 . . . . 0.0 110.854 179.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.916 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.472 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 11.7 m0 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 121.267 0.556 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.477 ' C ' ' SG ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER 173.79 -46.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.018 179.275 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.86 48.52 1.23 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.548 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.424 ' NH1' ' CE2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -94.32 36.41 1.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.001 179.545 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.527 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 27.1 m -75.14 72.51 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.798 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.667 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 70.9 m 98.93 42.27 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.05 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.46 ' O ' ' N ' ' A' ' 10' ' ' GLY . 28.7 t80 -155.43 -111.28 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.041 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.52 89.39 0.0 OUTLIER 'General case' 0 C--O 1.231 0.129 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.557 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 103.42 -48.68 1.0 Allowed Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.667 -0.777 . . . . 0.0 113.884 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.557 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER 162.39 -174.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 116.966 0.383 . . . . 0.0 110.748 -178.87 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.667 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 14.8 m -67.22 86.53 0.16 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.985 0.421 . . . . 0.0 110.81 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.477 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 2.5 t80 -91.13 171.72 9.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.47 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.477 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 13.6 mtt-85 -163.99 96.37 0.81 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.614 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.469 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -175.58 -78.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.477 ' SG ' ' C ' ' A' ' 3' ' ' CYS . 1.8 m 70.59 12.46 7.34 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.378 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.42 ' HG3' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.324 -0.846 . . . . 0.0 111.853 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 1.2 m95 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.018 0.437 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.0 t -52.74 165.74 0.25 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.117 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -41.35 -31.33 0.23 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.056 0.455 . . . . 0.0 111.138 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -71.88 92.12 1.23 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.045 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.449 ' O ' ' C ' ' A' ' 7' ' ' CYS . 8.5 m -52.33 -16.22 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.725 -179.101 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.619 ' O ' ' CB ' ' A' ' 8' ' ' TYR . 1.8 m -29.89 105.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.635 0.255 . . . . 0.0 111.146 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.619 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 42.0 t80 107.87 177.69 0.0 OUTLIER 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.537 -178.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.94 38.52 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.196 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.433 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 149.99 -72.56 0.29 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.179 -1.01 . . . . 0.0 113.436 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.433 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 9.3 pt -158.9 -167.2 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 116.684 0.242 . . . . 0.0 111.178 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -119.81 134.39 55.25 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.305 0.574 . . . . 0.0 112.001 -179.857 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.417 ' N ' HG22 ' A' ' 6' ' ' VAL . 0.3 OUTLIER -112.16 -164.61 0.93 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.188 -0.915 . . . . 0.0 108.823 178.213 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 59.0 mtp180 -155.52 91.11 1.29 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.069 0.462 . . . . 0.0 111.229 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.09 -86.42 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.846 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t 45.18 -92.03 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.559 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.9 mtp85 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.856 -179.953 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.429 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.159 0 CA-C-O 120.854 0.359 . . . . 0.0 110.879 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 90.0 m -135.37 -79.56 0.43 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.379 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -105.24 -21.41 13.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.356 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.453 ' NH1' ' CD2' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -82.3 55.98 3.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.862 0.363 . . . . 0.0 110.879 179.909 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.541 ' O ' ' CB ' ' A' ' 7' ' ' CYS . 2.7 m -58.29 132.93 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.572 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.587 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 71.4 m 108.12 77.74 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.177 0.991 . . . . 0.0 111.307 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.453 ' CD2' ' NH1' ' A' ' 5' ' ' ARG . 42.5 t80 -179.26 -104.85 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.25 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.46 ' O ' ' CZ ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -61.01 83.82 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.067 0 CA-C-O 120.816 0.341 . . . . 0.0 111.798 -179.228 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.469 ' O ' ' CG1' ' A' ' 11' ' ' ILE . . . 89.41 49.87 3.34 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.488 -0.863 . . . . 0.0 113.148 179.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.469 ' CG1' ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 69.17 -167.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.769 0.319 . . . . 0.0 111.788 179.559 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.587 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 19.0 m -88.2 -164.53 1.13 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.331 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.51 ' CD1' ' C ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 74.56 -67.15 0.27 Allowed 'General case' 0 CA--C 1.513 -0.481 0 CA-C-O 121.945 0.879 . . . . 0.0 110.165 -179.616 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.496 ' N ' ' CG ' ' A' ' 13' ' ' TYR . 0.5 OUTLIER 48.08 176.62 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 113.871 -1.513 . . . . 0.0 112.12 178.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.41 129.47 23.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.909 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 t -87.85 114.54 24.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.841 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.905 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 20.9 m0 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.619 0.247 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.408 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 46.7 t -133.84 -72.52 0.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.751 179.537 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -68.76 -120.52 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.405 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.467 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 0.2 OUTLIER 49.99 -175.32 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.088 0 O-C-N 122.163 -0.336 . . . . 0.0 110.606 -179.715 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.467 ' CG1' ' O ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 174.08 113.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.982 0.42 . . . . 0.0 110.878 179.676 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.0 OUTLIER 67.63 70.56 0.35 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.776 -179.671 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.572 ' O ' ' N ' ' A' ' 10' ' ' GLY . 52.6 t80 -178.22 -73.78 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.839 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -48.64 78.4 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.572 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 53.5 16.17 4.92 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 116.064 -0.516 . . . . 0.0 114.123 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.525 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER 163.96 -179.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 117.294 0.547 . . . . 0.0 110.951 179.73 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 3.4 t -97.81 93.41 6.34 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 121.243 0.544 . . . . 0.0 110.682 179.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.408 ' CD2' ' O ' ' A' ' 3' ' ' CYS . 4.5 t80 -75.73 166.33 23.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.444 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -177.4 64.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.943 179.796 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.2 mpp_? -166.33 81.73 0.27 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.274 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.2 t -161.84 137.94 7.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.915 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.897 179.943 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.472 ' CD1' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.472 ' HB3' ' OH ' ' A' ' 8' ' ' TYR . 43.4 t -178.75 66.32 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.93 0.395 . . . . 0.0 110.959 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.427 ' CE2' ' HA ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER 44.78 29.31 0.42 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.661 179.766 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.44 ' HA ' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 42.29 59.66 2.59 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.974 0.416 . . . . 0.0 111.221 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.428 ' CB ' ' HB2' ' A' ' 16' ' ' CYS . 11.2 t -82.97 87.74 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.66 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.566 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER 75.95 48.22 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.92 179.789 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.472 ' CE1' ' CD1' ' A' ' 2' ' ' TRP . 44.9 p90 174.73 176.08 0.17 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.952 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' TYR . 53.0 mtt-85 22.23 48.03 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.691 0.619 . . . . 0.0 112.559 179.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 151.21 -75.35 0.25 Allowed Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.388 -0.911 . . . . 0.0 113.341 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.423 ' O ' ' N ' ' A' ' 7' ' ' CYS . 2.0 pt -159.72 -172.8 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.62 0.21 . . . . 0.0 111.433 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.566 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 8.8 t -109.93 118.15 35.69 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.302 0.572 . . . . 0.0 111.362 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.454 ' O ' ' C ' ' A' ' 14' ' ' ARG . 1.8 t80 -126.15 60.27 1.3 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.457 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.454 ' C ' ' O ' ' A' ' 13' ' ' TYR . 2.2 mtm-85 -22.33 93.76 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.582 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.09 -82.59 0.0 OUTLIER 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.023 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.428 ' HB2' ' CB ' ' A' ' 6' ' ' VAL . 25.7 t 56.76 37.47 28.83 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.017 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.293 -0.86 . . . . 0.0 111.01 179.986 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.495 ' CG ' ' OH ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.169 0 CA-C-O 120.342 0.115 . . . . 0.0 110.845 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 4' ' ' PHE . 97.3 m -39.66 -74.0 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.881 0.372 . . . . 0.0 111.144 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.453 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER 176.36 -29.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.489 179.591 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.622 ' O ' ' CG2' ' A' ' 6' ' ' VAL . 89.6 mtt180 -147.3 -158.29 0.9 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.676 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.622 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.5 m 87.14 -166.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 123.226 0.61 . . . . 0.0 111.116 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.723 ' CA ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -52.88 161.74 0.72 Allowed 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.603 -179.465 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.691 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 8.2 p90 55.07 173.28 0.03 OUTLIER 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.7 OUTLIER 28.55 39.85 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 179.961 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.483 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 162.66 -68.51 0.23 Allowed Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.444 -0.884 . . . . 0.0 113.632 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.565 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -177.43 -90.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 117.125 0.463 . . . . 0.0 111.933 -179.496 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.723 ' HA ' ' CA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -176.05 48.4 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.522 0.677 . . . . 0.0 110.782 179.471 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.417 ' N ' ' HA ' ' A' ' 6' ' ' VAL . 1.0 OUTLIER -80.9 81.81 7.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.072 179.044 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -44.69 99.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.443 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.436 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 176.44 -164.6 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.623 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 41.5 t 174.26 156.41 0.14 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.763 0.316 . . . . 0.0 110.511 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.308 179.972 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 11.9 t90 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.789 0.328 . . . . 0.0 111.126 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.6 t -96.34 -13.36 23.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.999 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.505 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -164.42 -3.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.384 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.405 ' HA ' ' HG3' ' A' ' 9' ' ' ARG . 1.8 mtt-85 48.24 35.71 5.85 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.095 0.474 . . . . 0.0 110.632 -179.472 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.465 ' CG2' ' CE1' ' A' ' 4' ' ' PHE . 23.6 m -86.25 -142.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.289 -179.478 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.548 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.2 m -26.92 130.31 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.467 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.593 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.0 OUTLIER 73.75 -75.3 0.08 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.748 -178.652 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.582 ' N ' ' CG ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -51.79 75.86 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.664 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.593 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 93.4 -21.77 38.83 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 114.666 0.626 . . . . 0.0 114.666 178.397 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.571 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER 161.23 -164.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 117.42 0.61 . . . . 0.0 110.315 -179.151 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.548 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 m -125.53 102.99 7.63 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.65 0.262 . . . . 0.0 111.319 179.458 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.463 ' O ' ' C ' ' A' ' 14' ' ' ARG . 4.5 p90 -149.83 35.53 0.69 Allowed 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.972 0.415 . . . . 0.0 110.602 178.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.463 ' C ' ' O ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -15.86 127.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.917 -179.895 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 165.36 94.78 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.869 179.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.505 ' HA ' ' HB3' ' A' ' 4' ' ' PHE . 1.2 m -79.74 99.0 7.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.849 0.357 . . . . 0.0 110.927 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.909 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 8.2 m95 . . . . . 0 CA--C 1.53 0.177 0 CA-C-O 120.817 0.342 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.407 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 0.7 OUTLIER -103.47 69.98 1.02 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.804 -179.774 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.449 ' HB2' ' HB3' ' A' ' 16' ' ' CYS . 0.5 OUTLIER 53.33 28.38 7.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.153 0.502 . . . . 0.0 110.667 -179.617 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 49.77 33.78 6.71 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.698 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.588 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -148.95 50.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-O 121.545 0.688 . . . . 0.0 109.923 179.387 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER 179.44 136.21 0.1 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.976 179.854 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.592 ' O ' ' N ' ' A' ' 10' ' ' GLY . 7.7 t80 72.84 -138.97 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -177.877 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.508 ' HD2' ' CE2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -39.37 84.07 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.78 0.324 . . . . 0.0 111.408 179.649 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.592 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 137.98 -69.91 0.49 Allowed Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.788 -0.72 . . . . 0.0 113.191 -179.708 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.517 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 10.9 pt -158.38 -136.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 116.755 0.278 . . . . 0.0 111.031 -179.301 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.588 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER 166.16 90.61 0.0 OUTLIER 'General case' 0 C--N 1.348 0.526 0 C-N-CA 122.324 0.25 . . . . 0.0 110.793 179.992 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.58 ' CE2' ' CG1' ' A' ' 6' ' ' VAL . 0.2 OUTLIER -101.45 25.26 8.56 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 119.37 -0.932 . . . . 0.0 111.956 179.297 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 42.13 95.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.127 178.589 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 167.21 59.01 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.504 179.505 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.449 ' HB3' ' HB2' ' A' ' 4' ' ' PHE . 3.2 p -171.2 34.64 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.955 -179.638 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.809 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.49 ' CE3' ' N ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.33 0 CA-C-O 120.821 0.343 . . . . 0.0 111.897 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 176.64 149.05 0.13 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -179.535 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.402 ' O ' ' HD3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -42.02 -34.32 0.69 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.489 0.661 . . . . 0.0 109.895 179.736 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.58 ' HG3' ' CG ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 169.21 148.11 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.598 179.621 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.475 ' HB ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER 170.05 86.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 121.702 0.763 . . . . 0.0 109.673 -179.575 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.731 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER 32.88 39.99 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.769 -178.002 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.427 ' O ' ' N ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER 171.94 171.95 0.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 113.734 -1.575 . . . . 0.0 108.868 179.875 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.481 ' HB3' ' CD1' ' A' ' 2' ' ' TRP . 1.0 OUTLIER 32.39 37.23 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.526 0.516 . . . . 0.0 111.475 179.304 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.494 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 154.3 -73.03 0.26 Allowed Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.631 -179.865 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.691 ' O ' ' N ' ' A' ' 7' ' ' CYS . 1.3 pp -173.27 173.84 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 CA-C-N 116.763 0.282 . . . . 0.0 111.113 -179.333 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.731 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -71.55 66.47 0.5 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.936 0.398 . . . . 0.0 111.624 179.641 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.58 ' CG ' ' HG3' ' A' ' 5' ' ' ARG . 1.5 t80 -73.96 134.79 43.17 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.06 178.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 49.81 0.92 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.477 -179.786 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.7 -85.32 0.06 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.006 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.475 ' HB2' ' HB ' ' A' ' 6' ' ' VAL . 51.9 t 54.74 -100.89 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.457 0.17 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.0 mmm180 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.119 179.938 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.432 ' O ' HG13 ' A' ' 6' ' ' VAL . 5.4 m0 . . . . . 0 CA--C 1.543 0.675 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -19.4 139.91 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.927 0.891 . . . . 0.0 113.396 -178.317 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.441 ' CB ' ' O ' ' A' ' 3' ' ' CYS . 11.8 m-85 85.95 149.41 0.06 Allowed 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 -179.741 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.416 ' HG2' ' HG3' ' A' ' 14' ' ' ARG . 23.0 mtt180 -74.54 57.88 0.75 Allowed 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.83 0.824 . . . . 0.0 110.014 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.433 HG22 ' HB3' ' A' ' 8' ' ' TYR . 0.9 OUTLIER -74.58 -7.12 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.212 179.538 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 13.0 m 43.05 57.33 3.73 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.684 0.754 . . . . 0.0 111.08 179.707 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.595 ' C ' ' CD1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -106.89 174.68 5.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.436 -1.257 . . . . 0.0 108.93 179.021 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.574 ' HB2' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 39.8 35.31 0.21 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.523 0.678 . . . . 0.0 110.97 178.154 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.64 48.65 75.55 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 115.221 -0.899 . . . . 0.0 113.97 179.534 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.437 HD11 HG23 ' A' ' 11' ' ' ILE . 0.0 OUTLIER 177.98 127.52 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 117.373 0.587 . . . . 0.0 111.617 179.651 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 83.1 m -72.16 69.83 0.78 Allowed 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.422 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.425 ' O ' ' HG2' ' A' ' 14' ' ' ARG . 46.6 t80 -41.21 146.37 0.19 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.461 -178.724 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.533 ' O ' ' CG ' ' A' ' 15' ' ' ARG . 2.0 mmt85 -171.13 79.38 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.027 -179.513 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.533 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER 169.32 73.36 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 120.706 0.288 . . . . 0.0 110.929 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -104.43 170.26 8.0 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.935 0.398 . . . . 0.0 111.455 -179.778 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.827 179.795 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.449 ' CD1' ' HG3' ' A' ' 9' ' ' ARG . 99.0 m95 . . . . . 0 CA--C 1.531 0.229 0 CA-C-O 120.662 0.268 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.447 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 1.5 m 64.77 102.92 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.058 179.679 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.447 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 11.3 t80 171.93 -18.11 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.813 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 44.7 mtp85 62.6 72.28 0.5 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.119 0.485 . . . . 0.0 109.879 -179.218 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.501 HG11 ' CE1' ' A' ' 8' ' ' TYR . 1.5 p -124.63 -24.35 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.937 -178.695 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.403 ' HB3' ' O ' ' A' ' 6' ' ' VAL . 42.2 t 67.73 72.33 0.33 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.592 0.234 . . . . 0.0 111.196 179.958 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.635 ' CE1' ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -178.59 -157.36 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.087 179.427 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.635 ' HG2' ' CE1' ' A' ' 8' ' ' TYR . 1.0 OUTLIER 61.54 48.93 5.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.115 0.483 . . . . 0.0 110.062 -178.791 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.416 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 111.61 -35.86 4.5 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.99 -179.535 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.416 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.8 OUTLIER -175.33 -177.44 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.816 0.341 . . . . 0.0 110.74 179.899 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.45 91.0 0.39 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.181 179.551 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -71.31 131.03 42.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.17 0.51 . . . . 0.0 111.793 -179.203 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.46 27.18 0.51 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.18 179.585 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.19 64.05 2.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.003 -179.631 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 t -166.3 163.76 17.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.054 179.851 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.2 mmp_? . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.937 -179.953 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.477 ' CD1' ' HB3' ' A' ' 8' ' ' TYR . 66.8 p-90 . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.541 ' HB3' ' OH ' ' A' ' 13' ' ' TYR . 5.1 t -127.07 -15.37 5.31 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.881 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.551 ' N ' ' OH ' ' A' ' 13' ' ' TYR . 11.2 t80 -160.43 -76.17 0.06 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.89 0.376 . . . . 0.0 110.488 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.415 ' O ' ' HB ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER 178.33 26.66 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.915 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.437 HG12 ' CD1' ' A' ' 13' ' ' TYR . 7.5 p -178.7 57.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 179.309 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.629 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 51.8 t -146.73 155.94 42.78 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.938 0.399 . . . . 0.0 111.229 177.271 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.666 ' O ' ' N ' ' A' ' 10' ' ' GLY . 30.8 t80 68.82 -70.65 0.13 Allowed 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -177.916 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -52.95 66.61 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.543 179.173 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.666 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 67.13 29.62 74.71 Favored Glycine 0 CA--C 1.52 0.398 0 CA-C-N 115.848 -0.615 . . . . 0.0 114.25 179.327 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.531 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 178.71 -169.37 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 117.769 0.784 . . . . 0.0 111.709 179.94 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.629 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 2.6 t 178.71 144.43 0.13 Allowed 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 122.331 1.062 . . . . 0.0 113.761 177.883 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.575 ' CE1' ' HB2' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -105.64 -171.06 1.84 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.12 -1.854 . . . . 0.0 106.67 176.78 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 13' ' ' TYR . 4.0 mmp_? -145.08 63.49 1.29 Allowed 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.726 179.391 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ARG . 7.7 tmm_? -130.72 -76.18 0.53 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.808 179.909 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.4 m 50.8 -87.79 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.435 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.418 ' N ' ' O ' ' A' ' 15' ' ' ARG . 59.3 ttp85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.329 -0.844 . . . . 0.0 111.016 -179.988 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.474 ' HB2' ' CE2' ' A' ' 8' ' ' TYR . 29.1 m95 . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.2 p 179.27 57.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.068 0.461 . . . . 0.0 110.327 179.541 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.4 ' O ' ' C ' ' A' ' 5' ' ' ARG . 17.6 t80 70.88 33.29 2.2 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.677 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.404 ' HA ' ' HE1' ' A' ' 8' ' ' TYR . 3.3 ptp180 34.55 77.24 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.194 -179.831 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.489 HG21 ' HA ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -118.6 -86.09 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -178.878 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.656 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.5 OUTLIER -90.03 86.08 6.49 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -177.723 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.488 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 153.89 -111.43 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.343 0.657 . . . . 0.0 111.134 177.48 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.514 ' CG ' ' O ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -26.8 108.46 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.311 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.07 -60.56 4.4 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 121.008 -0.615 . . . . 0.0 113.529 179.47 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.48 149.39 9.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.236 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.656 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -86.01 99.81 11.71 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 120.095 -0.642 . . . . 0.0 112.17 -179.207 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -92.04 105.69 17.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.355 178.914 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 -52.12 93.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.622 -179.237 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -172.15 -88.47 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.845 179.375 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.489 ' HA ' HG21 ' A' ' 6' ' ' VAL . 35.6 t 40.52 -93.62 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 179.668 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.936 -179.87 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.043 0 CA-C-O 120.844 0.354 . . . . 0.0 110.995 . . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.467 ' O ' ' HB3' ' A' ' 4' ' ' PHE . 4.7 t 67.86 -68.73 0.16 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.528 -179.816 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER 174.22 -33.32 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.23 179.487 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.429 ' CD ' ' CD1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 168.05 125.65 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.312 179.901 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.418 ' O ' ' O ' ' A' ' 11' ' ' ILE . 3.0 m -159.97 171.02 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.147 -179.927 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.3 OUTLIER -40.24 135.44 1.43 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.153 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.565 ' CG ' ' N ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 73.4 179.35 0.22 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.264 -179.823 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.565 ' N ' ' CG ' ' A' ' 8' ' ' TYR . 0.4 OUTLIER 50.31 35.46 10.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 111.518 -179.313 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.405 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 129.68 -58.96 0.7 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.361 -0.923 . . . . 0.0 113.964 179.089 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.418 ' O ' ' O ' ' A' ' 6' ' ' VAL . 1.1 pt -157.22 -159.0 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 117.045 0.423 . . . . 0.0 110.968 -179.076 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 12.0 t -133.28 137.56 46.07 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 121.481 0.658 . . . . 0.0 112.021 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.431 ' O ' ' N ' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -145.05 83.68 1.69 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.368 179.427 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.2 mtm-85 -61.55 76.77 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.422 -178.945 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' A' ' 13' ' ' TYR . 34.5 mtt-85 -162.51 -96.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.632 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.6 t 42.99 84.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.754 0.312 . . . . 0.0 111.428 179.758 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.926 179.9 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.8 m95 . . . . . 0 N--CA 1.464 0.266 0 CA-C-O 120.643 0.259 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.3 t -58.99 -20.87 56.94 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.127 179.896 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.455 ' CD2' ' CB ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -170.22 170.64 7.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.078 0.466 . . . . 0.0 111.233 179.971 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 7' ' ' CYS . 4.0 mtt85 -113.6 60.18 0.66 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.413 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.419 HG13 ' CE2' ' A' ' 4' ' ' PHE . 15.6 m -63.93 71.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.3 0.572 . . . . 0.0 111.926 -179.284 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 98.5 m 67.74 52.21 0.76 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.46 179.422 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.432 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 178.77 -176.21 0.23 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.184 178.927 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.432 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 15.7 mmm180 37.24 34.51 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.615 -179.604 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.84 -72.05 0.37 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.121 179.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.422 HG21 HD12 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -156.76 -161.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.65 0.225 . . . . 0.0 111.128 -179.603 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 5.6 m -93.38 134.98 35.05 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.051 0.453 . . . . 0.0 111.167 179.604 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.29 171.12 14.86 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.317 -179.767 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 -155.96 48.05 0.49 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.98 0.419 . . . . 0.0 110.963 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -179.99 132.15 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.886 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.455 ' CB ' ' CD2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -126.25 154.46 43.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.712 179.931 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.921 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.465 ' CE3' ' O ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.231 0 CA-C-O 120.66 0.266 . . . . 0.0 110.854 . . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.639 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 43.4 t 179.68 122.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.549 179.718 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.639 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 92.4 m-85 90.03 -44.65 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.916 -179.386 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 47.71 55.52 8.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.168 -179.919 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.45 HG13 ' C ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -104.44 119.94 54.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.658 0.742 . . . . 0.0 112.447 -178.786 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.625 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 82.7 m 65.22 38.53 5.91 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.587 -1.188 . . . . 0.0 110.067 179.862 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.409 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 18.6 t80 -178.45 170.04 1.72 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.814 -1.084 . . . . 0.0 109.99 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.409 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 22.7 mmt180 34.63 36.97 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.516 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.429 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 148.28 -72.33 0.3 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.079 -179.914 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.429 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 179.31 -169.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 116.652 0.226 . . . . 0.0 110.779 -179.419 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.625 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 57.8 m -93.06 92.94 8.05 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.053 0.454 . . . . 0.0 111.0 179.885 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.581 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 0.8 OUTLIER -137.29 99.45 3.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.596 179.676 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.03 115.48 18.73 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.069 -177.97 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.438 ' HG3' ' CE2' ' A' ' 13' ' ' TYR . 1.0 OUTLIER 167.1 87.44 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.775 179.266 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.462 ' HB2' ' CG ' ' A' ' 4' ' ' PHE . 23.0 t -119.67 135.47 54.81 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.741 -179.989 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.833 -179.975 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.549 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.1 OUTLIER . . . . . 0 CA--C 1.538 0.491 0 CA-C-O 119.908 -0.091 . . . . 0.0 111.241 . . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.423 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 39.0 t -47.02 130.04 12.21 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.846 0.355 . . . . 0.0 111.018 179.994 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.48 ' O ' ' CD1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -77.85 150.62 34.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.459 -179.951 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.656 ' HA ' ' CD2' ' A' ' 13' ' ' TYR . 0.7 OUTLIER 47.18 81.78 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.107 -179.914 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.724 ' N ' ' HB3' ' A' ' 13' ' ' TYR . 2.5 p 173.14 166.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.81 -176.945 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.512 ' HA ' ' N ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -57.45 88.48 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.676 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.452 ' CD2' ' O ' ' A' ' 6' ' ' VAL . 8.6 p90 -135.74 153.04 51.69 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.395 0.617 . . . . 0.0 112.558 -178.931 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.431 ' HG3' ' N ' ' A' ' 10' ' ' GLY . 6.1 ptm180 39.06 -161.1 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.377 179.239 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.431 ' N ' ' HG3' ' A' ' 9' ' ' ARG . . . -47.78 -21.3 1.46 Allowed Glycine 0 CA--C 1.52 0.368 0 CA-C-N 115.781 -0.645 . . . . 0.0 114.525 -179.069 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.456 ' O ' ' CG1' ' A' ' 11' ' ' ILE . 1.5 pp -116.19 102.77 14.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 117.918 0.859 . . . . 0.0 111.824 -179.555 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.21 95.73 0.78 Allowed 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.301 179.596 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.724 ' HB3' ' N ' ' A' ' 6' ' ' VAL . 2.4 t80 -85.36 -165.37 1.2 Allowed 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.584 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.434 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 21.6 mtm-85 -156.77 114.53 3.21 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 119.994 -0.682 . . . . 0.0 112.233 -179.698 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 171.56 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.967 179.241 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.417 ' HB2' ' CG2' ' A' ' 6' ' ' VAL . 0.6 OUTLIER 51.22 -163.76 0.06 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.506 -179.956 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.893 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.789 0.328 . . . . 6.8700000000000001 111.257 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 15.6 m95 -83.68 -154.85 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.102 -0.499 . . . . 7.0700000000000003 110.572 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 t -45.0 -29.91 0.93 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.799 0.333 . . . . 2.77 111.137 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.406 ' O ' ' CD ' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 169.23 -3.86 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.173 -0.467 . . . . 7.6100000000000003 111.891 179.713 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.406 ' CD ' ' O ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 38.14 43.17 0.55 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.021 0.439 . . . . 8.9700000000000006 111.311 -179.728 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 34.8 m -52.31 119.74 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.875 -0.602 . . . . 3.8799999999999999 111.262 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.476 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 74.2 m 66.03 41.14 3.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.912 -0.585 . . . . 2.7200000000000002 110.102 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.421 ' CE2' ' HG2' ' A' ' 9' ' ' ARG . 79.0 t80 -175.27 167.01 3.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.578 -0.737 . . . . 5.9100000000000001 110.378 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.421 ' HG2' ' CE2' ' A' ' 8' ' ' TYR . 0.3 OUTLIER 35.23 36.89 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.298 -0.41 . . . . 6.2999999999999998 111.685 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.475 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 158.64 -66.42 0.29 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.579 -0.819 . . . . 2.3199999999999998 112.748 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.475 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 172.84 -178.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 120.864 0.364 . . . . 2.6299999999999999 111.182 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.476 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 1.7 m -77.18 110.11 11.6 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.96 -0.564 . . . . 2.1099999999999999 110.299 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -137.54 68.67 1.41 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 4.1600000000000001 111.519 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -55.49 97.77 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.432 -0.349 . . . . 6.4800000000000004 111.039 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.404 ' O ' ' CD2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 179.21 50.59 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.955 0.407 . . . . 6.1799999999999997 111.099 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.38 -21.27 63.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.329 -0.396 . . . . 2.2400000000000002 111.083 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.246 -0.883 . . . . 8.2400000000000002 110.897 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.789 0.328 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.412 ' N ' ' OH ' ' A' ' 8' ' ' TYR . 0.5 OUTLIER 63.57 15.51 8.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.601 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -50.08 -29.82 9.68 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.306 0.574 . . . . 0.0 110.003 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.462 ' O ' ' CB ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -178.01 -63.54 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.157 -0.928 . . . . 0.0 108.697 179.624 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.462 ' CB ' ' O ' ' A' ' 4' ' ' PHE . 8.3 ptt-85 154.01 45.92 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.173 178.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.507 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 4.5 m -105.65 116.25 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-O 121.369 0.604 . . . . 0.0 111.781 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.657 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 13.5 m 76.57 25.95 0.9 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.879 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.497 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.0 OUTLIER 171.69 -176.06 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.127 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.495 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 15.94 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.51 ' O ' ' CG1' ' A' ' 11' ' ' ILE . . . 131.54 15.8 1.56 Allowed Glycine 0 CA--C 1.524 0.638 0 C-N-CA 120.078 -1.058 . . . . 0.0 114.35 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.51 ' CG1' ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 80.79 -169.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 117.247 0.523 . . . . 0.0 111.434 179.57 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.657 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 1.9 t -122.81 133.08 54.46 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.455 ' CE2' ' HG3' ' A' ' 5' ' ' ARG . 5.8 p90 -147.53 25.81 1.06 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.908 177.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.411 ' N ' HG12 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 33.84 92.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.697 -1.138 . . . . 0.0 112.347 178.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.447 ' O ' HG13 ' A' ' 6' ' ' VAL . 0.3 OUTLIER 176.65 156.7 0.27 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.405 ' N ' ' HG3' ' A' ' 15' ' ' ARG . 40.2 t -145.64 84.25 1.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.658 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.969 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.859 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.507 ' O ' ' N ' ' A' ' 3' ' ' CYS . 21.2 mttp . . . . . 0 N--CA 1.479 0.99 0 CA-C-O 120.668 0.271 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.57 ' HB2' ' CZ ' ' A' ' 8' ' ' TYR . 4.0 m0 21.85 45.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.857 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 2' ' ' TRP . 1.8 t 95.25 -71.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.474 ' HB2' HG11 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -119.5 -19.56 8.12 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -177.198 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.606 ' HA ' ' CE1' ' A' ' 8' ' ' TYR . 2.0 mtp180 69.55 41.35 1.27 Allowed 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.726 -0.39 . . . . 0.0 110.187 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.561 ' CG1' ' HA ' ' A' ' 14' ' ' ARG . 28.5 m -90.51 91.31 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -178.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.802 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.8 OUTLIER 76.12 56.26 0.05 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.125 178.439 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.606 ' CE1' ' HA ' ' A' ' 5' ' ' ARG . 31.5 p90 175.0 171.08 0.27 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.794 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.571 ' HD3' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 47.23 21.66 0.2 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.77 0.795 . . . . 0.0 110.751 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 146.69 -62.27 0.45 Allowed Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.981 179.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.416 ' CD1' ' HB2' ' A' ' 13' ' ' TYR . 1.5 pp -170.22 176.52 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 117.51 0.655 . . . . 0.0 112.505 -178.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.802 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -66.99 77.05 0.13 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.163 -0.472 . . . . 0.0 109.997 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.519 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 1.5 t80 -104.76 118.33 36.29 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.97 -178.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.561 ' HA ' ' CG1' ' A' ' 6' ' ' VAL . 0.2 OUTLIER -100.15 126.16 46.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.253 179.496 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.44 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -149.34 -78.14 0.14 Allowed 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.269 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.468 ' N ' ' HB3' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -26.17 136.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.111 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.1 mmp_? . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.923 179.998 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.763 0.316 . . . . 0.0 111.171 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.446 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.1 OUTLIER -152.04 -168.11 2.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.696 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 46.52 38.02 5.04 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.958 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 56.24 -102.66 0.16 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.766 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.6 30.57 1.1 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.152 0.501 . . . . 0.0 110.601 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.517 ' O ' ' N ' ' A' ' 8' ' ' TYR . 3.5 m -83.29 -174.17 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.061 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.604 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 3.6 m -41.09 86.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.725 -179.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.557 ' O ' ' C ' ' A' ' 9' ' ' ARG . 86.3 t80 164.47 162.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.576 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.557 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 1.32 77.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.196 0.598 . . . . 0.0 112.385 179.581 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.45 -77.12 0.29 Allowed Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.054 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.4 pp -158.08 -172.58 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.467 0.175 . . . . 0.0 110.739 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.604 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 16.2 t -134.39 84.29 2.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.758 0.313 . . . . 0.0 111.794 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.51 ' O ' ' O ' ' A' ' 14' ' ' ARG . 7.9 p90 -98.84 12.22 36.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.453 0.645 . . . . 0.0 110.152 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.51 ' O ' ' O ' ' A' ' 13' ' ' TYR . 7.2 mtm-85 41.38 178.76 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.465 -1.243 . . . . 0.0 112.503 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 68.29 59.7 0.41 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.859 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.6 t -82.52 132.68 35.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.787 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.872 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.424 ' HG2' ' CD2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.456 0 CA-C-O 120.695 0.283 . . . . 0.0 111.422 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.429 ' O ' ' C ' ' A' ' 3' ' ' CYS . 5.6 m95 -94.01 -161.85 0.89 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.614 -0.267 . . . . 0.0 111.323 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.429 ' C ' ' O ' ' A' ' 2' ' ' TRP . 1.0 OUTLIER -25.52 -53.96 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.033 -0.531 . . . . 0.0 112.429 -179.773 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.566 ' CE2' ' CE1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 179.45 -32.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.715 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.472 ' HD2' ' HB2' ' A' ' 9' ' ' ARG . 5.7 mtm-85 62.87 115.96 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.969 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.518 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 2.6 m -118.65 86.65 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.014 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.637 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 64.6 m 93.37 44.15 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.295 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.433 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 7.6 t80 -179.88 165.82 1.27 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.446 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.472 ' HB2' ' HD2' ' A' ' 5' ' ' ARG . 2.8 ptt180 31.46 38.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.285 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.414 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 156.55 -68.63 0.29 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.207 -0.997 . . . . 0.0 113.529 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.414 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 177.94 -178.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 120.522 0.201 . . . . 0.0 111.146 -179.396 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.637 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 15.2 m -82.12 65.8 7.42 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.375 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.566 ' CE1' ' CE2' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -63.48 -154.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.838 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.607 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER 162.69 109.2 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.421 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.607 ' HB2' ' O ' ' A' ' 14' ' ' ARG . 6.2 mmp_? 110.03 78.64 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.562 0.745 . . . . 0.0 111.301 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.405 ' HA ' ' CG ' ' A' ' 4' ' ' PHE . 29.7 t -69.59 -80.46 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.006 0.431 . . . . 0.0 110.655 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.335 -0.84 . . . . 0.0 110.921 179.914 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.723 0.297 . . . . 0.0 111.079 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.427 ' CE2' ' HG2' ' A' ' 9' ' ' ARG . 10.9 m-90 -53.01 -81.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.291 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB3' ' CG2' ' A' ' 6' ' ' VAL . 2.7 t -144.47 65.84 1.28 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.776 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.48 ' CD1' ' OH ' ' A' ' 13' ' ' TYR . 1.6 t80 57.47 21.03 6.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.9 mtm-85 62.7 38.62 11.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.767 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.518 ' CG1' ' CE2' ' A' ' 13' ' ' TYR . 1.5 m -77.16 -104.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.966 -0.294 . . . . 0.0 110.425 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.2 m -77.26 146.78 36.67 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 122.161 -0.337 . . . . 0.0 110.2 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.501 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 49.2 p90 49.7 176.61 0.01 OUTLIER 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.984 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.427 ' HG2' ' CE2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 34.28 34.73 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.974 0.416 . . . . 0.0 111.259 -179.189 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.473 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 166.59 -64.11 0.21 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.491 -179.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.473 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER -178.04 -104.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 179.765 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.0 OUTLIER 168.35 62.64 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.637 0.256 . . . . 0.0 110.713 -179.631 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.533 ' O ' ' CD1' ' A' ' 13' ' ' TYR . 7.0 p90 -98.88 27.95 4.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.511 0.672 . . . . 0.0 110.779 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 44.61 -165.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.601 178.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.95 46.42 1.22 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.074 0.464 . . . . 0.0 110.695 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.1 t -100.83 -77.11 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.803 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.897 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.7 tttt . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.75 0.31 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.466 ' CE2' ' CB ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -62.38 89.23 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.607 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -103.73 -76.06 0.6 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.228 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.438 ' CE1' ' HD3' ' A' ' 14' ' ' ARG . 1.4 t80 -94.47 -34.16 12.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.129 0.49 . . . . 0.0 110.827 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.52 ' O ' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -89.58 32.09 0.89 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.802 178.886 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.457 ' CG2' ' CE1' ' A' ' 13' ' ' TYR . 10.1 p -60.07 -4.48 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 8' ' ' TYR . 0.5 OUTLIER -66.36 66.18 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.528 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.52 ' CE1' ' O ' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 175.01 -94.42 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 178.643 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.508 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 13.1 mmp_? -62.4 79.23 0.02 OUTLIER 'General case' 0 C--O 1.233 0.228 0 CA-C-O 120.984 0.421 . . . . 0.0 109.889 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 116.56 48.06 0.48 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.539 -0.624 . . . . 0.0 111.539 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.411 ' CD1' ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 45.82 -168.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-O 120.629 0.252 . . . . 0.0 111.569 -179.56 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.3 m -105.35 128.5 53.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.03 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.49 ' CD2' ' O ' ' A' ' 13' ' ' TYR . 7.5 p90 -172.24 44.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.264 0.554 . . . . 0.0 111.048 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.438 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 61.2 mtt85 -34.05 110.59 0.09 Allowed 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.948 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -160.18 73.09 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.71 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t -131.55 132.21 43.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.628 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.939 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.0 mmtp . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.709 0.29 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 62.37 155.15 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.923 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER 178.79 -68.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.43 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -166.22 35.74 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.325 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 65.04 34.58 8.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.639 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.436 ' O ' ' O ' ' A' ' 11' ' ' ILE . 16.5 m -66.87 178.42 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.515 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 20.3 m -35.5 129.41 0.56 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.048 0.451 . . . . 0.0 111.647 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.434 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 1.3 t80 82.85 -175.53 0.03 OUTLIER 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.829 -178.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 37.56 37.26 0.1 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.801 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.411 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 137.83 -70.6 0.48 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.434 -0.889 . . . . 0.0 113.318 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.436 ' O ' ' O ' ' A' ' 6' ' ' VAL . 1.4 pt -157.59 -163.9 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.67 0.235 . . . . 0.0 111.084 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 m -113.44 123.16 49.38 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-O 121.212 0.529 . . . . 0.0 111.321 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -153.11 54.21 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.428 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -45.54 114.06 0.69 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.572 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 17' ' ' ARG . 17.5 tpp85 -178.52 -91.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.716 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.9 t 43.91 -92.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.63 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 15' ' ' ARG . 5.7 tmm_? . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.791 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.804 0.335 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 7.3 p-90 -164.03 -43.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.127 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.9 t -134.19 -79.68 0.46 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.953 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.536 ' O ' ' C ' ' A' ' 5' ' ' ARG . 1.5 p90 -147.09 -48.78 0.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.293 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.536 ' C ' ' O ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 4.94 89.14 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.491 -179.702 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.563 HG12 ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -54.22 -167.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.437 -179.542 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.61 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 64.2 m -19.39 87.28 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.795 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.726 ' O ' ' N ' ' A' ' 10' ' ' GLY . 54.1 t80 -177.33 -86.46 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.017 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.3 mmt-85 -48.27 70.13 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.92 0.39 . . . . 0.0 111.705 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.726 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 58.84 12.47 14.79 Favored Glycine 0 CA--C 1.521 0.428 0 CA-C-N 116.122 -0.49 . . . . 0.0 113.496 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.605 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.9 OUTLIER 166.68 -177.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-N 117.225 0.512 . . . . 0.0 111.32 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.64 ' O ' ' HB3' ' A' ' 13' ' ' TYR . 3.1 m -106.71 -158.56 0.66 Allowed 'General case' 0 C--O 1.23 0.05 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.197 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.64 ' HB3' ' O ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER 107.0 152.03 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.458 1.103 . . . . 0.0 111.034 179.71 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.483 ' HA ' ' HB2' ' A' ' 4' ' ' PHE . 6.9 mtp180 -150.17 110.22 4.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.327 -178.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -126.36 -82.13 0.62 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.925 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 15' ' ' ARG . 1.2 m 20.16 -89.05 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.272 0.629 . . . . 0.0 112.528 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.9 ptp85 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.481 179.903 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.949 0.404 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.409 ' CZ2' ' HG2' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -68.89 -165.25 0.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.485 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' ' CB ' ' A' ' 4' ' ' PHE . 7.6 t -48.65 -23.83 1.15 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.441 0.163 . . . . 0.0 111.386 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.473 ' CB ' ' O ' ' A' ' 3' ' ' CYS . 0.6 OUTLIER 85.42 97.96 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.972 179.85 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.41 ' C ' ' CG2' ' A' ' 6' ' ' VAL . 0.0 OUTLIER -90.97 49.62 1.67 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.503 179.592 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.435 ' O ' ' C ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 47.49 -178.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.456 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.627 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 90.8 m 19.86 59.21 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 114.963 -1.017 . . . . 0.0 113.018 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.467 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 3.1 t80 174.38 170.77 0.23 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.314 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 mmt180 43.57 26.49 0.12 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.166 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.415 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 147.3 -63.55 0.43 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 119.958 -1.115 . . . . 0.0 113.923 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.415 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -174.17 -172.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 117.057 0.428 . . . . 0.0 111.661 -178.91 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.627 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 21.5 m -99.71 103.54 15.21 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.898 0.38 . . . . 0.0 111.699 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.607 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 1.2 p90 -139.84 95.54 2.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.492 0.663 . . . . 0.0 110.019 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -66.38 94.28 0.26 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.359 -178.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.87 70.06 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.035 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.2 -28.01 9.26 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.759 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.965 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 120.783 0.325 . . . . 0.0 111.042 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.471 ' O ' ' N ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 63.52 -81.74 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.197 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.433 ' HB3' ' CD1' ' A' ' 4' ' ' PHE . 56.7 m 43.27 -89.65 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.471 ' N ' ' O ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -164.13 48.09 0.12 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.247 0.546 . . . . 0.0 109.635 179.101 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 4' ' ' PHE . 15.2 mtm-85 81.55 56.63 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.805 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.498 ' CG1' ' CE2' ' A' ' 13' ' ' TYR . 26.8 m -111.87 -139.31 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.395 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -54.11 149.31 9.64 Favored 'General case' 0 CA--C 1.52 -0.206 0 O-C-N 122.049 -0.407 . . . . 0.0 110.776 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.528 ' O ' ' N ' ' A' ' 10' ' ' GLY . 5.2 t80 72.21 -136.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.424 ' HD2' ' CD2' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -39.29 89.55 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.856 0.36 . . . . 0.0 111.174 179.395 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 135.48 -70.78 0.5 Allowed Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.503 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.508 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -179.71 -100.36 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 O-C-N 122.97 -0.135 . . . . 0.0 111.167 179.921 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 176.25 62.81 0.01 OUTLIER 'General case' 0 C--N 1.342 0.253 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.662 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.543 ' O ' ' CD1' ' A' ' 13' ' ' TYR . 1.5 p90 -102.49 96.55 6.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.721 0.772 . . . . 0.0 109.316 178.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -57.02 117.05 3.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.716 -178.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 1.5 mmm180 -159.08 -91.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.54 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.437 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 31.69 61.85 0.28 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 111.939 179.547 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.936 -179.91 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.431 ' N ' ' CD1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.307 0 CA-C-O 120.776 0.322 . . . . 0.0 111.16 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.416 ' CH2' ' HG3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -44.18 -38.23 3.62 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.131 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 t 177.43 122.55 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.644 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.482 ' C ' ' HG2' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 54.22 -165.3 0.09 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.98 -179.41 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.482 ' HG2' ' C ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 45.07 40.04 4.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.015 0.436 . . . . 0.0 110.401 179.564 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.411 ' CG1' ' O ' ' A' ' 13' ' ' TYR . 31.0 m -40.77 162.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.413 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.619 ' HA ' ' O ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER 74.23 143.23 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.817 -179.662 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.56 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 35.1 t80 97.27 173.5 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.798 -178.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.411 ' HB3' ' NZ ' ' A' ' 1' ' ' LYS . 0.0 OUTLIER 35.3 37.71 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.984 179.825 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.421 ' C ' HG13 ' A' ' 11' ' ' ILE . . . 154.48 -68.64 0.3 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.251 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.619 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -173.06 -89.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 116.748 0.274 . . . . 0.0 111.562 -179.545 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -168.13 120.93 0.87 Allowed 'General case' 0 CA--C 1.522 -0.107 0 CA-C-O 120.747 0.308 . . . . 0.0 110.321 179.699 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.431 ' CD1' ' N ' ' A' ' 1' ' ' LYS . 0.2 OUTLIER -99.76 175.29 5.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.413 179.899 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.406 ' HD3' ' N ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -151.13 26.65 0.7 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.619 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.22 122.38 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.6 t -77.87 64.12 3.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.974 0.416 . . . . 0.0 110.828 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 ptp85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.862 179.952 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.835 0.35 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.483 ' HB2' ' CE2' ' A' ' 8' ' ' TYR . 87.8 m95 -68.63 -8.01 38.27 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.101 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.57 ' O ' ' HG2' ' A' ' 5' ' ' ARG . 1.6 t 69.6 -57.76 0.53 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 122.147 0.179 . . . . 0.0 111.401 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.425 ' O ' ' O ' ' A' ' 15' ' ' ARG . 0.1 OUTLIER -43.32 -30.02 0.47 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.77 0.319 . . . . 0.0 111.682 -179.447 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.579 ' HA ' ' CD2' ' A' ' 8' ' ' TYR . 4.0 ptp180 37.73 35.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.746 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.496 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 1.7 m -109.22 77.77 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.452 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.655 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 62.0 m 83.45 44.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.487 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.589 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.0 OUTLIER -147.81 147.13 29.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.722 -1.127 . . . . 0.0 109.004 179.089 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.53 ' HB2' ' CD1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 33.59 -85.68 0.0 OUTLIER 'General case' 0 CA--C 1.522 -0.105 0 CA-C-O 121.647 0.737 . . . . 0.0 111.895 179.312 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . -51.64 -75.27 0.23 Allowed Glycine 0 C--N 1.297 -1.623 0 CA-C-N 114.348 -1.297 . . . . 0.0 113.571 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.458 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -177.35 -174.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-N 116.823 0.312 . . . . 0.0 111.401 -179.063 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.655 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 23.8 m -84.13 60.0 5.65 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.252 0.548 . . . . 0.0 109.651 178.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.462 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 2.6 t80 -87.27 105.02 16.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.792 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.471 ' HA ' HG12 ' A' ' 6' ' ' VAL . 36.4 mtp85 -66.59 64.48 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.859 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.428 ' O ' ' CG ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER 170.04 -163.49 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.259 179.585 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -145.06 56.88 1.26 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.919 0.39 . . . . 0.0 110.666 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.93 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 9' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.788 0.327 . . . . 0.0 111.257 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.422 ' CD1' ' HG3' ' A' ' 5' ' ' ARG . 4.5 m95 43.38 -163.25 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.058 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -69.16 -54.97 12.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.914 0.387 . . . . 0.0 110.149 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -140.59 -58.5 0.52 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.368 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.422 ' HG3' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 47.54 93.76 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.81 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.535 ' O ' ' C ' ' A' ' 7' ' ' CYS . 0.9 OUTLIER -55.0 -174.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.101 -179.694 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.637 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 98.9 m 0.72 71.97 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.607 0.763 . . . . 0.0 112.671 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.484 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 177.71 -165.21 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.081 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.479 ' C ' ' O ' ' A' ' 8' ' ' TYR . 4.5 mmm-85 -17.52 83.66 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.568 0 O-C-N 123.692 0.62 . . . . 0.0 112.557 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.484 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 124.07 -78.1 0.36 Allowed Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.792 -0.718 . . . . 0.0 113.177 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.467 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.9 OUTLIER -170.99 -172.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 122.18 0.192 . . . . 0.0 110.584 -179.424 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.637 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 72.4 m -92.92 73.97 4.82 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 120.775 0.322 . . . . 0.0 110.192 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.498 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -112.24 108.93 18.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.118 0.485 . . . . 0.0 111.977 -179.649 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.531 ' HA ' ' CG1' ' A' ' 6' ' ' VAL . 3.6 mtt180 -76.42 101.35 5.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.239 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.51 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 170.22 -157.55 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.177 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.427 ' HA ' ' HB2' ' A' ' 4' ' ' PHE . 0.8 OUTLIER 169.05 -30.23 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.916 0.389 . . . . 0.0 110.854 179.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.916 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.862 0.363 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.472 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 11.7 m0 64.29 20.37 12.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.267 0.556 . . . . 0.0 110.868 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.477 ' C ' ' SG ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER 173.79 -46.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.018 179.275 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.86 48.52 1.23 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.548 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.424 ' NH1' ' CE2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -94.32 36.41 1.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.001 179.545 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.527 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 27.1 m -75.14 72.51 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.798 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.667 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 70.9 m 98.93 42.27 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.05 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.46 ' O ' ' N ' ' A' ' 10' ' ' GLY . 28.7 t80 -155.43 -111.28 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.041 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.52 89.39 0.0 OUTLIER 'General case' 0 C--O 1.231 0.129 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.557 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 103.42 -48.68 1.0 Allowed Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.667 -0.777 . . . . 0.0 113.884 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.557 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER 162.39 -174.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 116.966 0.383 . . . . 0.0 110.748 -178.87 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.667 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 14.8 m -67.22 86.53 0.16 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.985 0.421 . . . . 0.0 110.81 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.477 ' O ' ' CG ' ' A' ' 14' ' ' ARG . 2.5 t80 -91.13 171.72 9.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.47 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.477 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 13.6 mtt-85 -163.99 96.37 0.81 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.614 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.469 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -175.58 -78.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.477 ' SG ' ' C ' ' A' ' 3' ' ' CYS . 1.8 m 70.59 12.46 7.34 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.378 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.42 ' HG3' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.324 -0.846 . . . . 0.0 111.853 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.738 0.304 . . . . 0.0 111.129 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -55.82 -170.75 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.018 0.437 . . . . 0.0 111.112 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.0 t -52.74 165.74 0.25 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.117 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -41.35 -31.33 0.23 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.056 0.455 . . . . 0.0 111.138 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -71.88 92.12 1.23 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.045 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.449 ' O ' ' C ' ' A' ' 7' ' ' CYS . 8.5 m -52.33 -16.22 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.725 -179.101 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.619 ' O ' ' CB ' ' A' ' 8' ' ' TYR . 1.8 m -29.89 105.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.635 0.255 . . . . 0.0 111.146 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.619 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 42.0 t80 107.87 177.69 0.0 OUTLIER 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.537 -178.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.94 38.52 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.196 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.433 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 149.99 -72.56 0.29 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.179 -1.01 . . . . 0.0 113.436 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.433 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 9.3 pt -158.9 -167.2 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 116.684 0.242 . . . . 0.0 111.178 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -119.81 134.39 55.25 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.305 0.574 . . . . 0.0 112.001 -179.857 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.417 ' N ' HG22 ' A' ' 6' ' ' VAL . 0.3 OUTLIER -112.16 -164.61 0.93 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.188 -0.915 . . . . 0.0 108.823 178.213 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 59.0 mtp180 -155.52 91.11 1.29 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.069 0.462 . . . . 0.0 111.229 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.09 -86.42 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.846 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t 45.18 -92.03 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.559 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.9 mtp85 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.856 -179.953 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.695 0.283 . . . . 0.0 111.38 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.429 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 51.43 49.73 20.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.854 0.359 . . . . 0.0 110.879 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 90.0 m -135.37 -79.56 0.43 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.379 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -105.24 -21.41 13.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.356 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.453 ' NH1' ' CD2' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -82.3 55.98 3.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.862 0.363 . . . . 0.0 110.879 179.909 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.541 ' O ' ' CB ' ' A' ' 7' ' ' CYS . 2.7 m -58.29 132.93 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.572 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.587 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 71.4 m 108.12 77.74 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.177 0.991 . . . . 0.0 111.307 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.453 ' CD2' ' NH1' ' A' ' 5' ' ' ARG . 42.5 t80 -179.26 -104.85 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.25 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.46 ' O ' ' CZ ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -61.01 83.82 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.067 0 CA-C-O 120.816 0.341 . . . . 0.0 111.798 -179.228 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.469 ' O ' ' CG1' ' A' ' 11' ' ' ILE . . . 89.41 49.87 3.34 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.488 -0.863 . . . . 0.0 113.148 179.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.469 ' CG1' ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 69.17 -167.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.769 0.319 . . . . 0.0 111.788 179.559 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.587 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 19.0 m -88.2 -164.53 1.13 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.331 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.51 ' CD1' ' C ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 74.56 -67.15 0.27 Allowed 'General case' 0 CA--C 1.513 -0.481 0 CA-C-O 121.945 0.879 . . . . 0.0 110.165 -179.616 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.496 ' N ' ' CG ' ' A' ' 13' ' ' TYR . 0.5 OUTLIER 48.08 176.62 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 113.871 -1.513 . . . . 0.0 112.12 178.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.41 129.47 23.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.909 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 t -87.85 114.54 24.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.841 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.905 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 120.704 0.288 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 20.9 m0 59.04 20.58 8.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.279 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.408 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 46.7 t -133.84 -72.52 0.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.751 179.537 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -68.76 -120.52 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.405 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.467 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 0.2 OUTLIER 49.99 -175.32 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.088 0 O-C-N 122.163 -0.336 . . . . 0.0 110.606 -179.715 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.467 ' CG1' ' O ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 174.08 113.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.982 0.42 . . . . 0.0 110.878 179.676 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.0 OUTLIER 67.63 70.56 0.35 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.776 -179.671 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.572 ' O ' ' N ' ' A' ' 10' ' ' GLY . 52.6 t80 -178.22 -73.78 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.839 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -48.64 78.4 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.572 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 53.5 16.17 4.92 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 116.064 -0.516 . . . . 0.0 114.123 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.525 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER 163.96 -179.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 117.294 0.547 . . . . 0.0 110.951 179.73 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 3.4 t -97.81 93.41 6.34 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 121.243 0.544 . . . . 0.0 110.682 179.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.408 ' CD2' ' O ' ' A' ' 3' ' ' CYS . 4.5 t80 -75.73 166.33 23.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.444 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -177.4 64.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.943 179.796 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.2 mpp_? -166.33 81.73 0.27 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.274 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.2 t -161.84 137.94 7.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.915 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.897 179.943 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.696 0.284 . . . . 0.0 111.207 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.472 ' CD1' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -132.23 6.73 4.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.664 179.773 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.472 ' HB3' ' OH ' ' A' ' 8' ' ' TYR . 43.4 t -178.75 66.32 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.93 0.395 . . . . 0.0 110.959 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.427 ' CE2' ' HA ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER 44.78 29.31 0.42 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.661 179.766 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.44 ' HA ' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 42.29 59.66 2.59 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.974 0.416 . . . . 0.0 111.221 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.428 ' CB ' ' HB2' ' A' ' 16' ' ' CYS . 11.2 t -82.97 87.74 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.66 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.566 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER 75.95 48.22 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.92 179.789 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.472 ' CE1' ' CD1' ' A' ' 2' ' ' TRP . 44.9 p90 174.73 176.08 0.17 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.952 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' TYR . 53.0 mtt-85 22.23 48.03 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.691 0.619 . . . . 0.0 112.559 179.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 151.21 -75.35 0.25 Allowed Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.388 -0.911 . . . . 0.0 113.341 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.423 ' O ' ' N ' ' A' ' 7' ' ' CYS . 2.0 pt -159.72 -172.8 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.62 0.21 . . . . 0.0 111.433 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.566 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 8.8 t -109.93 118.15 35.69 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.302 0.572 . . . . 0.0 111.362 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.454 ' O ' ' C ' ' A' ' 14' ' ' ARG . 1.8 t80 -126.15 60.27 1.3 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.457 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.454 ' C ' ' O ' ' A' ' 13' ' ' TYR . 2.2 mtm-85 -22.33 93.76 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.582 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.09 -82.59 0.0 OUTLIER 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.023 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.428 ' HB2' ' CB ' ' A' ' 6' ' ' VAL . 25.7 t 56.76 37.47 28.83 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.017 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.293 -0.86 . . . . 0.0 111.01 179.986 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.941 0.4 . . . . 0.0 111.261 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.495 ' CG ' ' OH ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -85.99 -162.55 0.75 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.845 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 4' ' ' PHE . 97.3 m -39.66 -74.0 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.881 0.372 . . . . 0.0 111.144 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.453 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER 176.36 -29.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.489 179.591 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.622 ' O ' ' CG2' ' A' ' 6' ' ' VAL . 89.6 mtt180 -147.3 -158.29 0.9 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.676 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.622 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.5 m 87.14 -166.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 123.226 0.61 . . . . 0.0 111.116 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.723 ' CA ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -52.88 161.74 0.72 Allowed 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.603 -179.465 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.691 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 8.2 p90 55.07 173.28 0.03 OUTLIER 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.7 OUTLIER 28.55 39.85 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 179.961 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.483 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 162.66 -68.51 0.23 Allowed Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.444 -0.884 . . . . 0.0 113.632 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.565 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -177.43 -90.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 117.125 0.463 . . . . 0.0 111.933 -179.496 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.723 ' HA ' ' CA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -176.05 48.4 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.522 0.677 . . . . 0.0 110.782 179.471 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.417 ' N ' ' HA ' ' A' ' 6' ' ' VAL . 1.0 OUTLIER -80.9 81.81 7.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.072 179.044 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -44.69 99.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.443 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.436 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 176.44 -164.6 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.623 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 41.5 t 174.26 156.41 0.14 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.763 0.316 . . . . 0.0 110.511 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.308 179.972 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.833 0.349 . . . . 0.0 111.178 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 11.9 t90 65.46 38.78 5.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.126 179.937 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.6 t -96.34 -13.36 23.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.999 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.505 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -164.42 -3.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.384 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.405 ' HA ' ' HG3' ' A' ' 9' ' ' ARG . 1.8 mtt-85 48.24 35.71 5.85 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.095 0.474 . . . . 0.0 110.632 -179.472 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.465 ' CG2' ' CE1' ' A' ' 4' ' ' PHE . 23.6 m -86.25 -142.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.289 -179.478 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.548 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.2 m -26.92 130.31 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.467 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.593 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.0 OUTLIER 73.75 -75.3 0.08 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.748 -178.652 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.582 ' N ' ' CG ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -51.79 75.86 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.664 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.593 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 93.4 -21.77 38.83 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 114.666 0.626 . . . . 0.0 114.666 178.397 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.571 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER 161.23 -164.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 117.42 0.61 . . . . 0.0 110.315 -179.151 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.548 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 m -125.53 102.99 7.63 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.65 0.262 . . . . 0.0 111.319 179.458 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.463 ' O ' ' C ' ' A' ' 14' ' ' ARG . 4.5 p90 -149.83 35.53 0.69 Allowed 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.972 0.415 . . . . 0.0 110.602 178.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.463 ' C ' ' O ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -15.86 127.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.917 -179.895 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 165.36 94.78 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.869 179.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.505 ' HA ' ' HB3' ' A' ' 4' ' ' PHE . 1.2 m -79.74 99.0 7.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.849 0.357 . . . . 0.0 110.927 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.909 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.421 ' HB2' ' HG2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.696 0.284 . . . . 0.0 111.619 . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -66.71 -16.26 64.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.817 0.342 . . . . 0.0 111.071 179.879 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.407 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 0.7 OUTLIER -103.47 69.98 1.02 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.804 -179.774 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.449 ' HB2' ' HB3' ' A' ' 16' ' ' CYS . 0.5 OUTLIER 53.33 28.38 7.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.153 0.502 . . . . 0.0 110.667 -179.617 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.421 ' HG2' ' HB2' ' A' ' 1' ' ' LYS . 2.5 mtm180 49.77 33.78 6.71 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.698 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.588 ' O ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -148.95 50.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-O 121.545 0.688 . . . . 0.0 109.923 179.387 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER 179.44 136.21 0.1 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.976 179.854 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.592 ' O ' ' N ' ' A' ' 10' ' ' GLY . 7.7 t80 72.84 -138.97 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -177.877 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.508 ' HD2' ' CE2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -39.37 84.07 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.78 0.324 . . . . 0.0 111.408 179.649 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.592 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 137.98 -69.91 0.49 Allowed Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.788 -0.72 . . . . 0.0 113.191 -179.708 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.517 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 10.9 pt -158.38 -136.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 116.755 0.278 . . . . 0.0 111.031 -179.301 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.588 ' HA ' ' O ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER 166.16 90.61 0.0 OUTLIER 'General case' 0 C--N 1.348 0.526 0 C-N-CA 122.324 0.25 . . . . 0.0 110.793 179.992 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.58 ' CE2' ' CG1' ' A' ' 6' ' ' VAL . 0.2 OUTLIER -101.45 25.26 8.56 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 119.37 -0.932 . . . . 0.0 111.956 179.297 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 42.13 95.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.127 178.589 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 167.21 59.01 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.504 179.505 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.449 ' HB3' ' HB2' ' A' ' 4' ' ' PHE . 3.2 p -171.2 34.64 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.955 -179.638 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.809 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.854 0.359 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.49 ' CE3' ' N ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -45.02 -94.77 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.897 -179.72 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 176.64 149.05 0.13 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -179.535 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.402 ' O ' ' HD3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -42.02 -34.32 0.69 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.489 0.661 . . . . 0.0 109.895 179.736 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.58 ' HG3' ' CG ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 169.21 148.11 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.598 179.621 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.475 ' HB ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER 170.05 86.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 121.702 0.763 . . . . 0.0 109.673 -179.575 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.731 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER 32.88 39.99 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.769 -178.002 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.427 ' O ' ' N ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER 171.94 171.95 0.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 113.734 -1.575 . . . . 0.0 108.868 179.875 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.481 ' HB3' ' CD1' ' A' ' 2' ' ' TRP . 1.0 OUTLIER 32.39 37.23 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.526 0.516 . . . . 0.0 111.475 179.304 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.494 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 154.3 -73.03 0.26 Allowed Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.631 -179.865 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.691 ' O ' ' N ' ' A' ' 7' ' ' CYS . 1.3 pp -173.27 173.84 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 CA-C-N 116.763 0.282 . . . . 0.0 111.113 -179.333 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.731 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -71.55 66.47 0.5 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.936 0.398 . . . . 0.0 111.624 179.641 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.58 ' CG ' ' HG3' ' A' ' 5' ' ' ARG . 1.5 t80 -73.96 134.79 43.17 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.06 178.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 49.81 0.92 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.477 -179.786 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.7 -85.32 0.06 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.006 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.475 ' HB2' ' HB ' ' A' ' 6' ' ' VAL . 51.9 t 54.74 -100.89 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.457 0.17 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.0 mmm180 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.119 179.938 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 120.649 0.261 . . . . 0.0 111.458 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.432 ' O ' HG13 ' A' ' 6' ' ' VAL . 5.4 m0 76.06 -145.61 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 179.142 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -19.4 139.91 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.927 0.891 . . . . 0.0 113.396 -178.317 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.441 ' CB ' ' O ' ' A' ' 3' ' ' CYS . 11.8 m-85 85.95 149.41 0.06 Allowed 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 -179.741 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.416 ' HG2' ' HG3' ' A' ' 14' ' ' ARG . 23.0 mtt180 -74.54 57.88 0.75 Allowed 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.83 0.824 . . . . 0.0 110.014 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.433 HG22 ' HB3' ' A' ' 8' ' ' TYR . 0.9 OUTLIER -74.58 -7.12 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.212 179.538 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 13.0 m 43.05 57.33 3.73 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.684 0.754 . . . . 0.0 111.08 179.707 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.595 ' C ' ' CD1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -106.89 174.68 5.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.436 -1.257 . . . . 0.0 108.93 179.021 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.574 ' HB2' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 39.8 35.31 0.21 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.523 0.678 . . . . 0.0 110.97 178.154 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.64 48.65 75.55 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 115.221 -0.899 . . . . 0.0 113.97 179.534 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.437 HD11 HG23 ' A' ' 11' ' ' ILE . 0.0 OUTLIER 177.98 127.52 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 117.373 0.587 . . . . 0.0 111.617 179.651 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 83.1 m -72.16 69.83 0.78 Allowed 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.422 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.425 ' O ' ' HG2' ' A' ' 14' ' ' ARG . 46.6 t80 -41.21 146.37 0.19 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.461 -178.724 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.533 ' O ' ' CG ' ' A' ' 15' ' ' ARG . 2.0 mmt85 -171.13 79.38 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.027 -179.513 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.533 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER 169.32 73.36 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 120.706 0.288 . . . . 0.0 110.929 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -104.43 170.26 8.0 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.935 0.398 . . . . 0.0 111.455 -179.778 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.827 179.795 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.442 ' HB2' ' CZ ' ' A' ' 13' ' ' TYR . 37.1 mttm . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.614 0.245 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.449 ' CD1' ' HG3' ' A' ' 9' ' ' ARG . 99.0 m95 -57.65 -17.87 17.12 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.662 0.268 . . . . 0.0 111.18 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.447 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 1.5 m 64.77 102.92 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.058 179.679 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.447 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 11.3 t80 171.93 -18.11 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.813 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 44.7 mtp85 62.6 72.28 0.5 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.119 0.485 . . . . 0.0 109.879 -179.218 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.501 HG11 ' CE1' ' A' ' 8' ' ' TYR . 1.5 p -124.63 -24.35 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.937 -178.695 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.403 ' HB3' ' O ' ' A' ' 6' ' ' VAL . 42.2 t 67.73 72.33 0.33 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.592 0.234 . . . . 0.0 111.196 179.958 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.635 ' CE1' ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -178.59 -157.36 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.087 179.427 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.635 ' HG2' ' CE1' ' A' ' 8' ' ' TYR . 1.0 OUTLIER 61.54 48.93 5.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.115 0.483 . . . . 0.0 110.062 -178.791 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.416 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 111.61 -35.86 4.5 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.99 -179.535 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.416 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.8 OUTLIER -175.33 -177.44 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.816 0.341 . . . . 0.0 110.74 179.899 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.45 91.0 0.39 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.181 179.551 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.442 ' CZ ' ' HB2' ' A' ' 1' ' ' LYS . 0.9 OUTLIER -71.31 131.03 42.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.17 0.51 . . . . 0.0 111.793 -179.203 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.46 27.18 0.51 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.18 179.585 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.19 64.05 2.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.003 -179.631 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 t -166.3 163.76 17.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.054 179.851 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.2 mmp_? . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.937 -179.953 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.446 ' CB ' ' HA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.534 0.207 . . . . 0.0 111.472 . . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.477 ' CD1' ' HB3' ' A' ' 8' ' ' TYR . 66.8 p-90 -65.59 -20.25 66.24 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.134 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.541 ' HB3' ' OH ' ' A' ' 13' ' ' TYR . 5.1 t -127.07 -15.37 5.31 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.881 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.551 ' N ' ' OH ' ' A' ' 13' ' ' TYR . 11.2 t80 -160.43 -76.17 0.06 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.89 0.376 . . . . 0.0 110.488 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.446 ' HA ' ' CB ' ' A' ' 1' ' ' LYS . 0.0 OUTLIER 178.33 26.66 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.915 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.437 HG12 ' CD1' ' A' ' 13' ' ' TYR . 7.5 p -178.7 57.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 179.309 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.629 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 51.8 t -146.73 155.94 42.78 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.938 0.399 . . . . 0.0 111.229 177.271 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.666 ' O ' ' N ' ' A' ' 10' ' ' GLY . 30.8 t80 68.82 -70.65 0.13 Allowed 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -177.916 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -52.95 66.61 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.543 179.173 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.666 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 67.13 29.62 74.71 Favored Glycine 0 CA--C 1.52 0.398 0 CA-C-N 115.848 -0.615 . . . . 0.0 114.25 179.327 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.531 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 178.71 -169.37 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 117.769 0.784 . . . . 0.0 111.709 179.94 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.629 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 2.6 t 178.71 144.43 0.13 Allowed 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 122.331 1.062 . . . . 0.0 113.761 177.883 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.575 ' CE1' ' HB2' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -105.64 -171.06 1.84 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.12 -1.854 . . . . 0.0 106.67 176.78 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 13' ' ' TYR . 4.0 mmp_? -145.08 63.49 1.29 Allowed 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.726 179.391 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ARG . 7.7 tmm_? -130.72 -76.18 0.53 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.808 179.909 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.4 m 50.8 -87.79 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.435 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.418 ' N ' ' O ' ' A' ' 15' ' ' ARG . 59.3 ttp85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.329 -0.844 . . . . 0.0 111.016 -179.988 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.868 0.366 . . . . 0.0 111.232 . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.474 ' HB2' ' CE2' ' A' ' 8' ' ' TYR . 29.1 m95 -79.21 -1.96 38.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.783 -179.956 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.2 p 179.27 57.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.068 0.461 . . . . 0.0 110.327 179.541 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.4 ' O ' ' C ' ' A' ' 5' ' ' ARG . 17.6 t80 70.88 33.29 2.2 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.677 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.404 ' HA ' ' HE1' ' A' ' 8' ' ' TYR . 3.3 ptp180 34.55 77.24 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.194 -179.831 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.489 HG21 ' HA ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -118.6 -86.09 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -178.878 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.656 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.5 OUTLIER -90.03 86.08 6.49 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -177.723 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.488 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 153.89 -111.43 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.343 0.657 . . . . 0.0 111.134 177.48 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.514 ' CG ' ' O ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -26.8 108.46 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.311 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.07 -60.56 4.4 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 121.008 -0.615 . . . . 0.0 113.529 179.47 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.48 149.39 9.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.236 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.656 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -86.01 99.81 11.71 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 120.095 -0.642 . . . . 0.0 112.17 -179.207 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -92.04 105.69 17.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.355 178.914 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 -52.12 93.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.622 -179.237 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -172.15 -88.47 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.845 179.375 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.489 ' HA ' HG21 ' A' ' 6' ' ' VAL . 35.6 t 40.52 -93.62 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 179.668 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.936 -179.87 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.864 0.364 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.2 OUTLIER -62.19 144.65 55.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.995 -179.9 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.467 ' O ' ' HB3' ' A' ' 4' ' ' PHE . 4.7 t 67.86 -68.73 0.16 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.528 -179.816 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.467 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER 174.22 -33.32 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.23 179.487 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.429 ' CD ' ' CD1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 168.05 125.65 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.312 179.901 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.418 ' O ' ' O ' ' A' ' 11' ' ' ILE . 3.0 m -159.97 171.02 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.147 -179.927 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.3 OUTLIER -40.24 135.44 1.43 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.153 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.565 ' CG ' ' N ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 73.4 179.35 0.22 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.264 -179.823 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.565 ' N ' ' CG ' ' A' ' 8' ' ' TYR . 0.4 OUTLIER 50.31 35.46 10.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 111.518 -179.313 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.405 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 129.68 -58.96 0.7 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.361 -0.923 . . . . 0.0 113.964 179.089 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.418 ' O ' ' O ' ' A' ' 6' ' ' VAL . 1.1 pt -157.22 -159.0 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 117.045 0.423 . . . . 0.0 110.968 -179.076 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 12.0 t -133.28 137.56 46.07 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 121.481 0.658 . . . . 0.0 112.021 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.431 ' O ' ' N ' ' A' ' 15' ' ' ARG . 0.6 OUTLIER -145.05 83.68 1.69 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.368 179.427 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.2 mtm-85 -61.55 76.77 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.422 -178.945 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' A' ' 13' ' ' TYR . 34.5 mtt-85 -162.51 -96.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.632 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.6 t 42.99 84.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.754 0.312 . . . . 0.0 111.428 179.758 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.926 179.9 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 120.646 0.26 . . . . 0.0 111.412 . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.8 m95 43.94 -158.84 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.343 179.769 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.3 t -58.99 -20.87 56.94 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.127 179.896 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.455 ' CD2' ' CB ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -170.22 170.64 7.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.078 0.466 . . . . 0.0 111.233 179.971 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 7' ' ' CYS . 4.0 mtt85 -113.6 60.18 0.66 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.413 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.419 HG13 ' CE2' ' A' ' 4' ' ' PHE . 15.6 m -63.93 71.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.3 0.572 . . . . 0.0 111.926 -179.284 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 98.5 m 67.74 52.21 0.76 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.46 179.422 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.432 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 178.77 -176.21 0.23 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.184 178.927 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.432 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 15.7 mmm180 37.24 34.51 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.615 -179.604 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.84 -72.05 0.37 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.121 179.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.422 HG21 HD12 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -156.76 -161.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.65 0.225 . . . . 0.0 111.128 -179.603 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 5.6 m -93.38 134.98 35.05 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.051 0.453 . . . . 0.0 111.167 179.604 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.29 171.12 14.86 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.317 -179.767 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 -155.96 48.05 0.49 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.98 0.419 . . . . 0.0 110.963 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -179.99 132.15 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.886 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.455 ' CB ' ' CD2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -126.25 154.46 43.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.712 179.931 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.921 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.414 ' HG3' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 111.507 0.188 . . . . 0.0 111.507 . . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.465 ' CE3' ' O ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -94.87 -72.02 0.64 Allowed 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.854 179.391 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.639 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 43.4 t 179.68 122.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.549 179.718 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.639 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 92.4 m-85 90.03 -44.65 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.916 -179.386 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 47.71 55.52 8.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.168 -179.919 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.45 HG13 ' C ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -104.44 119.94 54.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.658 0.742 . . . . 0.0 112.447 -178.786 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.625 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 82.7 m 65.22 38.53 5.91 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.587 -1.188 . . . . 0.0 110.067 179.862 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.409 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 18.6 t80 -178.45 170.04 1.72 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.814 -1.084 . . . . 0.0 109.99 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.409 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 22.7 mmt180 34.63 36.97 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.516 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.429 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 148.28 -72.33 0.3 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.079 -179.914 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.429 ' CG2' ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 179.31 -169.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 116.652 0.226 . . . . 0.0 110.779 -179.419 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.625 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 57.8 m -93.06 92.94 8.05 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.053 0.454 . . . . 0.0 111.0 179.885 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.581 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 0.8 OUTLIER -137.29 99.45 3.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.596 179.676 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.03 115.48 18.73 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.069 -177.97 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.438 ' HG3' ' CE2' ' A' ' 13' ' ' TYR . 1.0 OUTLIER 167.1 87.44 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.775 179.266 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.462 ' HB2' ' CG ' ' A' ' 4' ' ' PHE . 23.0 t -119.67 135.47 54.81 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.741 -179.989 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.833 -179.975 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.6 ttpp . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.85 0.357 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.549 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.1 OUTLIER -178.85 -111.14 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.241 -179.964 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.423 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 39.0 t -47.02 130.04 12.21 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.846 0.355 . . . . 0.0 111.018 179.994 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.48 ' O ' ' CD1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -77.85 150.62 34.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.459 -179.951 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.656 ' HA ' ' CD2' ' A' ' 13' ' ' TYR . 0.7 OUTLIER 47.18 81.78 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.107 -179.914 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.724 ' N ' ' HB3' ' A' ' 13' ' ' TYR . 2.5 p 173.14 166.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.81 -176.945 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.512 ' HA ' ' N ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -57.45 88.48 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.676 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.452 ' CD2' ' O ' ' A' ' 6' ' ' VAL . 8.6 p90 -135.74 153.04 51.69 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.395 0.617 . . . . 0.0 112.558 -178.931 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.431 ' HG3' ' N ' ' A' ' 10' ' ' GLY . 6.1 ptm180 39.06 -161.1 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.377 179.239 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.431 ' N ' ' HG3' ' A' ' 9' ' ' ARG . . . -47.78 -21.3 1.46 Allowed Glycine 0 CA--C 1.52 0.368 0 CA-C-N 115.781 -0.645 . . . . 0.0 114.525 -179.069 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.456 ' O ' ' CG1' ' A' ' 11' ' ' ILE . 1.5 pp -116.19 102.77 14.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 117.918 0.859 . . . . 0.0 111.824 -179.555 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.21 95.73 0.78 Allowed 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.301 179.596 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.724 ' HB3' ' N ' ' A' ' 6' ' ' VAL . 2.4 t80 -85.36 -165.37 1.2 Allowed 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.584 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.434 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 21.6 mtm-85 -156.77 114.53 3.21 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 119.994 -0.682 . . . . 0.0 112.233 -179.698 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 171.56 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.967 179.241 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.417 ' HB2' ' CG2' ' A' ' 6' ' ' VAL . 0.6 OUTLIER 51.22 -163.76 0.06 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.506 -179.956 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.893 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 15.6 m95 . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 120.528 0.204 . . . . 6.1500000000000004 110.572 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 t -45.0 -29.91 0.93 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.799 0.333 . . . . 2.77 111.137 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.406 ' O ' ' CD ' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 169.23 -3.86 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.173 -0.467 . . . . 6.7699999999999996 111.891 179.713 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.406 ' CD ' ' O ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 38.14 43.17 0.55 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.021 0.439 . . . . 8.4199999999999999 111.311 -179.728 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.825 HG12 ' O ' ' A' ' 13' ' ' TYR . 34.8 m -52.31 119.74 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.875 -0.602 . . . . 3.46 111.262 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.486 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 74.2 m 66.03 41.14 3.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.912 -0.585 . . . . 2.5 110.102 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.445 ' CE2' ' HG2' ' A' ' 9' ' ' ARG . 79.0 t80 -175.27 167.01 3.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.578 -0.737 . . . . 5.7300000000000004 110.378 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.445 ' HG2' ' CE2' ' A' ' 8' ' ' TYR . 0.3 OUTLIER 35.23 36.89 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.298 -0.41 . . . . 5.7199999999999998 111.685 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.813 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 158.64 -66.42 0.29 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.579 -0.819 . . . . 1.97 112.748 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.813 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 172.84 -178.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 120.864 0.364 . . . . 2.1299999999999999 111.182 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.486 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 1.7 m -77.18 110.11 11.6 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.96 -0.564 . . . . 2.1099999999999999 110.299 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.825 ' O ' HG12 ' A' ' 6' ' ' VAL . 2.4 t80 -137.54 68.67 1.41 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 4.0 111.519 -179.141 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -55.49 97.77 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.432 -0.349 . . . . 5.7999999999999998 111.039 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.404 ' O ' ' CD2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 179.21 50.59 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.955 0.407 . . . . 5.46 111.099 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.38 -21.27 63.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.329 -0.396 . . . . 2.2400000000000002 111.083 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.246 -0.883 . . . . 7.5700000000000003 110.897 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.749 ' N ' ' HH ' ' A' ' 8' ' ' TYR . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.142 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -50.08 -29.82 9.68 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.306 0.574 . . . . 0.0 110.003 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.462 ' O ' ' CB ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -178.01 -63.54 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.157 -0.928 . . . . 0.0 108.697 179.624 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.473 ' HG3' ' CE2' ' A' ' 13' ' ' TYR . 8.3 ptt-85 154.01 45.92 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.173 178.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.631 HG11 ' N ' ' A' ' 15' ' ' ARG . 4.5 m -105.65 116.25 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-O 121.369 0.604 . . . . 0.0 111.781 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.696 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 13.5 m 76.57 25.95 0.9 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.879 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.749 ' HH ' ' N ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 171.69 -176.06 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.127 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.495 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 15.94 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.616 ' C ' HG23 ' A' ' 11' ' ' ILE . . . 131.54 15.8 1.56 Allowed Glycine 0 CA--C 1.524 0.638 0 C-N-CA 120.078 -1.058 . . . . 0.0 114.35 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.616 HG23 ' C ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 80.79 -169.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 117.247 0.523 . . . . 0.0 111.434 179.57 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.696 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 1.9 t -122.81 133.08 54.46 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.528 ' H ' HG12 ' A' ' 6' ' ' VAL . 5.8 p90 -147.53 25.81 1.06 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.908 177.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.84 92.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.697 -1.138 . . . . 0.0 112.347 178.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.631 ' N ' HG11 ' A' ' 6' ' ' VAL . 0.3 OUTLIER 176.65 156.7 0.27 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.2 t -145.64 84.25 1.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.658 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.969 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.859 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.58 ' HB2' ' CZ ' ' A' ' 8' ' ' TYR . 4.0 m0 . . . . . 0 N--CA 1.471 0.616 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 2' ' ' TRP . 1.8 t 95.25 -71.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.777 ' CD1' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -119.5 -19.56 8.12 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -177.198 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.623 ' HA ' ' CE1' ' A' ' 8' ' ' TYR . 2.0 mtp180 69.55 41.35 1.27 Allowed 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.726 -0.39 . . . . 0.0 110.187 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.777 HG22 ' CD1' ' A' ' 4' ' ' PHE . 28.5 m -90.51 91.31 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -178.544 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.817 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.8 OUTLIER 76.12 56.26 0.05 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.125 178.439 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.623 ' CE1' ' HA ' ' A' ' 5' ' ' ARG . 31.5 p90 175.0 171.08 0.27 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.794 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.563 ' HD3' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 47.23 21.66 0.2 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.77 0.795 . . . . 0.0 110.751 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.772 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 146.69 -62.27 0.45 Allowed Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.981 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.772 HG23 ' O ' ' A' ' 10' ' ' GLY . 1.5 pp -170.22 176.52 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 117.51 0.655 . . . . 0.0 112.505 -178.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.817 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -66.99 77.05 0.13 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.163 -0.472 . . . . 0.0 109.997 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.535 ' HB2' HD12 ' A' ' 11' ' ' ILE . 1.5 t80 -104.76 118.33 36.29 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.97 -178.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.564 ' HA ' ' CG1' ' A' ' 6' ' ' VAL . 0.2 OUTLIER -100.15 126.16 46.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.253 179.496 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.44 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -149.34 -78.14 0.14 Allowed 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.269 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.483 ' N ' ' HB3' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -26.17 136.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.111 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.1 mmp_? . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.923 179.998 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.446 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.746 0.307 . . . . 0.0 110.696 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.887 ' O ' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER 46.52 38.02 5.04 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.958 179.867 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 56.24 -102.66 0.16 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.766 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.6 30.57 1.1 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.152 0.501 . . . . 0.0 110.601 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.887 HG22 ' O ' ' A' ' 3' ' ' CYS . 3.5 m -83.29 -174.17 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.061 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.621 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 3.6 m -41.09 86.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.725 -179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.557 ' O ' ' C ' ' A' ' 9' ' ' ARG . 86.3 t80 164.47 162.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.576 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.557 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 1.32 77.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.196 0.598 . . . . 0.0 112.385 179.581 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.491 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 143.45 -77.12 0.29 Allowed Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.054 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.491 HG23 ' O ' ' A' ' 10' ' ' GLY . 1.4 pp -158.08 -172.58 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.467 0.175 . . . . 0.0 110.739 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.621 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 16.2 t -134.39 84.29 2.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.758 0.313 . . . . 0.0 111.794 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.624 ' CZ ' HG13 ' A' ' 6' ' ' VAL . 7.9 p90 -98.84 12.22 36.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.453 0.645 . . . . 0.0 110.152 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.51 ' O ' ' O ' ' A' ' 13' ' ' TYR . 7.2 mtm-85 41.38 178.76 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.465 -1.243 . . . . 0.0 112.503 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 68.29 59.7 0.41 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.859 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.801 ' HB2' HG21 ' A' ' 6' ' ' VAL . 20.6 t -82.52 132.68 35.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.787 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.872 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.429 ' O ' ' C ' ' A' ' 3' ' ' CYS . 5.6 m95 . . . . . 0 CA--C 1.532 0.263 0 CA-C-O 120.521 0.2 . . . . 0.0 111.323 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.429 ' C ' ' O ' ' A' ' 2' ' ' TRP . 1.0 OUTLIER -25.52 -53.96 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.033 -0.531 . . . . 0.0 112.429 -179.773 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.566 ' CE2' ' CE1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 179.45 -32.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.715 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.479 ' HD2' ' HB2' ' A' ' 9' ' ' ARG . 5.7 mtm-85 62.87 115.96 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.969 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.897 HG12 ' C ' ' A' ' 13' ' ' TYR . 2.6 m -118.65 86.65 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.014 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.655 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 64.6 m 93.37 44.15 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.295 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.433 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 7.6 t80 -179.88 165.82 1.27 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.446 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.479 ' HB2' ' HD2' ' A' ' 5' ' ' ARG . 2.8 ptt180 31.46 38.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.285 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.795 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 156.55 -68.63 0.29 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.207 -0.997 . . . . 0.0 113.529 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.795 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 177.94 -178.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 120.522 0.201 . . . . 0.0 111.146 -179.396 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.655 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 15.2 m -82.12 65.8 7.42 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.375 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.897 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -63.48 -154.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.838 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.605 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER 162.69 109.2 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.421 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.605 ' HB2' ' O ' ' A' ' 14' ' ' ARG . 6.2 mmp_? 110.03 78.64 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.562 0.745 . . . . 0.0 111.301 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.421 ' HA ' ' CG ' ' A' ' 4' ' ' PHE . 29.7 t -69.59 -80.46 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.006 0.431 . . . . 0.0 110.655 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.335 -0.84 . . . . 0.0 110.921 179.914 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.425 ' CE2' ' HG2' ' A' ' 9' ' ' ARG . 10.9 m-90 . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.898 0.38 . . . . 0.0 111.291 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.87 ' O ' HG22 ' A' ' 6' ' ' VAL . 2.7 t -144.47 65.84 1.28 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.776 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.479 ' CD1' ' OH ' ' A' ' 13' ' ' TYR . 1.6 t80 57.47 21.03 6.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.9 mtm-85 62.7 38.62 11.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.767 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.87 HG22 ' O ' ' A' ' 3' ' ' CYS . 1.5 m -77.16 -104.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.966 -0.294 . . . . 0.0 110.425 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.2 m -77.26 146.78 36.67 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 122.161 -0.337 . . . . 0.0 110.2 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.501 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 49.2 p90 49.7 176.61 0.01 OUTLIER 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.984 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.425 ' HG2' ' CE2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 34.28 34.73 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.974 0.416 . . . . 0.0 111.259 -179.189 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.869 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 166.59 -64.11 0.21 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.491 -179.285 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.869 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER -178.04 -104.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 179.765 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.0 OUTLIER 168.35 62.64 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.637 0.256 . . . . 0.0 110.713 -179.631 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.596 ' CE2' HG12 ' A' ' 6' ' ' VAL . 7.0 p90 -98.88 27.95 4.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.511 0.672 . . . . 0.0 110.779 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.448 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 44.61 -165.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.601 178.862 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.95 46.42 1.22 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.074 0.464 . . . . 0.0 110.695 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.795 ' HB2' HG21 ' A' ' 6' ' ' VAL . 39.1 t -100.83 -77.11 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.803 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.897 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.466 ' CE2' ' CB ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.146 0 CA-C-O 120.568 0.223 . . . . 0.0 110.607 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -103.73 -76.06 0.6 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.228 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.451 ' CE1' ' HD3' ' A' ' 14' ' ' ARG . 1.4 t80 -94.47 -34.16 12.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.129 0.49 . . . . 0.0 110.827 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.52 ' O ' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -89.58 32.09 0.89 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.802 178.886 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.939 HG21 ' CE1' ' A' ' 13' ' ' TYR . 10.1 p -60.07 -4.48 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 8' ' ' TYR . 0.5 OUTLIER -66.36 66.18 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.528 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.529 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER 175.01 -94.42 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 178.643 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.529 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 13.1 mmp_? -62.4 79.23 0.02 OUTLIER 'General case' 0 C--O 1.233 0.228 0 CA-C-O 120.984 0.421 . . . . 0.0 109.889 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.71 ' C ' HD13 ' A' ' 11' ' ' ILE . . . 116.56 48.06 0.48 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.539 -0.624 . . . . 0.0 111.539 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.71 HD13 ' C ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 45.82 -168.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-O 120.629 0.252 . . . . 0.0 111.569 -179.56 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.3 m -105.35 128.5 53.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.03 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.939 ' CE1' HG21 ' A' ' 6' ' ' VAL . 7.5 p90 -172.24 44.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.264 0.554 . . . . 0.0 111.048 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.451 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 61.2 mtt85 -34.05 110.59 0.09 Allowed 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.948 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -160.18 73.09 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.71 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t -131.55 132.21 43.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.628 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.939 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.907 0.384 . . . . 0.0 110.923 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER 178.79 -68.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.43 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -166.22 35.74 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.325 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 65.04 34.58 8.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.639 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.864 HG12 ' O ' ' A' ' 13' ' ' TYR . 16.5 m -66.87 178.42 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.515 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 20.3 m -35.5 129.41 0.56 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.048 0.451 . . . . 0.0 111.647 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.434 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 1.3 t80 82.85 -175.53 0.03 OUTLIER 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.829 -178.7 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.41 ' HD3' ' HB3' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 37.56 37.26 0.1 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.801 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.416 ' C ' HG23 ' A' ' 11' ' ' ILE . . . 137.83 -70.6 0.48 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.434 -0.889 . . . . 0.0 113.318 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.436 ' O ' ' O ' ' A' ' 6' ' ' VAL . 1.4 pt -157.59 -163.9 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.67 0.235 . . . . 0.0 111.084 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 m -113.44 123.16 49.38 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-O 121.212 0.529 . . . . 0.0 111.321 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.864 ' O ' HG12 ' A' ' 6' ' ' VAL . 0.7 OUTLIER -153.11 54.21 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.428 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -45.54 114.06 0.69 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.572 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 17' ' ' ARG . 17.5 tpp85 -178.52 -91.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.716 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.9 t 43.91 -92.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.63 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 15' ' ' ARG . 5.7 tmm_? . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.791 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 7.3 p-90 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.983 0.42 . . . . 0.0 111.127 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.9 t -134.19 -79.68 0.46 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.953 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.536 ' O ' ' C ' ' A' ' 5' ' ' ARG . 1.5 p90 -147.09 -48.78 0.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.293 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.536 ' C ' ' O ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 4.94 89.14 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.491 -179.702 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.728 HG13 ' HG2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -54.22 -167.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.437 -179.542 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.626 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 64.2 m -19.39 87.28 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.795 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.726 ' O ' ' N ' ' A' ' 10' ' ' GLY . 54.1 t80 -177.33 -86.46 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.017 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.412 ' O ' HD12 ' A' ' 11' ' ' ILE . 29.3 mmt-85 -48.27 70.13 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.92 0.39 . . . . 0.0 111.705 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.955 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 58.84 12.47 14.79 Favored Glycine 0 CA--C 1.521 0.428 0 CA-C-N 116.122 -0.49 . . . . 0.0 113.496 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.955 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.9 OUTLIER 166.68 -177.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-N 117.225 0.512 . . . . 0.0 111.32 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.698 ' HB3' HG12 ' A' ' 6' ' ' VAL . 3.1 m -106.71 -158.56 0.66 Allowed 'General case' 0 C--O 1.23 0.05 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.197 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.704 ' H ' HG12 ' A' ' 6' ' ' VAL . 0.1 OUTLIER 107.0 152.03 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.458 1.103 . . . . 0.0 111.034 179.71 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.728 ' HG2' HG13 ' A' ' 6' ' ' VAL . 6.9 mtp180 -150.17 110.22 4.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.327 -178.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -126.36 -82.13 0.62 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.925 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 15' ' ' ARG . 1.2 m 20.16 -89.05 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.272 0.629 . . . . 0.0 112.528 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.9 ptp85 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.481 179.903 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.42 ' CZ2' ' HG2' ' A' ' 5' ' ' ARG . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.134 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' ' CB ' ' A' ' 4' ' ' PHE . 7.6 t -48.65 -23.83 1.15 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.441 0.163 . . . . 0.0 111.386 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.473 ' CB ' ' O ' ' A' ' 3' ' ' CYS . 0.6 OUTLIER 85.42 97.96 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.972 179.85 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.517 ' O ' HG23 ' A' ' 6' ' ' VAL . 0.0 OUTLIER -90.97 49.62 1.67 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.503 179.592 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.773 HG12 ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 47.49 -178.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.456 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.686 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 90.8 m 19.86 59.21 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 114.963 -1.017 . . . . 0.0 113.018 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 3.1 t80 174.38 170.77 0.23 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.314 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 mmt180 43.57 26.49 0.12 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.166 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.794 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 147.3 -63.55 0.43 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 119.958 -1.115 . . . . 0.0 113.923 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.794 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -174.17 -172.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 117.057 0.428 . . . . 0.0 111.661 -178.91 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.686 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 21.5 m -99.71 103.54 15.21 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.898 0.38 . . . . 0.0 111.699 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.773 ' N ' HG12 ' A' ' 6' ' ' VAL . 1.2 p90 -139.84 95.54 2.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.492 0.663 . . . . 0.0 110.019 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -66.38 94.28 0.26 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.359 -178.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.87 70.06 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.035 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.2 -28.01 9.26 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.759 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.965 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.471 ' O ' ' N ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.526 0.05 0 CA-C-O 120.542 0.21 . . . . 0.0 111.197 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.452 ' HB2' HG22 ' A' ' 6' ' ' VAL . 56.7 m 43.27 -89.65 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.471 ' N ' ' O ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -164.13 48.09 0.12 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.247 0.546 . . . . 0.0 109.635 179.101 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.604 ' O ' HD11 ' A' ' 11' ' ' ILE . 15.2 mtm-85 81.55 56.63 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.805 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.695 HG12 ' CE2' ' A' ' 13' ' ' TYR . 26.8 m -111.87 -139.31 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.395 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -54.11 149.31 9.64 Favored 'General case' 0 CA--C 1.52 -0.206 0 O-C-N 122.049 -0.407 . . . . 0.0 110.776 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.528 ' O ' ' N ' ' A' ' 10' ' ' GLY . 5.2 t80 72.21 -136.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.476 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.436 ' HD2' ' CD2' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -39.29 89.55 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.856 0.36 . . . . 0.0 111.174 179.395 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.617 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 135.48 -70.78 0.5 Allowed Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.503 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.753 ' N ' HD12 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -179.71 -100.36 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 O-C-N 122.97 -0.135 . . . . 0.0 111.167 179.921 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 176.25 62.81 0.01 OUTLIER 'General case' 0 C--N 1.342 0.253 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.662 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.695 ' CE2' HG12 ' A' ' 6' ' ' VAL . 1.5 p90 -102.49 96.55 6.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.721 0.772 . . . . 0.0 109.316 178.228 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -57.02 117.05 3.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.716 -178.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 1.5 mmm180 -159.08 -91.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.54 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.437 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 31.69 61.85 0.28 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 111.939 179.547 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.936 -179.91 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.434 ' CH2' ' HG3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.448 0 CA-C-O 120.982 0.42 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 t 177.43 122.55 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.644 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.483 ' C ' ' HG2' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 54.22 -165.3 0.09 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.98 -179.41 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.483 ' HG2' ' C ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 45.07 40.04 4.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.015 0.436 . . . . 0.0 110.401 179.564 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.485 HG11 ' O ' ' A' ' 13' ' ' TYR . 31.0 m -40.77 162.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.413 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.641 ' HA ' ' O ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER 74.23 143.23 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.817 -179.662 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.56 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 35.1 t80 97.27 173.5 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.798 -178.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 35.3 37.71 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.984 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.418 ' C ' HG13 ' A' ' 11' ' ' ILE . . . 154.48 -68.64 0.3 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.251 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.643 HD12 ' N ' ' A' ' 11' ' ' ILE . 0.2 OUTLIER -173.06 -89.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 116.748 0.274 . . . . 0.0 111.562 -179.545 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -168.13 120.93 0.87 Allowed 'General case' 0 CA--C 1.522 -0.107 0 CA-C-O 120.747 0.308 . . . . 0.0 110.321 179.699 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.485 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -99.76 175.29 5.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.413 179.899 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.13 26.65 0.7 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.619 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.22 122.38 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.6 t -77.87 64.12 3.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.974 0.416 . . . . 0.0 110.828 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 ptp85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.862 179.952 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.58 ' N ' ' HH ' ' A' ' 8' ' ' TYR . 87.8 m95 . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 5' ' ' ARG . 1.6 t 69.6 -57.76 0.53 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 122.147 0.179 . . . . 0.0 111.401 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.727 ' HB3' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -43.32 -30.02 0.47 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.77 0.319 . . . . 0.0 111.682 -179.447 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.599 ' HA ' ' CD2' ' A' ' 8' ' ' TYR . 4.0 ptp180 37.73 35.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.746 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.727 HG22 ' HB3' ' A' ' 4' ' ' PHE . 1.7 m -109.22 77.77 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.452 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.669 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 62.0 m 83.45 44.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.487 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.599 ' CD2' ' HA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -147.81 147.13 29.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.722 -1.127 . . . . 0.0 109.004 179.089 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.563 ' HB2' ' CD1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 33.59 -85.68 0.0 OUTLIER 'General case' 0 CA--C 1.522 -0.105 0 CA-C-O 121.647 0.737 . . . . 0.0 111.895 179.312 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.837 ' O ' HG23 ' A' ' 11' ' ' ILE . . . -51.64 -75.27 0.23 Allowed Glycine 0 C--N 1.297 -1.623 0 CA-C-N 114.348 -1.297 . . . . 0.0 113.571 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.837 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -177.35 -174.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-N 116.823 0.312 . . . . 0.0 111.401 -179.063 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.669 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 23.8 m -84.13 60.0 5.65 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.252 0.548 . . . . 0.0 109.651 178.618 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.462 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 2.6 t80 -87.27 105.02 16.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.792 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.541 ' HA ' HG12 ' A' ' 6' ' ' VAL . 36.4 mtp85 -66.59 64.48 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.859 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.428 ' O ' ' CG ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER 170.04 -163.49 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.259 179.585 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -145.06 56.88 1.26 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.919 0.39 . . . . 0.0 110.666 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.93 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.436 ' CD1' ' HG3' ' A' ' 5' ' ' ARG . 4.5 m95 . . . . . 0 N--CA 1.466 0.325 0 CA-C-O 120.707 0.289 . . . . 0.0 111.058 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -69.16 -54.97 12.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.914 0.387 . . . . 0.0 110.149 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.532 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -140.59 -58.5 0.52 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.368 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.436 ' HG3' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 47.54 93.76 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.81 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.625 HG12 ' C ' ' A' ' 13' ' ' TYR . 0.9 OUTLIER -55.0 -174.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.101 -179.694 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.666 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 98.9 m 0.72 71.97 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.607 0.763 . . . . 0.0 112.671 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.484 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 177.71 -165.21 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.081 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.479 ' C ' ' O ' ' A' ' 8' ' ' TYR . 4.5 mmm-85 -17.52 83.66 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.568 0 O-C-N 123.692 0.62 . . . . 0.0 112.557 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.8 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 124.07 -78.1 0.36 Allowed Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.792 -0.718 . . . . 0.0 113.177 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.8 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.9 OUTLIER -170.99 -172.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 122.18 0.192 . . . . 0.0 110.584 -179.424 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.666 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 72.4 m -92.92 73.97 4.82 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 120.775 0.322 . . . . 0.0 110.192 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.625 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -112.24 108.93 18.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.118 0.485 . . . . 0.0 111.977 -179.649 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.624 ' HA ' HG13 ' A' ' 6' ' ' VAL . 3.6 mtt180 -76.42 101.35 5.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.239 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 170.22 -157.55 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.177 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.433 ' HA ' ' HB2' ' A' ' 4' ' ' PHE . 0.8 OUTLIER 169.05 -30.23 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.916 0.389 . . . . 0.0 110.854 179.447 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.916 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.472 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 11.7 m0 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 121.267 0.556 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.477 ' C ' ' SG ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER 173.79 -46.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.018 179.275 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.86 48.52 1.23 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.548 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.424 ' NH1' ' CE2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -94.32 36.41 1.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.001 179.545 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.817 HG12 ' O ' ' A' ' 13' ' ' TYR . 27.1 m -75.14 72.51 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.798 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.682 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 70.9 m 98.93 42.27 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.05 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.46 ' O ' ' N ' ' A' ' 10' ' ' GLY . 28.7 t80 -155.43 -111.28 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.041 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.52 89.39 0.0 OUTLIER 'General case' 0 C--O 1.231 0.129 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.895 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 103.42 -48.68 1.0 Allowed Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.667 -0.777 . . . . 0.0 113.884 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.895 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER 162.39 -174.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 116.966 0.383 . . . . 0.0 110.748 -178.87 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.682 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 14.8 m -67.22 86.53 0.16 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.985 0.421 . . . . 0.0 110.81 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.817 ' O ' HG12 ' A' ' 6' ' ' VAL . 2.5 t80 -91.13 171.72 9.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.47 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.477 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 13.6 mtt-85 -163.99 96.37 0.81 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.614 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.487 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -175.58 -78.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 1.8 m 70.59 12.46 7.34 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.378 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.417 ' HG3' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.324 -0.846 . . . . 0.0 111.853 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 1.2 m95 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.018 0.437 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.0 t -52.74 165.74 0.25 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.117 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -41.35 -31.33 0.23 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.056 0.455 . . . . 0.0 111.138 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -71.88 92.12 1.23 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.045 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.795 HG22 ' HB2' ' A' ' 13' ' ' TYR . 8.5 m -52.33 -16.22 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.725 -179.101 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.619 ' O ' ' CB ' ' A' ' 8' ' ' TYR . 1.8 m -29.89 105.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.635 0.255 . . . . 0.0 111.146 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.619 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 42.0 t80 107.87 177.69 0.0 OUTLIER 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.537 -178.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.94 38.52 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.196 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.433 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 149.99 -72.56 0.29 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.179 -1.01 . . . . 0.0 113.436 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.488 ' O ' HG23 ' A' ' 6' ' ' VAL . 9.3 pt -158.9 -167.2 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 116.684 0.242 . . . . 0.0 111.178 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -119.81 134.39 55.25 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.305 0.574 . . . . 0.0 112.001 -179.857 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.795 ' HB2' HG22 ' A' ' 6' ' ' VAL . 0.3 OUTLIER -112.16 -164.61 0.93 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.188 -0.915 . . . . 0.0 108.823 178.213 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 59.0 mtp180 -155.52 91.11 1.29 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.069 0.462 . . . . 0.0 111.229 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.09 -86.42 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.846 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t 45.18 -92.03 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.559 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.9 mtp85 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.856 -179.953 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.429 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.159 0 CA-C-O 120.854 0.359 . . . . 0.0 110.879 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 90.0 m -135.37 -79.56 0.43 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.379 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -105.24 -21.41 13.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.356 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.453 ' NH1' ' CD2' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -82.3 55.98 3.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.862 0.363 . . . . 0.0 110.879 179.909 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.59 HG12 ' C ' ' A' ' 13' ' ' TYR . 2.7 m -58.29 132.93 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.572 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.601 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 71.4 m 108.12 77.74 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.177 0.991 . . . . 0.0 111.307 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.453 ' CD2' ' NH1' ' A' ' 5' ' ' ARG . 42.5 t80 -179.26 -104.85 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.25 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.46 ' O ' ' CZ ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -61.01 83.82 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.067 0 CA-C-O 120.816 0.341 . . . . 0.0 111.798 -179.228 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.469 ' O ' ' CG1' ' A' ' 11' ' ' ILE . . . 89.41 49.87 3.34 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.488 -0.863 . . . . 0.0 113.148 179.277 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.469 ' CG1' ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 69.17 -167.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.769 0.319 . . . . 0.0 111.788 179.559 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.601 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 19.0 m -88.2 -164.53 1.13 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.331 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.59 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 74.56 -67.15 0.27 Allowed 'General case' 0 CA--C 1.513 -0.481 0 CA-C-O 121.945 0.879 . . . . 0.0 110.165 -179.616 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.496 ' N ' ' CG ' ' A' ' 13' ' ' TYR . 0.5 OUTLIER 48.08 176.62 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 113.871 -1.513 . . . . 0.0 112.12 178.928 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.41 129.47 23.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.909 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 t -87.85 114.54 24.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.841 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.905 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 20.9 m0 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.619 0.247 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.408 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 46.7 t -133.84 -72.52 0.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.751 179.537 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -68.76 -120.52 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.405 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.814 ' O ' HG13 ' A' ' 6' ' ' VAL . 0.2 OUTLIER 49.99 -175.32 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.088 0 O-C-N 122.163 -0.336 . . . . 0.0 110.606 -179.715 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.834 HG12 ' O ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 174.08 113.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.982 0.42 . . . . 0.0 110.878 179.676 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.0 OUTLIER 67.63 70.56 0.35 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.776 -179.671 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.572 ' O ' ' N ' ' A' ' 10' ' ' GLY . 52.6 t80 -178.22 -73.78 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.839 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.403 ' O ' HG13 ' A' ' 11' ' ' ILE . 3.2 mmp_? -48.64 78.4 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.853 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 53.5 16.17 4.92 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 116.064 -0.516 . . . . 0.0 114.123 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.853 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER 163.96 -179.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 117.294 0.547 . . . . 0.0 110.951 179.73 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 3.4 t -97.81 93.41 6.34 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 121.243 0.544 . . . . 0.0 110.682 179.285 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.834 ' O ' HG12 ' A' ' 6' ' ' VAL . 4.5 t80 -75.73 166.33 23.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.444 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -177.4 64.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.943 179.796 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.403 ' HD3' ' HD3' ' A' ' 14' ' ' ARG . 3.2 mpp_? -166.33 81.73 0.27 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.274 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.2 t -161.84 137.94 7.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.915 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.897 179.943 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.472 ' CD1' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.946 ' O ' HG23 ' A' ' 6' ' ' VAL . 43.4 t -178.75 66.32 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.93 0.395 . . . . 0.0 110.959 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.438 ' CE2' ' HA ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER 44.78 29.31 0.42 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.661 179.766 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.451 ' HA ' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 42.29 59.66 2.59 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.974 0.416 . . . . 0.0 111.221 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.946 HG23 ' O ' ' A' ' 3' ' ' CYS . 11.2 t -82.97 87.74 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.66 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.586 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER 75.95 48.22 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.92 179.789 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.489 ' OH ' ' HB3' ' A' ' 3' ' ' CYS . 44.9 p90 174.73 176.08 0.17 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.952 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' TYR . 53.0 mtt-85 22.23 48.03 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.691 0.619 . . . . 0.0 112.559 179.468 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 151.21 -75.35 0.25 Allowed Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.388 -0.911 . . . . 0.0 113.341 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.44 HG23 ' O ' ' A' ' 10' ' ' GLY . 2.0 pt -159.72 -172.8 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.62 0.21 . . . . 0.0 111.433 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.586 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 8.8 t -109.93 118.15 35.69 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.302 0.572 . . . . 0.0 111.362 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.729 ' O ' HG13 ' A' ' 6' ' ' VAL . 1.8 t80 -126.15 60.27 1.3 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.457 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.454 ' C ' ' O ' ' A' ' 13' ' ' TYR . 2.2 mtm-85 -22.33 93.76 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.582 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.09 -82.59 0.0 OUTLIER 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.023 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.807 ' CA ' HG21 ' A' ' 6' ' ' VAL . 25.7 t 56.76 37.47 28.83 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.017 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.293 -0.86 . . . . 0.0 111.01 179.986 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.495 ' CG ' ' OH ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.169 0 CA-C-O 120.342 0.115 . . . . 0.0 110.845 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 4' ' ' PHE . 97.3 m -39.66 -74.0 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.881 0.372 . . . . 0.0 111.144 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER 176.36 -29.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.489 179.591 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.966 ' O ' HG22 ' A' ' 6' ' ' VAL . 89.6 mtt180 -147.3 -158.29 0.9 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.676 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.966 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.5 m 87.14 -166.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 123.226 0.61 . . . . 0.0 111.116 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.746 ' CA ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -52.88 161.74 0.72 Allowed 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.603 -179.465 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.691 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 8.2 p90 55.07 173.28 0.03 OUTLIER 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.7 OUTLIER 28.55 39.85 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 179.961 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.784 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 162.66 -68.51 0.23 Allowed Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.444 -0.884 . . . . 0.0 113.632 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.784 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER -177.43 -90.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 117.125 0.463 . . . . 0.0 111.933 -179.496 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.746 ' HA ' ' CA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -176.05 48.4 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.522 0.677 . . . . 0.0 110.782 179.471 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.589 ' O ' HG12 ' A' ' 6' ' ' VAL . 1.0 OUTLIER -80.9 81.81 7.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.072 179.044 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -44.69 99.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.443 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.787 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 176.44 -164.6 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.623 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 41.5 t 174.26 156.41 0.14 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.763 0.316 . . . . 0.0 110.511 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.308 179.972 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 11.9 t90 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.789 0.328 . . . . 0.0 111.126 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.6 t -96.34 -13.36 23.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.999 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.854 ' CE1' HG22 ' A' ' 6' ' ' VAL . 0.0 OUTLIER -164.42 -3.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.384 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.411 ' HA ' ' HG3' ' A' ' 9' ' ' ARG . 1.8 mtt-85 48.24 35.71 5.85 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.095 0.474 . . . . 0.0 110.632 -179.472 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.854 HG22 ' CE1' ' A' ' 4' ' ' PHE . 23.6 m -86.25 -142.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.289 -179.478 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.2 m -26.92 130.31 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.467 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.593 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.0 OUTLIER 73.75 -75.3 0.08 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.748 -178.652 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.582 ' N ' ' CG ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -51.79 75.86 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.664 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.898 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 93.4 -21.77 38.83 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 114.666 0.626 . . . . 0.0 114.666 178.397 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.898 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER 161.23 -164.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 117.42 0.61 . . . . 0.0 110.315 -179.151 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 m -125.53 102.99 7.63 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.65 0.262 . . . . 0.0 111.319 179.458 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.485 ' CD1' HG12 ' A' ' 6' ' ' VAL . 4.5 p90 -149.83 35.53 0.69 Allowed 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.972 0.415 . . . . 0.0 110.602 178.946 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.546 ' HA ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER -15.86 127.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.917 -179.895 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.443 ' N ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 165.36 94.78 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.869 179.76 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 4' ' ' PHE . 1.2 m -79.74 99.0 7.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.849 0.357 . . . . 0.0 110.927 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.909 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 8.2 m95 . . . . . 0 CA--C 1.53 0.177 0 CA-C-O 120.817 0.342 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 0.7 OUTLIER -103.47 69.98 1.02 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.804 -179.774 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.732 ' O ' HG22 ' A' ' 6' ' ' VAL . 0.5 OUTLIER 53.33 28.38 7.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.153 0.502 . . . . 0.0 110.667 -179.617 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 49.77 33.78 6.71 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.698 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 1.093 HG21 ' CZ ' ' A' ' 13' ' ' TYR . 1.7 m -148.95 50.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-O 121.545 0.688 . . . . 0.0 109.923 179.387 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER 179.44 136.21 0.1 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.976 179.854 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.592 ' O ' ' N ' ' A' ' 10' ' ' GLY . 7.7 t80 72.84 -138.97 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -177.877 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.536 ' HD2' ' CE2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -39.37 84.07 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.78 0.324 . . . . 0.0 111.408 179.649 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.592 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 137.98 -69.91 0.49 Allowed Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.788 -0.72 . . . . 0.0 113.191 -179.708 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 1.089 HD11 HG12 ' A' ' 6' ' ' VAL . 10.9 pt -158.38 -136.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 116.755 0.278 . . . . 0.0 111.031 -179.301 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 166.16 90.61 0.0 OUTLIER 'General case' 0 C--N 1.348 0.526 0 C-N-CA 122.324 0.25 . . . . 0.0 110.793 179.992 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 1.093 ' CZ ' HG21 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -101.45 25.26 8.56 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 119.37 -0.932 . . . . 0.0 111.956 179.297 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 42.13 95.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.127 178.589 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 167.21 59.01 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.504 179.505 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 4' ' ' PHE . 3.2 p -171.2 34.64 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.955 -179.638 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.809 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.491 ' CD1' ' HB3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.33 0 CA-C-O 120.821 0.343 . . . . 0.0 111.897 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 176.64 149.05 0.13 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -179.535 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -42.02 -34.32 0.69 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.489 0.661 . . . . 0.0 109.895 179.736 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.716 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 169.21 148.11 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.598 179.621 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.725 HG11 ' SG ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER 170.05 86.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 121.702 0.763 . . . . 0.0 109.673 -179.575 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.838 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER 32.88 39.99 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.769 -178.002 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.427 ' O ' ' N ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER 171.94 171.95 0.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 113.734 -1.575 . . . . 0.0 108.868 179.875 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.491 ' HB3' ' CD1' ' A' ' 2' ' ' TRP . 1.0 OUTLIER 32.39 37.23 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.526 0.516 . . . . 0.0 111.475 179.304 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.854 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 154.3 -73.03 0.26 Allowed Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.631 -179.865 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.854 HG23 ' O ' ' A' ' 10' ' ' GLY . 1.3 pp -173.27 173.84 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 CA-C-N 116.763 0.282 . . . . 0.0 111.113 -179.333 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.838 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -71.55 66.47 0.5 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.936 0.398 . . . . 0.0 111.624 179.641 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.606 ' CG ' ' HG3' ' A' ' 5' ' ' ARG . 1.5 t80 -73.96 134.79 43.17 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.06 178.932 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 49.81 0.92 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.477 -179.786 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.409 ' HB3' ' CE2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -154.7 -85.32 0.06 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.006 179.986 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.725 ' SG ' HG11 ' A' ' 6' ' ' VAL . 51.9 t 54.74 -100.89 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.457 0.17 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.0 mmm180 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.119 179.938 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.476 ' HD1' ' HH ' ' A' ' 8' ' ' TYR . 5.4 m0 . . . . . 0 CA--C 1.543 0.675 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -19.4 139.91 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.927 0.891 . . . . 0.0 113.396 -178.317 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.559 ' O ' HG12 ' A' ' 6' ' ' VAL . 11.8 m-85 85.95 149.41 0.06 Allowed 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 -179.741 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.469 ' HG2' ' HG3' ' A' ' 14' ' ' ARG . 23.0 mtt180 -74.54 57.88 0.75 Allowed 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.83 0.824 . . . . 0.0 110.014 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.559 HG12 ' O ' ' A' ' 4' ' ' PHE . 0.9 OUTLIER -74.58 -7.12 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.212 179.538 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 13.0 m 43.05 57.33 3.73 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.684 0.754 . . . . 0.0 111.08 179.707 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.601 ' CE1' ' HB2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -106.89 174.68 5.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.436 -1.257 . . . . 0.0 108.93 179.021 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.601 ' HB2' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 39.8 35.31 0.21 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.523 0.678 . . . . 0.0 110.97 178.154 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.466 ' C ' HG22 ' A' ' 11' ' ' ILE . . . 63.64 48.65 75.55 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 115.221 -0.899 . . . . 0.0 113.97 179.534 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.511 HD11 ' HA ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 177.98 127.52 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 117.373 0.587 . . . . 0.0 111.617 179.651 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 83.1 m -72.16 69.83 0.78 Allowed 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.422 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.511 ' HA ' HD11 ' A' ' 11' ' ' ILE . 46.6 t80 -41.21 146.37 0.19 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.461 -178.724 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.533 ' O ' ' CG ' ' A' ' 15' ' ' ARG . 2.0 mmt85 -171.13 79.38 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.027 -179.513 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.533 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER 169.32 73.36 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 120.706 0.288 . . . . 0.0 110.929 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -104.43 170.26 8.0 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.935 0.398 . . . . 0.0 111.455 -179.778 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.827 179.795 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.453 ' CD1' ' HG3' ' A' ' 9' ' ' ARG . 99.0 m95 . . . . . 0 CA--C 1.531 0.229 0 CA-C-O 120.662 0.268 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 1.5 m 64.77 102.92 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.058 179.679 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.471 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 11.3 t80 171.93 -18.11 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.813 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 44.7 mtp85 62.6 72.28 0.5 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.119 0.485 . . . . 0.0 109.879 -179.218 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.632 HG11 ' CE1' ' A' ' 8' ' ' TYR . 1.5 p -124.63 -24.35 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.937 -178.695 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 6' ' ' VAL . 42.2 t 67.73 72.33 0.33 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.592 0.234 . . . . 0.0 111.196 179.958 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.661 ' CE1' ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -178.59 -157.36 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.087 179.427 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.661 ' HG2' ' CE1' ' A' ' 8' ' ' TYR . 1.0 OUTLIER 61.54 48.93 5.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.115 0.483 . . . . 0.0 110.062 -178.791 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.783 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 111.61 -35.86 4.5 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.99 -179.535 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.783 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.8 OUTLIER -175.33 -177.44 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.816 0.341 . . . . 0.0 110.74 179.899 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.45 91.0 0.39 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.181 179.551 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -71.31 131.03 42.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.17 0.51 . . . . 0.0 111.793 -179.203 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.46 27.18 0.51 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.18 179.585 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.19 64.05 2.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.003 -179.631 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 t -166.3 163.76 17.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.054 179.851 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.2 mmp_? . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.937 -179.953 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.499 ' CD1' ' HB3' ' A' ' 8' ' ' TYR . 66.8 p-90 . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.563 ' HB3' ' OH ' ' A' ' 13' ' ' TYR . 5.1 t -127.07 -15.37 5.31 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.881 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.551 ' N ' ' OH ' ' A' ' 13' ' ' TYR . 11.2 t80 -160.43 -76.17 0.06 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.89 0.376 . . . . 0.0 110.488 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.423 ' O ' ' HB ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER 178.33 26.66 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.915 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.957 ' C ' HD13 ' A' ' 11' ' ' ILE . 7.5 p -178.7 57.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 179.309 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.736 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 51.8 t -146.73 155.94 42.78 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.938 0.399 . . . . 0.0 111.229 177.271 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.666 ' O ' ' N ' ' A' ' 10' ' ' GLY . 30.8 t80 68.82 -70.65 0.13 Allowed 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -177.916 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -52.95 66.61 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.543 179.173 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.869 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 67.13 29.62 74.71 Favored Glycine 0 CA--C 1.52 0.398 0 CA-C-N 115.848 -0.615 . . . . 0.0 114.25 179.327 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.957 HD13 ' C ' ' A' ' 6' ' ' VAL . 0.8 OUTLIER 178.71 -169.37 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 117.769 0.784 . . . . 0.0 111.709 179.94 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.736 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 2.6 t 178.71 144.43 0.13 Allowed 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 122.331 1.062 . . . . 0.0 113.761 177.883 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.696 ' HD1' HG13 ' A' ' 6' ' ' VAL . 0.5 OUTLIER -105.64 -171.06 1.84 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.12 -1.854 . . . . 0.0 106.67 176.78 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 13' ' ' TYR . 4.0 mmp_? -145.08 63.49 1.29 Allowed 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.726 179.391 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ARG . 7.7 tmm_? -130.72 -76.18 0.53 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.808 179.909 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.4 m 50.8 -87.79 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.435 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.418 ' N ' ' O ' ' A' ' 15' ' ' ARG . 59.3 ttp85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.329 -0.844 . . . . 0.0 111.016 -179.988 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.493 ' HB2' ' CE2' ' A' ' 8' ' ' TYR . 29.1 m95 . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' HG22 ' A' ' 6' ' ' VAL . 28.2 p 179.27 57.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.068 0.461 . . . . 0.0 110.327 179.541 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.409 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 17.6 t80 70.88 33.29 2.2 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.677 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.427 ' HA ' ' HE1' ' A' ' 8' ' ' TYR . 3.3 ptp180 34.55 77.24 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.194 -179.831 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.73 HG21 ' HA ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -118.6 -86.09 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -178.878 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.683 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.5 OUTLIER -90.03 86.08 6.49 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -177.723 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.493 ' CE2' ' HB2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 153.89 -111.43 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.343 0.657 . . . . 0.0 111.134 177.48 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.514 ' CG ' ' O ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -26.8 108.46 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.311 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.07 -60.56 4.4 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 121.008 -0.615 . . . . 0.0 113.529 179.47 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.407 ' C ' HD13 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -157.48 149.39 9.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.236 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.683 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -86.01 99.81 11.71 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 120.095 -0.642 . . . . 0.0 112.17 -179.207 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.717 ' HB3' HG12 ' A' ' 6' ' ' VAL . 2.7 t80 -92.04 105.69 17.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.355 178.914 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 -52.12 93.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.622 -179.237 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -172.15 -88.47 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.845 179.375 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.73 ' HA ' HG21 ' A' ' 6' ' ' VAL . 35.6 t 40.52 -93.62 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 179.668 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.936 -179.87 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.043 0 CA-C-O 120.844 0.354 . . . . 0.0 110.995 . . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 4' ' ' PHE . 4.7 t 67.86 -68.73 0.16 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.528 -179.816 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.473 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER 174.22 -33.32 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.23 179.487 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.595 ' O ' HG13 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 168.05 125.65 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.312 179.901 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.595 HG13 ' O ' ' A' ' 5' ' ' ARG . 3.0 m -159.97 171.02 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.147 -179.927 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.3 OUTLIER -40.24 135.44 1.43 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.153 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.565 ' CG ' ' N ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 73.4 179.35 0.22 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.264 -179.823 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.565 ' N ' ' CG ' ' A' ' 8' ' ' TYR . 0.4 OUTLIER 50.31 35.46 10.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 111.518 -179.313 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.422 ' C ' HG23 ' A' ' 11' ' ' ILE . . . 129.68 -58.96 0.7 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.361 -0.923 . . . . 0.0 113.964 179.089 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.422 HG23 ' C ' ' A' ' 10' ' ' GLY . 1.1 pt -157.22 -159.0 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 117.045 0.423 . . . . 0.0 110.968 -179.076 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 12.0 t -133.28 137.56 46.07 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 121.481 0.658 . . . . 0.0 112.021 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.473 ' O ' HG12 ' A' ' 6' ' ' VAL . 0.6 OUTLIER -145.05 83.68 1.69 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.368 179.427 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.2 mtm-85 -61.55 76.77 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.422 -178.945 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' A' ' 13' ' ' TYR . 34.5 mtt-85 -162.51 -96.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.632 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.6 t 42.99 84.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.754 0.312 . . . . 0.0 111.428 179.758 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.926 179.9 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.8 m95 . . . . . 0 N--CA 1.464 0.266 0 CA-C-O 120.643 0.259 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.3 t -58.99 -20.87 56.94 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.127 179.896 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.456 ' CD2' ' HB3' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -170.22 170.64 7.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.078 0.466 . . . . 0.0 111.233 179.971 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 7' ' ' CYS . 4.0 mtt85 -113.6 60.18 0.66 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.413 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.401 ' O ' HG23 ' A' ' 6' ' ' VAL . 15.6 m -63.93 71.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.3 0.572 . . . . 0.0 111.926 -179.284 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.563 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 98.5 m 67.74 52.21 0.76 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.46 179.422 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.452 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 178.77 -176.21 0.23 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.184 178.927 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.452 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 15.7 mmm180 37.24 34.51 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.615 -179.604 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.84 -72.05 0.37 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.121 179.859 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.471 ' N ' HD13 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -156.76 -161.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.65 0.225 . . . . 0.0 111.128 -179.603 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.563 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 5.6 m -93.38 134.98 35.05 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.051 0.453 . . . . 0.0 111.167 179.604 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.42 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER -138.29 171.12 14.86 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.317 -179.767 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 -155.96 48.05 0.49 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.98 0.419 . . . . 0.0 110.963 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -179.99 132.15 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.886 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.456 ' HB3' ' CD2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -126.25 154.46 43.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.712 179.931 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.921 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.465 ' CE3' ' O ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.231 0 CA-C-O 120.66 0.266 . . . . 0.0 110.854 . . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.641 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 43.4 t 179.68 122.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.549 179.718 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.641 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 92.4 m-85 90.03 -44.65 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.916 -179.386 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 47.71 55.52 8.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.168 -179.919 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.506 HG12 ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -104.44 119.94 54.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.658 0.742 . . . . 0.0 112.447 -178.786 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.665 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 82.7 m 65.22 38.53 5.91 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.587 -1.188 . . . . 0.0 110.067 179.862 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.43 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 18.6 t80 -178.45 170.04 1.72 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.814 -1.084 . . . . 0.0 109.99 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.43 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 22.7 mmt180 34.63 36.97 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.516 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.81 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 148.28 -72.33 0.3 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.079 -179.914 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.81 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 179.31 -169.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 116.652 0.226 . . . . 0.0 110.779 -179.419 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.665 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 57.8 m -93.06 92.94 8.05 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.053 0.454 . . . . 0.0 111.0 179.885 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.581 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 0.8 OUTLIER -137.29 99.45 3.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.596 179.676 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.427 ' HG2' HG11 ' A' ' 6' ' ' VAL . 0.4 OUTLIER -79.03 115.48 18.73 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.069 -177.97 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.461 ' HG3' ' CE2' ' A' ' 13' ' ' TYR . 1.0 OUTLIER 167.1 87.44 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.775 179.266 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' CG ' ' A' ' 4' ' ' PHE . 23.0 t -119.67 135.47 54.81 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.741 -179.989 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.833 -179.975 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.549 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.1 OUTLIER . . . . . 0 CA--C 1.538 0.491 0 CA-C-O 119.908 -0.091 . . . . 0.0 111.241 . . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.592 ' HB3' HG11 ' A' ' 6' ' ' VAL . 39.0 t -47.02 130.04 12.21 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.846 0.355 . . . . 0.0 111.018 179.994 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.48 ' O ' ' CD1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -77.85 150.62 34.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.459 -179.951 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.681 ' HA ' ' CD2' ' A' ' 13' ' ' TYR . 0.7 OUTLIER 47.18 81.78 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.107 -179.914 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.797 ' H ' ' HB3' ' A' ' 13' ' ' TYR . 2.5 p 173.14 166.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.81 -176.945 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.564 ' N ' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -57.45 88.48 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.676 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.473 ' HD2' HG13 ' A' ' 6' ' ' VAL . 8.6 p90 -135.74 153.04 51.69 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.395 0.617 . . . . 0.0 112.558 -178.931 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.441 ' HG3' ' N ' ' A' ' 10' ' ' GLY . 6.1 ptm180 39.06 -161.1 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.377 179.239 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.441 ' N ' ' HG3' ' A' ' 9' ' ' ARG . . . -47.78 -21.3 1.46 Allowed Glycine 0 CA--C 1.52 0.368 0 CA-C-N 115.781 -0.645 . . . . 0.0 114.525 -179.069 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.472 ' O ' HD12 ' A' ' 11' ' ' ILE . 1.5 pp -116.19 102.77 14.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 117.918 0.859 . . . . 0.0 111.824 -179.555 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.21 95.73 0.78 Allowed 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.301 179.596 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.797 ' HB3' ' H ' ' A' ' 6' ' ' VAL . 2.4 t80 -85.36 -165.37 1.2 Allowed 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.584 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.434 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 21.6 mtm-85 -156.77 114.53 3.21 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 119.994 -0.682 . . . . 0.0 112.233 -179.698 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 171.56 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.967 179.241 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.42 ' HB2' ' CG2' ' A' ' 6' ' ' VAL . 0.6 OUTLIER 51.22 -163.76 0.06 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.506 -179.956 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.893 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.789 0.328 . . . . 6.5 111.257 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 15.6 m95 -83.68 -154.85 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.102 -0.499 . . . . 6.1500000000000004 110.572 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 t -45.0 -29.91 0.93 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.799 0.333 . . . . 2.77 111.137 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.406 ' O ' ' CD ' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 169.23 -3.86 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.173 -0.467 . . . . 6.7699999999999996 111.891 179.713 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.406 ' CD ' ' O ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 38.14 43.17 0.55 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.021 0.439 . . . . 8.4199999999999999 111.311 -179.728 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.825 HG12 ' O ' ' A' ' 13' ' ' TYR . 34.8 m -52.31 119.74 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.875 -0.602 . . . . 3.46 111.262 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.486 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 74.2 m 66.03 41.14 3.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.912 -0.585 . . . . 2.5 110.102 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.445 ' CE2' ' HG2' ' A' ' 9' ' ' ARG . 79.0 t80 -175.27 167.01 3.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.578 -0.737 . . . . 5.7300000000000004 110.378 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.445 ' HG2' ' CE2' ' A' ' 8' ' ' TYR . 0.3 OUTLIER 35.23 36.89 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.298 -0.41 . . . . 5.7199999999999998 111.685 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.813 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 158.64 -66.42 0.29 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.579 -0.819 . . . . 1.97 112.748 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.813 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 172.84 -178.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 120.864 0.364 . . . . 2.1299999999999999 111.182 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.486 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 1.7 m -77.18 110.11 11.6 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.96 -0.564 . . . . 2.1099999999999999 110.299 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.825 ' O ' HG12 ' A' ' 6' ' ' VAL . 2.4 t80 -137.54 68.67 1.41 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 4.0 111.519 -179.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -55.49 97.77 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.432 -0.349 . . . . 5.7999999999999998 111.039 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.404 ' O ' ' CD2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 179.21 50.59 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.955 0.407 . . . . 5.46 111.099 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.38 -21.27 63.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.329 -0.396 . . . . 2.2400000000000002 111.083 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.246 -0.883 . . . . 7.5700000000000003 110.897 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.789 0.328 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.412 ' N ' ' OH ' ' A' ' 8' ' ' TYR . 0.5 OUTLIER 63.57 15.51 8.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.601 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -50.08 -29.82 9.68 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.306 0.574 . . . . 0.0 110.003 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.462 ' O ' ' CB ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -178.01 -63.54 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.157 -0.928 . . . . 0.0 108.697 179.624 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.473 ' HG3' ' CE2' ' A' ' 13' ' ' TYR . 8.3 ptt-85 154.01 45.92 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.173 178.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.631 HG11 ' N ' ' A' ' 15' ' ' ARG . 4.5 m -105.65 116.25 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-O 121.369 0.604 . . . . 0.0 111.781 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.696 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 13.5 m 76.57 25.95 0.9 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.879 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.497 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.0 OUTLIER 171.69 -176.06 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.127 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.495 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 15.94 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.616 ' C ' HG23 ' A' ' 11' ' ' ILE . . . 131.54 15.8 1.56 Allowed Glycine 0 CA--C 1.524 0.638 0 C-N-CA 120.078 -1.058 . . . . 0.0 114.35 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.616 HG23 ' C ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 80.79 -169.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 117.247 0.523 . . . . 0.0 111.434 179.57 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.696 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 1.9 t -122.81 133.08 54.46 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.528 ' H ' HG12 ' A' ' 6' ' ' VAL . 5.8 p90 -147.53 25.81 1.06 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.908 177.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.84 92.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.697 -1.138 . . . . 0.0 112.347 178.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.631 ' N ' HG11 ' A' ' 6' ' ' VAL . 0.3 OUTLIER 176.65 156.7 0.27 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.2 t -145.64 84.25 1.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.658 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.969 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.859 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.507 ' O ' ' N ' ' A' ' 3' ' ' CYS . 21.2 mttp . . . . . 0 N--CA 1.479 0.99 0 CA-C-O 120.668 0.271 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.58 ' HB2' ' CZ ' ' A' ' 8' ' ' TYR . 4.0 m0 21.85 45.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.857 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 2' ' ' TRP . 1.8 t 95.25 -71.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.777 ' CD1' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -119.5 -19.56 8.12 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -177.198 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.623 ' HA ' ' CE1' ' A' ' 8' ' ' TYR . 2.0 mtp180 69.55 41.35 1.27 Allowed 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.726 -0.39 . . . . 0.0 110.187 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.777 HG22 ' CD1' ' A' ' 4' ' ' PHE . 28.5 m -90.51 91.31 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -178.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.817 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.8 OUTLIER 76.12 56.26 0.05 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.125 178.439 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.623 ' CE1' ' HA ' ' A' ' 5' ' ' ARG . 31.5 p90 175.0 171.08 0.27 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.794 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.563 ' HD3' ' O ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 47.23 21.66 0.2 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.77 0.795 . . . . 0.0 110.751 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.772 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 146.69 -62.27 0.45 Allowed Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.981 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.772 HG23 ' O ' ' A' ' 10' ' ' GLY . 1.5 pp -170.22 176.52 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 117.51 0.655 . . . . 0.0 112.505 -178.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.817 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -66.99 77.05 0.13 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.163 -0.472 . . . . 0.0 109.997 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.535 ' HB2' HD12 ' A' ' 11' ' ' ILE . 1.5 t80 -104.76 118.33 36.29 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.97 -178.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.564 ' HA ' ' CG1' ' A' ' 6' ' ' VAL . 0.2 OUTLIER -100.15 126.16 46.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.253 179.496 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.44 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -149.34 -78.14 0.14 Allowed 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.269 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.483 ' N ' ' HB3' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -26.17 136.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.111 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.1 mmp_? . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.923 179.998 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.763 0.316 . . . . 0.0 111.171 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.446 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.1 OUTLIER -152.04 -168.11 2.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.696 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.887 ' O ' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER 46.52 38.02 5.04 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.958 179.867 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 56.24 -102.66 0.16 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.766 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.6 30.57 1.1 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.152 0.501 . . . . 0.0 110.601 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.887 HG22 ' O ' ' A' ' 3' ' ' CYS . 3.5 m -83.29 -174.17 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.061 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.621 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 3.6 m -41.09 86.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.725 -179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.557 ' O ' ' C ' ' A' ' 9' ' ' ARG . 86.3 t80 164.47 162.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.576 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.557 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 1.32 77.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.196 0.598 . . . . 0.0 112.385 179.581 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.491 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 143.45 -77.12 0.29 Allowed Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.054 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.491 HG23 ' O ' ' A' ' 10' ' ' GLY . 1.4 pp -158.08 -172.58 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.467 0.175 . . . . 0.0 110.739 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.621 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 16.2 t -134.39 84.29 2.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.758 0.313 . . . . 0.0 111.794 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.624 ' CZ ' HG13 ' A' ' 6' ' ' VAL . 7.9 p90 -98.84 12.22 36.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.453 0.645 . . . . 0.0 110.152 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.51 ' O ' ' O ' ' A' ' 13' ' ' TYR . 7.2 mtm-85 41.38 178.76 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.465 -1.243 . . . . 0.0 112.503 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 68.29 59.7 0.41 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.859 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.801 ' HB2' HG21 ' A' ' 6' ' ' VAL . 20.6 t -82.52 132.68 35.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.787 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.872 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.452 ' HG2' ' CD2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.456 0 CA-C-O 120.695 0.283 . . . . 0.0 111.422 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.452 ' CD2' ' HG2' ' A' ' 1' ' ' LYS . 5.6 m95 -94.01 -161.85 0.89 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.614 -0.267 . . . . 0.0 111.323 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.429 ' C ' ' O ' ' A' ' 2' ' ' TRP . 1.0 OUTLIER -25.52 -53.96 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.033 -0.531 . . . . 0.0 112.429 -179.773 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.566 ' CE2' ' CE1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 179.45 -32.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.715 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.479 ' HD2' ' HB2' ' A' ' 9' ' ' ARG . 5.7 mtm-85 62.87 115.96 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.969 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.897 HG12 ' C ' ' A' ' 13' ' ' TYR . 2.6 m -118.65 86.65 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.014 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.655 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 64.6 m 93.37 44.15 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.295 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.433 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 7.6 t80 -179.88 165.82 1.27 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.446 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.479 ' HB2' ' HD2' ' A' ' 5' ' ' ARG . 2.8 ptt180 31.46 38.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.285 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.795 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 156.55 -68.63 0.29 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.207 -0.997 . . . . 0.0 113.529 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.795 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 177.94 -178.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 120.522 0.201 . . . . 0.0 111.146 -179.396 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.655 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 15.2 m -82.12 65.8 7.42 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.375 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.897 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -63.48 -154.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.838 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.605 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER 162.69 109.2 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.421 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.605 ' HB2' ' O ' ' A' ' 14' ' ' ARG . 6.2 mmp_? 110.03 78.64 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.562 0.745 . . . . 0.0 111.301 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.421 ' HA ' ' CG ' ' A' ' 4' ' ' PHE . 29.7 t -69.59 -80.46 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.006 0.431 . . . . 0.0 110.655 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.335 -0.84 . . . . 0.0 110.921 179.914 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.723 0.297 . . . . 0.0 111.079 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.425 ' CE2' ' HG2' ' A' ' 9' ' ' ARG . 10.9 m-90 -53.01 -81.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.291 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.87 ' O ' HG22 ' A' ' 6' ' ' VAL . 2.7 t -144.47 65.84 1.28 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.776 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.479 ' CD1' ' OH ' ' A' ' 13' ' ' TYR . 1.6 t80 57.47 21.03 6.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.9 mtm-85 62.7 38.62 11.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.767 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.87 HG22 ' O ' ' A' ' 3' ' ' CYS . 1.5 m -77.16 -104.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.966 -0.294 . . . . 0.0 110.425 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.2 m -77.26 146.78 36.67 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 122.161 -0.337 . . . . 0.0 110.2 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.501 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 49.2 p90 49.7 176.61 0.01 OUTLIER 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.984 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.425 ' HG2' ' CE2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 34.28 34.73 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.974 0.416 . . . . 0.0 111.259 -179.189 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.869 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 166.59 -64.11 0.21 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.491 -179.285 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.869 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER -178.04 -104.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 179.765 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.0 OUTLIER 168.35 62.64 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.637 0.256 . . . . 0.0 110.713 -179.631 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.596 ' CE2' HG12 ' A' ' 6' ' ' VAL . 7.0 p90 -98.88 27.95 4.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.511 0.672 . . . . 0.0 110.779 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.448 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 44.61 -165.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.601 178.862 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.95 46.42 1.22 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.074 0.464 . . . . 0.0 110.695 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.795 ' HB2' HG21 ' A' ' 6' ' ' VAL . 39.1 t -100.83 -77.11 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.803 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.897 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.7 tttt . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.75 0.31 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.466 ' CE2' ' CB ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -62.38 89.23 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.607 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -103.73 -76.06 0.6 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.228 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.451 ' CE1' ' HD3' ' A' ' 14' ' ' ARG . 1.4 t80 -94.47 -34.16 12.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.129 0.49 . . . . 0.0 110.827 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.52 ' O ' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -89.58 32.09 0.89 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.802 178.886 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.939 HG21 ' CE1' ' A' ' 13' ' ' TYR . 10.1 p -60.07 -4.48 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 8' ' ' TYR . 0.5 OUTLIER -66.36 66.18 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.528 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.529 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER 175.01 -94.42 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 178.643 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.529 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 13.1 mmp_? -62.4 79.23 0.02 OUTLIER 'General case' 0 C--O 1.233 0.228 0 CA-C-O 120.984 0.421 . . . . 0.0 109.889 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.71 ' C ' HD13 ' A' ' 11' ' ' ILE . . . 116.56 48.06 0.48 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.539 -0.624 . . . . 0.0 111.539 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.71 HD13 ' C ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 45.82 -168.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-O 120.629 0.252 . . . . 0.0 111.569 -179.56 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.3 m -105.35 128.5 53.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.03 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.939 ' CE1' HG21 ' A' ' 6' ' ' VAL . 7.5 p90 -172.24 44.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.264 0.554 . . . . 0.0 111.048 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.451 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 61.2 mtt85 -34.05 110.59 0.09 Allowed 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.948 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -160.18 73.09 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.71 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t -131.55 132.21 43.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.628 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.939 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.0 mmtp . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.709 0.29 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 62.37 155.15 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.923 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER 178.79 -68.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.43 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -166.22 35.74 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.325 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 65.04 34.58 8.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.639 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.864 HG12 ' O ' ' A' ' 13' ' ' TYR . 16.5 m -66.87 178.42 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.515 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 20.3 m -35.5 129.41 0.56 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.048 0.451 . . . . 0.0 111.647 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.434 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 1.3 t80 82.85 -175.53 0.03 OUTLIER 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.829 -178.7 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.41 ' HD3' ' HB3' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 37.56 37.26 0.1 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.801 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.416 ' C ' HG23 ' A' ' 11' ' ' ILE . . . 137.83 -70.6 0.48 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.434 -0.889 . . . . 0.0 113.318 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.436 ' O ' ' O ' ' A' ' 6' ' ' VAL . 1.4 pt -157.59 -163.9 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.67 0.235 . . . . 0.0 111.084 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 m -113.44 123.16 49.38 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-O 121.212 0.529 . . . . 0.0 111.321 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.864 ' O ' HG12 ' A' ' 6' ' ' VAL . 0.7 OUTLIER -153.11 54.21 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.428 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -45.54 114.06 0.69 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.572 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 17' ' ' ARG . 17.5 tpp85 -178.52 -91.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.716 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.9 t 43.91 -92.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.63 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 15' ' ' ARG . 5.7 tmm_? . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.791 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.402 ' N ' ' HB3' ' A' ' 9' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.804 0.335 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 7.3 p-90 -164.03 -43.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.127 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.9 t -134.19 -79.68 0.46 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.953 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.536 ' O ' ' C ' ' A' ' 5' ' ' ARG . 1.5 p90 -147.09 -48.78 0.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.293 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.536 ' C ' ' O ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 4.94 89.14 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.491 -179.702 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.728 HG13 ' HG2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -54.22 -167.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.437 -179.542 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.626 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 64.2 m -19.39 87.28 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.795 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.726 ' O ' ' N ' ' A' ' 10' ' ' GLY . 54.1 t80 -177.33 -86.46 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.017 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.412 ' O ' HD12 ' A' ' 11' ' ' ILE . 29.3 mmt-85 -48.27 70.13 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.92 0.39 . . . . 0.0 111.705 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.955 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 58.84 12.47 14.79 Favored Glycine 0 CA--C 1.521 0.428 0 CA-C-N 116.122 -0.49 . . . . 0.0 113.496 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.955 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.9 OUTLIER 166.68 -177.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-N 117.225 0.512 . . . . 0.0 111.32 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.698 ' HB3' HG12 ' A' ' 6' ' ' VAL . 3.1 m -106.71 -158.56 0.66 Allowed 'General case' 0 C--O 1.23 0.05 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.197 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.704 ' H ' HG12 ' A' ' 6' ' ' VAL . 0.1 OUTLIER 107.0 152.03 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.458 1.103 . . . . 0.0 111.034 179.71 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.728 ' HG2' HG13 ' A' ' 6' ' ' VAL . 6.9 mtp180 -150.17 110.22 4.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.327 -178.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -126.36 -82.13 0.62 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.925 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 15' ' ' ARG . 1.2 m 20.16 -89.05 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.272 0.629 . . . . 0.0 112.528 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.9 ptp85 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.481 179.903 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.949 0.404 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.42 ' CZ2' ' HG2' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -68.89 -165.25 0.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.485 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' ' CB ' ' A' ' 4' ' ' PHE . 7.6 t -48.65 -23.83 1.15 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.441 0.163 . . . . 0.0 111.386 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.473 ' CB ' ' O ' ' A' ' 3' ' ' CYS . 0.6 OUTLIER 85.42 97.96 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.972 179.85 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.517 ' O ' HG23 ' A' ' 6' ' ' VAL . 0.0 OUTLIER -90.97 49.62 1.67 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.503 179.592 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.773 HG12 ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 47.49 -178.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.456 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.686 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 90.8 m 19.86 59.21 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 114.963 -1.017 . . . . 0.0 113.018 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 3.1 t80 174.38 170.77 0.23 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.314 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 mmt180 43.57 26.49 0.12 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.166 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.794 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 147.3 -63.55 0.43 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 119.958 -1.115 . . . . 0.0 113.923 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.794 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -174.17 -172.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 117.057 0.428 . . . . 0.0 111.661 -178.91 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.686 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 21.5 m -99.71 103.54 15.21 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.898 0.38 . . . . 0.0 111.699 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.773 ' N ' HG12 ' A' ' 6' ' ' VAL . 1.2 p90 -139.84 95.54 2.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.492 0.663 . . . . 0.0 110.019 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -66.38 94.28 0.26 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.359 -178.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.87 70.06 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.035 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.2 -28.01 9.26 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.759 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.965 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 120.783 0.325 . . . . 0.0 111.042 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.471 ' O ' ' N ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 63.52 -81.74 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.197 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.452 ' HB2' HG22 ' A' ' 6' ' ' VAL . 56.7 m 43.27 -89.65 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.471 ' N ' ' O ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -164.13 48.09 0.12 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.247 0.546 . . . . 0.0 109.635 179.101 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.604 ' O ' HD11 ' A' ' 11' ' ' ILE . 15.2 mtm-85 81.55 56.63 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.805 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.695 HG12 ' CE2' ' A' ' 13' ' ' TYR . 26.8 m -111.87 -139.31 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.395 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -54.11 149.31 9.64 Favored 'General case' 0 CA--C 1.52 -0.206 0 O-C-N 122.049 -0.407 . . . . 0.0 110.776 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.528 ' O ' ' N ' ' A' ' 10' ' ' GLY . 5.2 t80 72.21 -136.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.476 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.436 ' HD2' ' CD2' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -39.29 89.55 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.856 0.36 . . . . 0.0 111.174 179.395 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.617 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 135.48 -70.78 0.5 Allowed Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.503 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.753 ' N ' HD12 ' A' ' 11' ' ' ILE . 0.1 OUTLIER -179.71 -100.36 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 O-C-N 122.97 -0.135 . . . . 0.0 111.167 179.921 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 176.25 62.81 0.01 OUTLIER 'General case' 0 C--N 1.342 0.253 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.662 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.695 ' CE2' HG12 ' A' ' 6' ' ' VAL . 1.5 p90 -102.49 96.55 6.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.721 0.772 . . . . 0.0 109.316 178.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -57.02 117.05 3.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.716 -178.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 1.5 mmm180 -159.08 -91.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.54 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.437 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 31.69 61.85 0.28 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 111.939 179.547 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.936 -179.91 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.431 ' N ' ' CD1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.307 0 CA-C-O 120.776 0.322 . . . . 0.0 111.16 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.434 ' CH2' ' HG3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -44.18 -38.23 3.62 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.131 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 t 177.43 122.55 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.644 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.483 ' C ' ' HG2' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 54.22 -165.3 0.09 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.98 -179.41 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.483 ' HG2' ' C ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 45.07 40.04 4.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.015 0.436 . . . . 0.0 110.401 179.564 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.485 HG11 ' O ' ' A' ' 13' ' ' TYR . 31.0 m -40.77 162.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.413 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.641 ' HA ' ' O ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER 74.23 143.23 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.817 -179.662 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.56 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 35.1 t80 97.27 173.5 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.798 -178.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.428 ' HB3' ' NZ ' ' A' ' 1' ' ' LYS . 0.0 OUTLIER 35.3 37.71 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.984 179.825 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.418 ' C ' HG13 ' A' ' 11' ' ' ILE . . . 154.48 -68.64 0.3 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.251 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.643 HD12 ' N ' ' A' ' 11' ' ' ILE . 0.2 OUTLIER -173.06 -89.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 116.748 0.274 . . . . 0.0 111.562 -179.545 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -168.13 120.93 0.87 Allowed 'General case' 0 CA--C 1.522 -0.107 0 CA-C-O 120.747 0.308 . . . . 0.0 110.321 179.699 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.485 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -99.76 175.29 5.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.413 179.899 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.13 26.65 0.7 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.619 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.22 122.38 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.6 t -77.87 64.12 3.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.974 0.416 . . . . 0.0 110.828 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 ptp85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.862 179.952 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.835 0.35 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.493 ' HB2' ' CE2' ' A' ' 8' ' ' TYR . 87.8 m95 -68.63 -8.01 38.27 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.101 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 5' ' ' ARG . 1.6 t 69.6 -57.76 0.53 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 122.147 0.179 . . . . 0.0 111.401 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.727 ' HB3' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -43.32 -30.02 0.47 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.77 0.319 . . . . 0.0 111.682 -179.447 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.599 ' HA ' ' CD2' ' A' ' 8' ' ' TYR . 4.0 ptp180 37.73 35.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.746 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.727 HG22 ' HB3' ' A' ' 4' ' ' PHE . 1.7 m -109.22 77.77 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.452 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.669 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 62.0 m 83.45 44.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.487 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.599 ' CD2' ' HA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -147.81 147.13 29.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.722 -1.127 . . . . 0.0 109.004 179.089 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.563 ' HB2' ' CD1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 33.59 -85.68 0.0 OUTLIER 'General case' 0 CA--C 1.522 -0.105 0 CA-C-O 121.647 0.737 . . . . 0.0 111.895 179.312 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.837 ' O ' HG23 ' A' ' 11' ' ' ILE . . . -51.64 -75.27 0.23 Allowed Glycine 0 C--N 1.297 -1.623 0 CA-C-N 114.348 -1.297 . . . . 0.0 113.571 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.837 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -177.35 -174.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-N 116.823 0.312 . . . . 0.0 111.401 -179.063 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.669 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 23.8 m -84.13 60.0 5.65 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.252 0.548 . . . . 0.0 109.651 178.618 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.462 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 2.6 t80 -87.27 105.02 16.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.792 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.541 ' HA ' HG12 ' A' ' 6' ' ' VAL . 36.4 mtp85 -66.59 64.48 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.859 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.428 ' O ' ' CG ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER 170.04 -163.49 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.259 179.585 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -145.06 56.88 1.26 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.919 0.39 . . . . 0.0 110.666 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.93 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.422 ' HB2' ' HB3' ' A' ' 9' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.788 0.327 . . . . 0.0 111.257 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.436 ' CD1' ' HG3' ' A' ' 5' ' ' ARG . 4.5 m95 43.38 -163.25 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.058 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -69.16 -54.97 12.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.914 0.387 . . . . 0.0 110.149 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.532 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -140.59 -58.5 0.52 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.368 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.436 ' HG3' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 47.54 93.76 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.81 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.625 HG12 ' C ' ' A' ' 13' ' ' TYR . 0.9 OUTLIER -55.0 -174.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.101 -179.694 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.666 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 98.9 m 0.72 71.97 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.607 0.763 . . . . 0.0 112.671 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.484 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 177.71 -165.21 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.081 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.479 ' C ' ' O ' ' A' ' 8' ' ' TYR . 4.5 mmm-85 -17.52 83.66 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.568 0 O-C-N 123.692 0.62 . . . . 0.0 112.557 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.8 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 124.07 -78.1 0.36 Allowed Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.792 -0.718 . . . . 0.0 113.177 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.8 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.9 OUTLIER -170.99 -172.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 122.18 0.192 . . . . 0.0 110.584 -179.424 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.666 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 72.4 m -92.92 73.97 4.82 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 120.775 0.322 . . . . 0.0 110.192 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.625 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -112.24 108.93 18.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.118 0.485 . . . . 0.0 111.977 -179.649 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.624 ' HA ' HG13 ' A' ' 6' ' ' VAL . 3.6 mtt180 -76.42 101.35 5.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.239 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 170.22 -157.55 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.177 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.433 ' HA ' ' HB2' ' A' ' 4' ' ' PHE . 0.8 OUTLIER 169.05 -30.23 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.916 0.389 . . . . 0.0 110.854 179.447 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.916 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.862 0.363 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.472 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 11.7 m0 64.29 20.37 12.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.267 0.556 . . . . 0.0 110.868 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.477 ' C ' ' SG ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER 173.79 -46.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.018 179.275 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.86 48.52 1.23 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.548 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.424 ' NH1' ' CE2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -94.32 36.41 1.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.001 179.545 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.817 HG12 ' O ' ' A' ' 13' ' ' TYR . 27.1 m -75.14 72.51 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.798 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.682 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 70.9 m 98.93 42.27 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.05 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.46 ' O ' ' N ' ' A' ' 10' ' ' GLY . 28.7 t80 -155.43 -111.28 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.041 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.52 89.39 0.0 OUTLIER 'General case' 0 C--O 1.231 0.129 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.895 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 103.42 -48.68 1.0 Allowed Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.667 -0.777 . . . . 0.0 113.884 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.895 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER 162.39 -174.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 116.966 0.383 . . . . 0.0 110.748 -178.87 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.682 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 14.8 m -67.22 86.53 0.16 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.985 0.421 . . . . 0.0 110.81 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.817 ' O ' HG12 ' A' ' 6' ' ' VAL . 2.5 t80 -91.13 171.72 9.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.47 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.477 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 13.6 mtt-85 -163.99 96.37 0.81 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.614 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.487 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -175.58 -78.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 1.8 m 70.59 12.46 7.34 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.378 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.417 ' HG3' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.324 -0.846 . . . . 0.0 111.853 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.738 0.304 . . . . 0.0 111.129 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -55.82 -170.75 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.018 0.437 . . . . 0.0 111.112 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.0 t -52.74 165.74 0.25 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.117 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -41.35 -31.33 0.23 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.056 0.455 . . . . 0.0 111.138 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -71.88 92.12 1.23 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.045 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.795 HG22 ' HB2' ' A' ' 13' ' ' TYR . 8.5 m -52.33 -16.22 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.725 -179.101 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.619 ' O ' ' CB ' ' A' ' 8' ' ' TYR . 1.8 m -29.89 105.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.635 0.255 . . . . 0.0 111.146 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.619 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 42.0 t80 107.87 177.69 0.0 OUTLIER 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.537 -178.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.94 38.52 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.196 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.433 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 149.99 -72.56 0.29 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.179 -1.01 . . . . 0.0 113.436 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.488 ' O ' HG23 ' A' ' 6' ' ' VAL . 9.3 pt -158.9 -167.2 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 116.684 0.242 . . . . 0.0 111.178 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -119.81 134.39 55.25 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.305 0.574 . . . . 0.0 112.001 -179.857 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.795 ' HB2' HG22 ' A' ' 6' ' ' VAL . 0.3 OUTLIER -112.16 -164.61 0.93 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.188 -0.915 . . . . 0.0 108.823 178.213 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 59.0 mtp180 -155.52 91.11 1.29 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.069 0.462 . . . . 0.0 111.229 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.09 -86.42 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.846 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t 45.18 -92.03 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.559 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.9 mtp85 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.856 -179.953 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.695 0.283 . . . . 0.0 111.38 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.429 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 51.43 49.73 20.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.854 0.359 . . . . 0.0 110.879 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 90.0 m -135.37 -79.56 0.43 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.379 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -105.24 -21.41 13.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.356 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.453 ' NH1' ' CD2' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -82.3 55.98 3.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.862 0.363 . . . . 0.0 110.879 179.909 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.59 HG12 ' C ' ' A' ' 13' ' ' TYR . 2.7 m -58.29 132.93 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.572 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.601 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 71.4 m 108.12 77.74 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.177 0.991 . . . . 0.0 111.307 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.453 ' CD2' ' NH1' ' A' ' 5' ' ' ARG . 42.5 t80 -179.26 -104.85 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.25 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.46 ' O ' ' CZ ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -61.01 83.82 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.067 0 CA-C-O 120.816 0.341 . . . . 0.0 111.798 -179.228 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.469 ' O ' ' CG1' ' A' ' 11' ' ' ILE . . . 89.41 49.87 3.34 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.488 -0.863 . . . . 0.0 113.148 179.277 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.469 ' CG1' ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 69.17 -167.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.769 0.319 . . . . 0.0 111.788 179.559 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.601 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 19.0 m -88.2 -164.53 1.13 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.331 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.59 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 74.56 -67.15 0.27 Allowed 'General case' 0 CA--C 1.513 -0.481 0 CA-C-O 121.945 0.879 . . . . 0.0 110.165 -179.616 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.496 ' N ' ' CG ' ' A' ' 13' ' ' TYR . 0.5 OUTLIER 48.08 176.62 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 113.871 -1.513 . . . . 0.0 112.12 178.928 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.41 129.47 23.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.909 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 t -87.85 114.54 24.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.841 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.905 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 120.704 0.288 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 20.9 m0 59.04 20.58 8.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.279 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.408 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 46.7 t -133.84 -72.52 0.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.751 179.537 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -68.76 -120.52 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.405 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.814 ' O ' HG13 ' A' ' 6' ' ' VAL . 0.2 OUTLIER 49.99 -175.32 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.088 0 O-C-N 122.163 -0.336 . . . . 0.0 110.606 -179.715 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.834 HG12 ' O ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 174.08 113.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.982 0.42 . . . . 0.0 110.878 179.676 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.0 OUTLIER 67.63 70.56 0.35 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.776 -179.671 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.572 ' O ' ' N ' ' A' ' 10' ' ' GLY . 52.6 t80 -178.22 -73.78 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.839 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.403 ' O ' HG13 ' A' ' 11' ' ' ILE . 3.2 mmp_? -48.64 78.4 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.853 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 53.5 16.17 4.92 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 116.064 -0.516 . . . . 0.0 114.123 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.853 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER 163.96 -179.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 117.294 0.547 . . . . 0.0 110.951 179.73 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 3.4 t -97.81 93.41 6.34 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 121.243 0.544 . . . . 0.0 110.682 179.285 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.834 ' O ' HG12 ' A' ' 6' ' ' VAL . 4.5 t80 -75.73 166.33 23.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.444 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -177.4 64.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.943 179.796 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.403 ' HD3' ' HD3' ' A' ' 14' ' ' ARG . 3.2 mpp_? -166.33 81.73 0.27 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.274 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.2 t -161.84 137.94 7.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.915 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.897 179.943 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.408 ' HB2' ' HD2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.696 0.284 . . . . 0.0 111.207 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.472 ' CD1' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -132.23 6.73 4.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.664 179.773 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.946 ' O ' HG23 ' A' ' 6' ' ' VAL . 43.4 t -178.75 66.32 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.93 0.395 . . . . 0.0 110.959 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.438 ' CE2' ' HA ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER 44.78 29.31 0.42 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.661 179.766 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.451 ' HA ' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 42.29 59.66 2.59 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.974 0.416 . . . . 0.0 111.221 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.946 HG23 ' O ' ' A' ' 3' ' ' CYS . 11.2 t -82.97 87.74 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.66 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.586 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER 75.95 48.22 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.92 179.789 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.489 ' OH ' ' HB3' ' A' ' 3' ' ' CYS . 44.9 p90 174.73 176.08 0.17 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.952 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' TYR . 53.0 mtt-85 22.23 48.03 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.691 0.619 . . . . 0.0 112.559 179.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 151.21 -75.35 0.25 Allowed Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.388 -0.911 . . . . 0.0 113.341 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.44 HG23 ' O ' ' A' ' 10' ' ' GLY . 2.0 pt -159.72 -172.8 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.62 0.21 . . . . 0.0 111.433 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.586 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 8.8 t -109.93 118.15 35.69 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.302 0.572 . . . . 0.0 111.362 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.729 ' O ' HG13 ' A' ' 6' ' ' VAL . 1.8 t80 -126.15 60.27 1.3 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.457 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.454 ' C ' ' O ' ' A' ' 13' ' ' TYR . 2.2 mtm-85 -22.33 93.76 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.582 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.09 -82.59 0.0 OUTLIER 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.023 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.807 ' CA ' HG21 ' A' ' 6' ' ' VAL . 25.7 t 56.76 37.47 28.83 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.017 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.293 -0.86 . . . . 0.0 111.01 179.986 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.941 0.4 . . . . 0.0 111.261 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.495 ' CG ' ' OH ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -85.99 -162.55 0.75 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.845 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 4' ' ' PHE . 97.3 m -39.66 -74.0 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.881 0.372 . . . . 0.0 111.144 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER 176.36 -29.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.489 179.591 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.966 ' O ' HG22 ' A' ' 6' ' ' VAL . 89.6 mtt180 -147.3 -158.29 0.9 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.676 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.966 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.5 m 87.14 -166.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 123.226 0.61 . . . . 0.0 111.116 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.746 ' CA ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -52.88 161.74 0.72 Allowed 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.603 -179.465 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.691 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 8.2 p90 55.07 173.28 0.03 OUTLIER 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.7 OUTLIER 28.55 39.85 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 179.961 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.784 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 162.66 -68.51 0.23 Allowed Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.444 -0.884 . . . . 0.0 113.632 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.784 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER -177.43 -90.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 117.125 0.463 . . . . 0.0 111.933 -179.496 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.746 ' HA ' ' CA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -176.05 48.4 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.522 0.677 . . . . 0.0 110.782 179.471 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.589 ' O ' HG12 ' A' ' 6' ' ' VAL . 1.0 OUTLIER -80.9 81.81 7.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.072 179.044 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -44.69 99.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.443 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.787 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 176.44 -164.6 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.623 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 41.5 t 174.26 156.41 0.14 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.763 0.316 . . . . 0.0 110.511 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.308 179.972 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.405 ' HA ' ' NH2' ' A' ' 9' ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.833 0.349 . . . . 0.0 111.178 . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 11.9 t90 65.46 38.78 5.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.126 179.937 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.6 t -96.34 -13.36 23.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.999 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.854 ' CE1' HG22 ' A' ' 6' ' ' VAL . 0.0 OUTLIER -164.42 -3.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.384 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.411 ' HA ' ' HG3' ' A' ' 9' ' ' ARG . 1.8 mtt-85 48.24 35.71 5.85 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.095 0.474 . . . . 0.0 110.632 -179.472 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.854 HG22 ' CE1' ' A' ' 4' ' ' PHE . 23.6 m -86.25 -142.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.289 -179.478 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.2 m -26.92 130.31 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.467 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.593 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.0 OUTLIER 73.75 -75.3 0.08 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.748 -178.652 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.582 ' N ' ' CG ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -51.79 75.86 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.664 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.898 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 93.4 -21.77 38.83 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 114.666 0.626 . . . . 0.0 114.666 178.397 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.898 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER 161.23 -164.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 117.42 0.61 . . . . 0.0 110.315 -179.151 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 m -125.53 102.99 7.63 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.65 0.262 . . . . 0.0 111.319 179.458 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.485 ' CD1' HG12 ' A' ' 6' ' ' VAL . 4.5 p90 -149.83 35.53 0.69 Allowed 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.972 0.415 . . . . 0.0 110.602 178.946 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.546 ' HA ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER -15.86 127.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.917 -179.895 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.443 ' N ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 165.36 94.78 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.869 179.76 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 4' ' ' PHE . 1.2 m -79.74 99.0 7.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.849 0.357 . . . . 0.0 110.927 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.909 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.449 ' HB2' ' HG2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.696 0.284 . . . . 0.0 111.619 . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -66.71 -16.26 64.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.817 0.342 . . . . 0.0 111.071 179.879 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 0.7 OUTLIER -103.47 69.98 1.02 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.804 -179.774 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.732 ' O ' HG22 ' A' ' 6' ' ' VAL . 0.5 OUTLIER 53.33 28.38 7.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.153 0.502 . . . . 0.0 110.667 -179.617 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.449 ' HG2' ' HB2' ' A' ' 1' ' ' LYS . 2.5 mtm180 49.77 33.78 6.71 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.698 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 1.093 HG21 ' CZ ' ' A' ' 13' ' ' TYR . 1.7 m -148.95 50.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-O 121.545 0.688 . . . . 0.0 109.923 179.387 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER 179.44 136.21 0.1 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.976 179.854 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.592 ' O ' ' N ' ' A' ' 10' ' ' GLY . 7.7 t80 72.84 -138.97 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -177.877 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.536 ' HD2' ' CE2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -39.37 84.07 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.78 0.324 . . . . 0.0 111.408 179.649 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.592 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 137.98 -69.91 0.49 Allowed Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.788 -0.72 . . . . 0.0 113.191 -179.708 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 1.089 HD11 HG12 ' A' ' 6' ' ' VAL . 10.9 pt -158.38 -136.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 116.755 0.278 . . . . 0.0 111.031 -179.301 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 166.16 90.61 0.0 OUTLIER 'General case' 0 C--N 1.348 0.526 0 C-N-CA 122.324 0.25 . . . . 0.0 110.793 179.992 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 1.093 ' CZ ' HG21 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -101.45 25.26 8.56 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 119.37 -0.932 . . . . 0.0 111.956 179.297 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 42.13 95.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.127 178.589 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 167.21 59.01 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.504 179.505 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 4' ' ' PHE . 3.2 p -171.2 34.64 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.955 -179.638 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.809 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.854 0.359 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.491 ' CD1' ' HB3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -45.02 -94.77 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.897 -179.72 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 176.64 149.05 0.13 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -179.535 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -42.02 -34.32 0.69 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.489 0.661 . . . . 0.0 109.895 179.736 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.716 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 169.21 148.11 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.598 179.621 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.725 HG11 ' SG ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER 170.05 86.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 121.702 0.763 . . . . 0.0 109.673 -179.575 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.838 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER 32.88 39.99 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.769 -178.002 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.427 ' O ' ' N ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER 171.94 171.95 0.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 113.734 -1.575 . . . . 0.0 108.868 179.875 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.491 ' HB3' ' CD1' ' A' ' 2' ' ' TRP . 1.0 OUTLIER 32.39 37.23 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.526 0.516 . . . . 0.0 111.475 179.304 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.854 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 154.3 -73.03 0.26 Allowed Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.631 -179.865 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.854 HG23 ' O ' ' A' ' 10' ' ' GLY . 1.3 pp -173.27 173.84 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 CA-C-N 116.763 0.282 . . . . 0.0 111.113 -179.333 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.838 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -71.55 66.47 0.5 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.936 0.398 . . . . 0.0 111.624 179.641 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.606 ' CG ' ' HG3' ' A' ' 5' ' ' ARG . 1.5 t80 -73.96 134.79 43.17 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.06 178.932 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 49.81 0.92 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.477 -179.786 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.409 ' HB3' ' CE2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -154.7 -85.32 0.06 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.006 179.986 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.725 ' SG ' HG11 ' A' ' 6' ' ' VAL . 51.9 t 54.74 -100.89 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.457 0.17 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.0 mmm180 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.119 179.938 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.499 ' H3 ' HG21 ' A' ' 6' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 120.649 0.261 . . . . 0.0 111.458 . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.476 ' HD1' ' HH ' ' A' ' 8' ' ' TYR . 5.4 m0 76.06 -145.61 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 179.142 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -19.4 139.91 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.927 0.891 . . . . 0.0 113.396 -178.317 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.559 ' O ' HG12 ' A' ' 6' ' ' VAL . 11.8 m-85 85.95 149.41 0.06 Allowed 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 -179.741 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.469 ' HG2' ' HG3' ' A' ' 14' ' ' ARG . 23.0 mtt180 -74.54 57.88 0.75 Allowed 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.83 0.824 . . . . 0.0 110.014 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.559 HG12 ' O ' ' A' ' 4' ' ' PHE . 0.9 OUTLIER -74.58 -7.12 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.212 179.538 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 13.0 m 43.05 57.33 3.73 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.684 0.754 . . . . 0.0 111.08 179.707 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.601 ' CE1' ' HB2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -106.89 174.68 5.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.436 -1.257 . . . . 0.0 108.93 179.021 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.601 ' HB2' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 39.8 35.31 0.21 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.523 0.678 . . . . 0.0 110.97 178.154 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.466 ' C ' HG22 ' A' ' 11' ' ' ILE . . . 63.64 48.65 75.55 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 115.221 -0.899 . . . . 0.0 113.97 179.534 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.511 HD11 ' HA ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 177.98 127.52 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 117.373 0.587 . . . . 0.0 111.617 179.651 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 83.1 m -72.16 69.83 0.78 Allowed 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.422 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.511 ' HA ' HD11 ' A' ' 11' ' ' ILE . 46.6 t80 -41.21 146.37 0.19 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.461 -178.724 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.533 ' O ' ' CG ' ' A' ' 15' ' ' ARG . 2.0 mmt85 -171.13 79.38 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.027 -179.513 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.533 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER 169.32 73.36 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 120.706 0.288 . . . . 0.0 110.929 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -104.43 170.26 8.0 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.935 0.398 . . . . 0.0 111.455 -179.778 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.827 179.795 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 13' ' ' TYR . 37.1 mttm . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.614 0.245 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.453 ' CD1' ' HG3' ' A' ' 9' ' ' ARG . 99.0 m95 -57.65 -17.87 17.12 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.662 0.268 . . . . 0.0 111.18 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 1.5 m 64.77 102.92 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.058 179.679 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.471 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 11.3 t80 171.93 -18.11 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.813 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 44.7 mtp85 62.6 72.28 0.5 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.119 0.485 . . . . 0.0 109.879 -179.218 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.632 HG11 ' CE1' ' A' ' 8' ' ' TYR . 1.5 p -124.63 -24.35 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.937 -178.695 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 6' ' ' VAL . 42.2 t 67.73 72.33 0.33 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.592 0.234 . . . . 0.0 111.196 179.958 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.661 ' CE1' ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -178.59 -157.36 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.087 179.427 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.661 ' HG2' ' CE1' ' A' ' 8' ' ' TYR . 1.0 OUTLIER 61.54 48.93 5.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.115 0.483 . . . . 0.0 110.062 -178.791 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.783 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 111.61 -35.86 4.5 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.99 -179.535 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.783 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.8 OUTLIER -175.33 -177.44 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.816 0.341 . . . . 0.0 110.74 179.899 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.45 91.0 0.39 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.181 179.551 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.443 ' CZ ' ' HB2' ' A' ' 1' ' ' LYS . 0.9 OUTLIER -71.31 131.03 42.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.17 0.51 . . . . 0.0 111.793 -179.203 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.46 27.18 0.51 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.18 179.585 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.19 64.05 2.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.003 -179.631 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 t -166.3 163.76 17.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.054 179.851 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.2 mmp_? . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.937 -179.953 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.469 ' CB ' ' HA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.534 0.207 . . . . 0.0 111.472 . . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.499 ' CD1' ' HB3' ' A' ' 8' ' ' TYR . 66.8 p-90 -65.59 -20.25 66.24 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.134 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.563 ' HB3' ' OH ' ' A' ' 13' ' ' TYR . 5.1 t -127.07 -15.37 5.31 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.881 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.551 ' N ' ' OH ' ' A' ' 13' ' ' TYR . 11.2 t80 -160.43 -76.17 0.06 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.89 0.376 . . . . 0.0 110.488 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.469 ' HA ' ' CB ' ' A' ' 1' ' ' LYS . 0.0 OUTLIER 178.33 26.66 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.915 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.957 ' C ' HD13 ' A' ' 11' ' ' ILE . 7.5 p -178.7 57.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 179.309 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.736 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 51.8 t -146.73 155.94 42.78 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.938 0.399 . . . . 0.0 111.229 177.271 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.666 ' O ' ' N ' ' A' ' 10' ' ' GLY . 30.8 t80 68.82 -70.65 0.13 Allowed 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -177.916 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -52.95 66.61 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.543 179.173 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.869 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 67.13 29.62 74.71 Favored Glycine 0 CA--C 1.52 0.398 0 CA-C-N 115.848 -0.615 . . . . 0.0 114.25 179.327 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.957 HD13 ' C ' ' A' ' 6' ' ' VAL . 0.8 OUTLIER 178.71 -169.37 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 117.769 0.784 . . . . 0.0 111.709 179.94 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.736 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 2.6 t 178.71 144.43 0.13 Allowed 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 122.331 1.062 . . . . 0.0 113.761 177.883 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.696 ' HD1' HG13 ' A' ' 6' ' ' VAL . 0.5 OUTLIER -105.64 -171.06 1.84 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.12 -1.854 . . . . 0.0 106.67 176.78 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 13' ' ' TYR . 4.0 mmp_? -145.08 63.49 1.29 Allowed 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.726 179.391 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ARG . 7.7 tmm_? -130.72 -76.18 0.53 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.808 179.909 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.4 m 50.8 -87.79 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.435 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.418 ' N ' ' O ' ' A' ' 15' ' ' ARG . 59.3 ttp85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.329 -0.844 . . . . 0.0 111.016 -179.988 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.868 0.366 . . . . 0.0 111.232 . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.493 ' HB2' ' CE2' ' A' ' 8' ' ' TYR . 29.1 m95 -79.21 -1.96 38.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.783 -179.956 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' HG22 ' A' ' 6' ' ' VAL . 28.2 p 179.27 57.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.068 0.461 . . . . 0.0 110.327 179.541 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.409 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 17.6 t80 70.88 33.29 2.2 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.677 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.427 ' HA ' ' HE1' ' A' ' 8' ' ' TYR . 3.3 ptp180 34.55 77.24 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.194 -179.831 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.73 HG21 ' HA ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -118.6 -86.09 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -178.878 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.683 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.5 OUTLIER -90.03 86.08 6.49 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -177.723 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.493 ' CE2' ' HB2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 153.89 -111.43 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.343 0.657 . . . . 0.0 111.134 177.48 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.514 ' CG ' ' O ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -26.8 108.46 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.311 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.07 -60.56 4.4 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 121.008 -0.615 . . . . 0.0 113.529 179.47 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.407 ' C ' HD13 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -157.48 149.39 9.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.236 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.683 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -86.01 99.81 11.71 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 120.095 -0.642 . . . . 0.0 112.17 -179.207 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.717 ' HB3' HG12 ' A' ' 6' ' ' VAL . 2.7 t80 -92.04 105.69 17.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.355 178.914 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 -52.12 93.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.622 -179.237 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -172.15 -88.47 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.845 179.375 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.73 ' HA ' HG21 ' A' ' 6' ' ' VAL . 35.6 t 40.52 -93.62 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 179.668 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.936 -179.87 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.864 0.364 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.2 OUTLIER -62.19 144.65 55.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.995 -179.9 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 4' ' ' PHE . 4.7 t 67.86 -68.73 0.16 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.528 -179.816 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.473 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER 174.22 -33.32 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.23 179.487 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.595 ' O ' HG13 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 168.05 125.65 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.312 179.901 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.595 HG13 ' O ' ' A' ' 5' ' ' ARG . 3.0 m -159.97 171.02 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.147 -179.927 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.3 OUTLIER -40.24 135.44 1.43 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.153 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.565 ' CG ' ' N ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 73.4 179.35 0.22 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.264 -179.823 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.565 ' N ' ' CG ' ' A' ' 8' ' ' TYR . 0.4 OUTLIER 50.31 35.46 10.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 111.518 -179.313 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.422 ' C ' HG23 ' A' ' 11' ' ' ILE . . . 129.68 -58.96 0.7 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.361 -0.923 . . . . 0.0 113.964 179.089 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.422 HG23 ' C ' ' A' ' 10' ' ' GLY . 1.1 pt -157.22 -159.0 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 117.045 0.423 . . . . 0.0 110.968 -179.076 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 12.0 t -133.28 137.56 46.07 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 121.481 0.658 . . . . 0.0 112.021 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.473 ' O ' HG12 ' A' ' 6' ' ' VAL . 0.6 OUTLIER -145.05 83.68 1.69 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.368 179.427 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.2 mtm-85 -61.55 76.77 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.422 -178.945 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' A' ' 13' ' ' TYR . 34.5 mtt-85 -162.51 -96.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.632 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.6 t 42.99 84.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.754 0.312 . . . . 0.0 111.428 179.758 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.926 179.9 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 120.646 0.26 . . . . 0.0 111.412 . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.8 m95 43.94 -158.84 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.343 179.769 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.3 t -58.99 -20.87 56.94 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.127 179.896 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.456 ' CD2' ' HB3' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -170.22 170.64 7.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.078 0.466 . . . . 0.0 111.233 179.971 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 7' ' ' CYS . 4.0 mtt85 -113.6 60.18 0.66 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.413 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.401 ' O ' HG23 ' A' ' 6' ' ' VAL . 15.6 m -63.93 71.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.3 0.572 . . . . 0.0 111.926 -179.284 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.563 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 98.5 m 67.74 52.21 0.76 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.46 179.422 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.452 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 178.77 -176.21 0.23 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.184 178.927 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.452 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 15.7 mmm180 37.24 34.51 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.615 -179.604 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.84 -72.05 0.37 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.121 179.859 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.471 ' N ' HD13 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -156.76 -161.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.65 0.225 . . . . 0.0 111.128 -179.603 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.563 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 5.6 m -93.38 134.98 35.05 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.051 0.453 . . . . 0.0 111.167 179.604 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.42 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER -138.29 171.12 14.86 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.317 -179.767 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 -155.96 48.05 0.49 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.98 0.419 . . . . 0.0 110.963 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -179.99 132.15 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.886 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.456 ' HB3' ' CD2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -126.25 154.46 43.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.712 179.931 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.921 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.421 ' HG3' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 111.507 0.188 . . . . 0.0 111.507 . . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.465 ' CE3' ' O ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -94.87 -72.02 0.64 Allowed 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.854 179.391 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.641 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 43.4 t 179.68 122.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.549 179.718 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.641 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 92.4 m-85 90.03 -44.65 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.916 -179.386 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 47.71 55.52 8.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.168 -179.919 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.506 HG12 ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -104.44 119.94 54.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.658 0.742 . . . . 0.0 112.447 -178.786 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.665 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 82.7 m 65.22 38.53 5.91 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.587 -1.188 . . . . 0.0 110.067 179.862 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.43 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 18.6 t80 -178.45 170.04 1.72 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.814 -1.084 . . . . 0.0 109.99 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.43 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 22.7 mmt180 34.63 36.97 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.516 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.81 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 148.28 -72.33 0.3 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.079 -179.914 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.81 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 179.31 -169.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 116.652 0.226 . . . . 0.0 110.779 -179.419 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.665 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 57.8 m -93.06 92.94 8.05 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.053 0.454 . . . . 0.0 111.0 179.885 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.581 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 0.8 OUTLIER -137.29 99.45 3.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.596 179.676 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.427 ' HG2' HG11 ' A' ' 6' ' ' VAL . 0.4 OUTLIER -79.03 115.48 18.73 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.069 -177.97 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.461 ' HG3' ' CE2' ' A' ' 13' ' ' TYR . 1.0 OUTLIER 167.1 87.44 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.775 179.266 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' CG ' ' A' ' 4' ' ' PHE . 23.0 t -119.67 135.47 54.81 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.741 -179.989 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.833 -179.975 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.6 ttpp . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.85 0.357 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.549 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.1 OUTLIER -178.85 -111.14 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.241 -179.964 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.592 ' HB3' HG11 ' A' ' 6' ' ' VAL . 39.0 t -47.02 130.04 12.21 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.846 0.355 . . . . 0.0 111.018 179.994 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.48 ' O ' ' CD1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -77.85 150.62 34.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.459 -179.951 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.681 ' HA ' ' CD2' ' A' ' 13' ' ' TYR . 0.7 OUTLIER 47.18 81.78 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.107 -179.914 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.797 ' H ' ' HB3' ' A' ' 13' ' ' TYR . 2.5 p 173.14 166.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.81 -176.945 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.564 ' N ' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -57.45 88.48 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.676 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.473 ' HD2' HG13 ' A' ' 6' ' ' VAL . 8.6 p90 -135.74 153.04 51.69 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.395 0.617 . . . . 0.0 112.558 -178.931 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.441 ' HG3' ' N ' ' A' ' 10' ' ' GLY . 6.1 ptm180 39.06 -161.1 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.377 179.239 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.441 ' N ' ' HG3' ' A' ' 9' ' ' ARG . . . -47.78 -21.3 1.46 Allowed Glycine 0 CA--C 1.52 0.368 0 CA-C-N 115.781 -0.645 . . . . 0.0 114.525 -179.069 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.472 ' O ' HD12 ' A' ' 11' ' ' ILE . 1.5 pp -116.19 102.77 14.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 117.918 0.859 . . . . 0.0 111.824 -179.555 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.21 95.73 0.78 Allowed 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.301 179.596 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.797 ' HB3' ' H ' ' A' ' 6' ' ' VAL . 2.4 t80 -85.36 -165.37 1.2 Allowed 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.584 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.434 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 21.6 mtm-85 -156.77 114.53 3.21 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 119.994 -0.682 . . . . 0.0 112.233 -179.698 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 171.56 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.967 179.241 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.42 ' HB2' ' CG2' ' A' ' 6' ' ' VAL . 0.6 OUTLIER 51.22 -163.76 0.06 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.506 -179.956 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.893 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 15.6 m95 . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 120.528 0.204 . . . . 6.15 110.572 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 t -45.0 -29.91 0.93 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.799 0.333 . . . . 2.77 111.137 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.406 ' O ' ' CD ' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 169.23 -3.86 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.173 -0.467 . . . . 6.77 111.891 179.713 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.406 ' CD ' ' O ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 38.14 43.17 0.55 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.021 0.439 . . . . 8.42 111.311 -179.728 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.825 HG12 ' O ' ' A' ' 13' ' ' TYR . 34.8 m -52.31 119.74 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.875 -0.602 . . . . 3.46 111.262 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.486 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 74.2 m 66.03 41.14 3.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.912 -0.585 . . . . 2.5 110.102 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.445 ' CE2' ' HG2' ' A' ' 9' ' ' ARG . 79.0 t80 -175.27 167.01 3.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.578 -0.737 . . . . 5.73 110.378 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.445 ' HG2' ' CE2' ' A' ' 8' ' ' TYR . 0.3 OUTLIER 35.23 36.89 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.298 -0.41 . . . . 5.72 111.685 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.813 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 158.64 -66.42 0.29 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.579 -0.819 . . . . 1.97 112.748 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.813 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 172.84 -178.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 120.864 0.364 . . . . 2.13 111.182 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.486 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 1.7 m -77.18 110.11 11.6 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.96 -0.564 . . . . 2.11 110.299 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.825 ' O ' HG12 ' A' ' 6' ' ' VAL . 2.4 t80 -137.54 68.67 1.41 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 4.0 111.519 -179.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -55.49 97.77 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.432 -0.349 . . . . 5.8 111.039 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.404 ' O ' ' CD2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 179.21 50.59 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.955 0.407 . . . . 5.46 111.099 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.38 -21.27 63.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.329 -0.396 . . . . 2.24 111.083 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.246 -0.883 . . . . 7.57 110.897 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.749 ' N ' ' HH ' ' A' ' 8' ' ' TYR . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.142 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -50.08 -29.82 9.68 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.306 0.574 . . . . 0.0 110.003 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.462 ' O ' ' CB ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -178.01 -63.54 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.157 -0.928 . . . . 0.0 108.697 179.624 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.473 ' HG3' ' CE2' ' A' ' 13' ' ' TYR . 8.3 ptt-85 154.01 45.92 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.173 178.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.631 HG11 ' N ' ' A' ' 15' ' ' ARG . 4.5 m -105.65 116.25 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-O 121.369 0.604 . . . . 0.0 111.781 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.696 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 13.5 m 76.57 25.95 0.9 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.879 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.749 ' HH ' ' N ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 171.69 -176.06 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.127 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.495 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 15.94 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.616 ' C ' HG23 ' A' ' 11' ' ' ILE . . . 131.54 15.8 1.56 Allowed Glycine 0 CA--C 1.524 0.638 0 C-N-CA 120.078 -1.058 . . . . 0.0 114.35 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.616 HG23 ' C ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 80.79 -169.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 117.247 0.523 . . . . 0.0 111.434 179.57 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.696 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 1.9 t -122.81 133.08 54.46 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.528 ' H ' HG12 ' A' ' 6' ' ' VAL . 5.8 p90 -147.53 25.81 1.06 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.908 177.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.84 92.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.697 -1.138 . . . . 0.0 112.347 178.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.631 ' N ' HG11 ' A' ' 6' ' ' VAL . 0.3 OUTLIER 176.65 156.7 0.27 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.2 t -145.64 84.25 1.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.658 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.969 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.859 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.58 ' HB2' ' CZ ' ' A' ' 8' ' ' TYR . 4.0 m0 . . . . . 0 N--CA 1.471 0.616 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 2' ' ' TRP . 1.8 t 95.25 -71.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.777 ' CD1' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -119.5 -19.56 8.12 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -177.198 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.623 ' HA ' ' CE1' ' A' ' 8' ' ' TYR . 2.0 mtp180 69.55 41.35 1.27 Allowed 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.726 -0.39 . . . . 0.0 110.187 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.777 HG22 ' CD1' ' A' ' 4' ' ' PHE . 28.5 m -90.51 91.31 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -178.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.817 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.8 OUTLIER 76.12 56.26 0.05 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.125 178.439 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.623 ' CE1' ' HA ' ' A' ' 5' ' ' ARG . 31.5 p90 175.0 171.08 0.27 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.794 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.563 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 47.23 21.66 0.2 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.77 0.795 . . . . 0.0 110.751 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.772 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 146.69 -62.27 0.45 Allowed Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.981 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.772 HG23 ' O ' ' A' ' 10' ' ' GLY . 1.5 pp -170.22 176.52 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 117.51 0.655 . . . . 0.0 112.505 -178.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.817 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -66.99 77.05 0.13 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.163 -0.472 . . . . 0.0 109.997 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.535 ' HB2' HD12 ' A' ' 11' ' ' ILE . 1.5 t80 -104.76 118.33 36.29 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.97 -178.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.564 ' HA ' ' CG1' ' A' ' 6' ' ' VAL . 0.2 OUTLIER -100.15 126.16 46.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.253 179.496 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.44 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -149.34 -78.14 0.14 Allowed 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.269 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.483 ' N ' ' HB3' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -26.17 136.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.111 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.1 mmp_? . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.923 179.998 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.446 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.746 0.307 . . . . 0.0 110.696 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.887 ' O ' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER 46.52 38.02 5.04 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.958 179.867 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 56.24 -102.66 0.16 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.766 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.6 30.57 1.1 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.152 0.501 . . . . 0.0 110.601 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.887 HG22 ' O ' ' A' ' 3' ' ' CYS . 3.5 m -83.29 -174.17 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.061 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.621 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 3.6 m -41.09 86.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.725 -179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.557 ' O ' ' C ' ' A' ' 9' ' ' ARG . 86.3 t80 164.47 162.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.576 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.557 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 1.32 77.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.196 0.598 . . . . 0.0 112.385 179.581 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.491 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 143.45 -77.12 0.29 Allowed Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.054 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.491 HG23 ' O ' ' A' ' 10' ' ' GLY . 1.4 pp -158.08 -172.58 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.467 0.175 . . . . 0.0 110.739 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.621 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 16.2 t -134.39 84.29 2.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.758 0.313 . . . . 0.0 111.794 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.624 ' CZ ' HG13 ' A' ' 6' ' ' VAL . 7.9 p90 -98.84 12.22 36.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.453 0.645 . . . . 0.0 110.152 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.51 ' O ' ' O ' ' A' ' 13' ' ' TYR . 7.2 mtm-85 41.38 178.76 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.465 -1.243 . . . . 0.0 112.503 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 68.29 59.7 0.41 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.859 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.801 ' HB2' HG21 ' A' ' 6' ' ' VAL . 20.6 t -82.52 132.68 35.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.787 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.872 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.429 ' O ' ' C ' ' A' ' 3' ' ' CYS . 5.6 m95 . . . . . 0 CA--C 1.532 0.263 0 CA-C-O 120.521 0.2 . . . . 0.0 111.323 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.429 ' C ' ' O ' ' A' ' 2' ' ' TRP . 1.0 OUTLIER -25.52 -53.96 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.033 -0.531 . . . . 0.0 112.429 -179.773 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.566 ' CE2' ' CE1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 179.45 -32.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.715 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.479 ' HD2' ' HB2' ' A' ' 9' ' ' ARG . 5.7 mtm-85 62.87 115.96 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.969 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.897 HG12 ' C ' ' A' ' 13' ' ' TYR . 2.6 m -118.65 86.65 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.014 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.655 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 64.6 m 93.37 44.15 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.295 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.433 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 7.6 t80 -179.88 165.82 1.27 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.446 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.479 ' HB2' ' HD2' ' A' ' 5' ' ' ARG . 2.8 ptt180 31.46 38.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.285 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.795 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 156.55 -68.63 0.29 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.207 -0.997 . . . . 0.0 113.529 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.795 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 177.94 -178.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 120.522 0.201 . . . . 0.0 111.146 -179.396 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.655 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 15.2 m -82.12 65.8 7.42 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.375 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.897 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -63.48 -154.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.838 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.605 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER 162.69 109.2 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.421 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.605 ' HB2' ' O ' ' A' ' 14' ' ' ARG . 6.2 mmp_? 110.03 78.64 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.562 0.745 . . . . 0.0 111.301 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.421 ' HA ' ' CG ' ' A' ' 4' ' ' PHE . 29.7 t -69.59 -80.46 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.006 0.431 . . . . 0.0 110.655 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.335 -0.84 . . . . 0.0 110.921 179.914 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.425 ' CE2' ' HG2' ' A' ' 9' ' ' ARG . 10.9 m-90 . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.898 0.38 . . . . 0.0 111.291 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.87 ' O ' HG22 ' A' ' 6' ' ' VAL . 2.7 t -144.47 65.84 1.28 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.776 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.479 ' CD1' ' OH ' ' A' ' 13' ' ' TYR . 1.6 t80 57.47 21.03 6.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.9 mtm-85 62.7 38.62 11.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.767 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.87 HG22 ' O ' ' A' ' 3' ' ' CYS . 1.5 m -77.16 -104.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.966 -0.294 . . . . 0.0 110.425 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.2 m -77.26 146.78 36.67 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 122.161 -0.337 . . . . 0.0 110.2 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.501 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 49.2 p90 49.7 176.61 0.01 OUTLIER 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.984 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.425 ' HG2' ' CE2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 34.28 34.73 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.974 0.416 . . . . 0.0 111.259 -179.189 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.869 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 166.59 -64.11 0.21 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.491 -179.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.869 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER -178.04 -104.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 179.765 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.0 OUTLIER 168.35 62.64 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.637 0.256 . . . . 0.0 110.713 -179.631 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.596 ' CE2' HG12 ' A' ' 6' ' ' VAL . 7.0 p90 -98.88 27.95 4.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.511 0.672 . . . . 0.0 110.779 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.448 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 44.61 -165.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.601 178.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.95 46.42 1.22 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.074 0.464 . . . . 0.0 110.695 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.795 ' HB2' HG21 ' A' ' 6' ' ' VAL . 39.1 t -100.83 -77.11 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.803 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.897 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.466 ' CE2' ' CB ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.146 0 CA-C-O 120.568 0.223 . . . . 0.0 110.607 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -103.73 -76.06 0.6 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.228 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.451 ' CE1' ' HD3' ' A' ' 14' ' ' ARG . 1.4 t80 -94.47 -34.16 12.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.129 0.49 . . . . 0.0 110.827 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.52 ' O ' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -89.58 32.09 0.89 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.802 178.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.939 HG21 ' CE1' ' A' ' 13' ' ' TYR . 10.1 p -60.07 -4.48 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 8' ' ' TYR . 0.5 OUTLIER -66.36 66.18 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.528 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.529 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER 175.01 -94.42 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 178.643 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.529 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 13.1 mmp_? -62.4 79.23 0.02 OUTLIER 'General case' 0 C--O 1.233 0.228 0 CA-C-O 120.984 0.421 . . . . 0.0 109.889 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.71 ' C ' HD13 ' A' ' 11' ' ' ILE . . . 116.56 48.06 0.48 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.539 -0.624 . . . . 0.0 111.539 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.71 HD13 ' C ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 45.82 -168.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-O 120.629 0.252 . . . . 0.0 111.569 -179.56 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.3 m -105.35 128.5 53.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.03 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.939 ' CE1' HG21 ' A' ' 6' ' ' VAL . 7.5 p90 -172.24 44.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.264 0.554 . . . . 0.0 111.048 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.451 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 61.2 mtt85 -34.05 110.59 0.09 Allowed 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.948 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -160.18 73.09 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.71 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t -131.55 132.21 43.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.628 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.939 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.907 0.384 . . . . 0.0 110.923 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER 178.79 -68.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.43 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -166.22 35.74 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.325 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 65.04 34.58 8.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.639 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.864 HG12 ' O ' ' A' ' 13' ' ' TYR . 16.5 m -66.87 178.42 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.515 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 20.3 m -35.5 129.41 0.56 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.048 0.451 . . . . 0.0 111.647 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.434 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 1.3 t80 82.85 -175.53 0.03 OUTLIER 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.829 -178.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.41 ' HD3' ' HB3' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 37.56 37.26 0.1 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.801 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.416 ' C ' HG23 ' A' ' 11' ' ' ILE . . . 137.83 -70.6 0.48 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.434 -0.889 . . . . 0.0 113.318 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.436 ' O ' ' O ' ' A' ' 6' ' ' VAL . 1.4 pt -157.59 -163.9 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.67 0.235 . . . . 0.0 111.084 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 m -113.44 123.16 49.38 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-O 121.212 0.529 . . . . 0.0 111.321 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.864 ' O ' HG12 ' A' ' 6' ' ' VAL . 0.7 OUTLIER -153.11 54.21 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.428 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -45.54 114.06 0.69 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.572 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 17' ' ' ARG . 17.5 tpp85 -178.52 -91.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.716 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.9 t 43.91 -92.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.63 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 15' ' ' ARG . 5.7 tmm_? . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.791 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 7.3 p-90 . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.983 0.42 . . . . 0.0 111.127 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.9 t -134.19 -79.68 0.46 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.953 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.536 ' O ' ' C ' ' A' ' 5' ' ' ARG . 1.5 p90 -147.09 -48.78 0.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.293 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.536 ' C ' ' O ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 4.94 89.14 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.491 -179.702 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.728 HG13 ' HG2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -54.22 -167.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.437 -179.542 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.626 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 64.2 m -19.39 87.28 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.795 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.726 ' O ' ' N ' ' A' ' 10' ' ' GLY . 54.1 t80 -177.33 -86.46 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.017 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.412 ' O ' HD12 ' A' ' 11' ' ' ILE . 29.3 mmt-85 -48.27 70.13 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.92 0.39 . . . . 0.0 111.705 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.955 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 58.84 12.47 14.79 Favored Glycine 0 CA--C 1.521 0.428 0 CA-C-N 116.122 -0.49 . . . . 0.0 113.496 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.955 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.9 OUTLIER 166.68 -177.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-N 117.225 0.512 . . . . 0.0 111.32 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.698 ' HB3' HG12 ' A' ' 6' ' ' VAL . 3.1 m -106.71 -158.56 0.66 Allowed 'General case' 0 C--O 1.23 0.05 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.197 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.704 ' H ' HG12 ' A' ' 6' ' ' VAL . 0.1 OUTLIER 107.0 152.03 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.458 1.103 . . . . 0.0 111.034 179.71 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.728 ' HG2' HG13 ' A' ' 6' ' ' VAL . 6.9 mtp180 -150.17 110.22 4.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.327 -178.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -126.36 -82.13 0.62 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.925 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 15' ' ' ARG . 1.2 m 20.16 -89.05 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.272 0.629 . . . . 0.0 112.528 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.9 ptp85 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.481 179.903 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.42 ' CZ2' ' HG2' ' A' ' 5' ' ' ARG . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.134 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' ' CB ' ' A' ' 4' ' ' PHE . 7.6 t -48.65 -23.83 1.15 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.441 0.163 . . . . 0.0 111.386 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.473 ' CB ' ' O ' ' A' ' 3' ' ' CYS . 0.6 OUTLIER 85.42 97.96 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.972 179.85 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.517 ' O ' HG23 ' A' ' 6' ' ' VAL . 0.0 OUTLIER -90.97 49.62 1.67 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.503 179.592 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.773 HG12 ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 47.49 -178.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.456 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.686 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 90.8 m 19.86 59.21 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 114.963 -1.017 . . . . 0.0 113.018 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 3.1 t80 174.38 170.77 0.23 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.314 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 mmt180 43.57 26.49 0.12 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.166 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.794 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 147.3 -63.55 0.43 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 119.958 -1.115 . . . . 0.0 113.923 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.794 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -174.17 -172.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 117.057 0.428 . . . . 0.0 111.661 -178.91 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.686 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 21.5 m -99.71 103.54 15.21 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.898 0.38 . . . . 0.0 111.699 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.773 ' N ' HG12 ' A' ' 6' ' ' VAL . 1.2 p90 -139.84 95.54 2.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.492 0.663 . . . . 0.0 110.019 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -66.38 94.28 0.26 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.359 -178.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.87 70.06 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.035 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.2 -28.01 9.26 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.759 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.965 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.471 ' O ' ' N ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.526 0.05 0 CA-C-O 120.542 0.21 . . . . 0.0 111.197 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.452 ' HB2' HG22 ' A' ' 6' ' ' VAL . 56.7 m 43.27 -89.65 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.471 ' N ' ' O ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -164.13 48.09 0.12 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.247 0.546 . . . . 0.0 109.635 179.101 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.604 ' O ' HD11 ' A' ' 11' ' ' ILE . 15.2 mtm-85 81.55 56.63 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.805 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.695 HG12 ' CE2' ' A' ' 13' ' ' TYR . 26.8 m -111.87 -139.31 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.395 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -54.11 149.31 9.64 Favored 'General case' 0 CA--C 1.52 -0.206 0 O-C-N 122.049 -0.407 . . . . 0.0 110.776 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.528 ' O ' ' N ' ' A' ' 10' ' ' GLY . 5.2 t80 72.21 -136.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.436 ' HD2' ' CD2' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -39.29 89.55 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.856 0.36 . . . . 0.0 111.174 179.395 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.617 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 135.48 -70.78 0.5 Allowed Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.503 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.753 HD12 ' N ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -179.71 -100.36 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 O-C-N 122.97 -0.135 . . . . 0.0 111.167 179.921 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 176.25 62.81 0.01 OUTLIER 'General case' 0 C--N 1.342 0.253 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.662 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.695 ' CE2' HG12 ' A' ' 6' ' ' VAL . 1.5 p90 -102.49 96.55 6.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.721 0.772 . . . . 0.0 109.316 178.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -57.02 117.05 3.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.716 -178.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 1.5 mmm180 -159.08 -91.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.54 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.437 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 31.69 61.85 0.28 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 111.939 179.547 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.936 -179.91 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.434 ' CH2' ' HG3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.448 0 CA-C-O 120.982 0.42 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 t 177.43 122.55 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.644 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.483 ' C ' ' HG2' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 54.22 -165.3 0.09 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.98 -179.41 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.483 ' HG2' ' C ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 45.07 40.04 4.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.015 0.436 . . . . 0.0 110.401 179.564 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.485 HG11 ' O ' ' A' ' 13' ' ' TYR . 31.0 m -40.77 162.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.413 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.641 ' HA ' ' O ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER 74.23 143.23 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.817 -179.662 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.56 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 35.1 t80 97.27 173.5 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.798 -178.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 35.3 37.71 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.984 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.418 ' C ' HG13 ' A' ' 11' ' ' ILE . . . 154.48 -68.64 0.3 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.251 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.643 ' N ' HD12 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -173.06 -89.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 116.748 0.274 . . . . 0.0 111.562 -179.545 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -168.13 120.93 0.87 Allowed 'General case' 0 CA--C 1.522 -0.107 0 CA-C-O 120.747 0.308 . . . . 0.0 110.321 179.699 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.485 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -99.76 175.29 5.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.413 179.899 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.13 26.65 0.7 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.619 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.22 122.38 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.6 t -77.87 64.12 3.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.974 0.416 . . . . 0.0 110.828 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 ptp85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.862 179.952 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.58 ' N ' ' HH ' ' A' ' 8' ' ' TYR . 87.8 m95 . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 5' ' ' ARG . 1.6 t 69.6 -57.76 0.53 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 122.147 0.179 . . . . 0.0 111.401 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.727 ' HB3' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -43.32 -30.02 0.47 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.77 0.319 . . . . 0.0 111.682 -179.447 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.599 ' HA ' ' CD2' ' A' ' 8' ' ' TYR . 4.0 ptp180 37.73 35.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.746 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.727 HG22 ' HB3' ' A' ' 4' ' ' PHE . 1.7 m -109.22 77.77 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.452 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.669 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 62.0 m 83.45 44.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.487 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.599 ' CD2' ' HA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -147.81 147.13 29.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.722 -1.127 . . . . 0.0 109.004 179.089 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.563 ' HB2' ' CD1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 33.59 -85.68 0.0 OUTLIER 'General case' 0 CA--C 1.522 -0.105 0 CA-C-O 121.647 0.737 . . . . 0.0 111.895 179.312 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.837 ' O ' HG23 ' A' ' 11' ' ' ILE . . . -51.64 -75.27 0.23 Allowed Glycine 0 C--N 1.297 -1.623 0 CA-C-N 114.348 -1.297 . . . . 0.0 113.571 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.837 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -177.35 -174.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-N 116.823 0.312 . . . . 0.0 111.401 -179.063 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.669 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 23.8 m -84.13 60.0 5.65 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.252 0.548 . . . . 0.0 109.651 178.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.462 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 2.6 t80 -87.27 105.02 16.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.792 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.541 ' HA ' HG12 ' A' ' 6' ' ' VAL . 36.4 mtp85 -66.59 64.48 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.859 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.428 ' O ' ' CG ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER 170.04 -163.49 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.259 179.585 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -145.06 56.88 1.26 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.919 0.39 . . . . 0.0 110.666 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.93 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.436 ' CD1' ' HG3' ' A' ' 5' ' ' ARG . 4.5 m95 . . . . . 0 N--CA 1.466 0.325 0 CA-C-O 120.707 0.289 . . . . 0.0 111.058 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -69.16 -54.97 12.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.914 0.387 . . . . 0.0 110.149 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.532 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -140.59 -58.5 0.52 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.368 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.436 ' HG3' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 47.54 93.76 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.81 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.625 HG12 ' C ' ' A' ' 13' ' ' TYR . 0.9 OUTLIER -55.0 -174.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.101 -179.694 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.666 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 98.9 m 0.72 71.97 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.607 0.763 . . . . 0.0 112.671 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.484 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 177.71 -165.21 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.081 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.479 ' C ' ' O ' ' A' ' 8' ' ' TYR . 4.5 mmm-85 -17.52 83.66 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.568 0 O-C-N 123.692 0.62 . . . . 0.0 112.557 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.8 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 124.07 -78.1 0.36 Allowed Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.792 -0.718 . . . . 0.0 113.177 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.8 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.9 OUTLIER -170.99 -172.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 122.18 0.192 . . . . 0.0 110.584 -179.424 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.666 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 72.4 m -92.92 73.97 4.82 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 120.775 0.322 . . . . 0.0 110.192 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.625 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -112.24 108.93 18.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.118 0.485 . . . . 0.0 111.977 -179.649 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.624 ' HA ' HG13 ' A' ' 6' ' ' VAL . 3.6 mtt180 -76.42 101.35 5.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.239 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 170.22 -157.55 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.177 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.433 ' HA ' ' HB2' ' A' ' 4' ' ' PHE . 0.8 OUTLIER 169.05 -30.23 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.916 0.389 . . . . 0.0 110.854 179.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.916 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.472 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 11.7 m0 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 121.267 0.556 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.477 ' C ' ' SG ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER 173.79 -46.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.018 179.275 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.86 48.52 1.23 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.548 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.424 ' NH1' ' CE2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -94.32 36.41 1.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.001 179.545 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.817 HG12 ' O ' ' A' ' 13' ' ' TYR . 27.1 m -75.14 72.51 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.798 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.682 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 70.9 m 98.93 42.27 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.05 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.46 ' O ' ' N ' ' A' ' 10' ' ' GLY . 28.7 t80 -155.43 -111.28 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.041 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.52 89.39 0.0 OUTLIER 'General case' 0 C--O 1.231 0.129 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.895 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 103.42 -48.68 1.0 Allowed Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.667 -0.777 . . . . 0.0 113.884 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.895 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER 162.39 -174.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 116.966 0.383 . . . . 0.0 110.748 -178.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.682 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 14.8 m -67.22 86.53 0.16 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.985 0.421 . . . . 0.0 110.81 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.817 ' O ' HG12 ' A' ' 6' ' ' VAL . 2.5 t80 -91.13 171.72 9.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.47 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.477 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 13.6 mtt-85 -163.99 96.37 0.81 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.614 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.487 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -175.58 -78.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 1.8 m 70.59 12.46 7.34 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.378 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.417 ' HG3' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.324 -0.846 . . . . 0.0 111.853 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 1.2 m95 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.018 0.437 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.0 t -52.74 165.74 0.25 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.117 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -41.35 -31.33 0.23 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.056 0.455 . . . . 0.0 111.138 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -71.88 92.12 1.23 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.045 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.795 HG22 ' HB2' ' A' ' 13' ' ' TYR . 8.5 m -52.33 -16.22 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.725 -179.101 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.619 ' O ' ' CB ' ' A' ' 8' ' ' TYR . 1.8 m -29.89 105.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.635 0.255 . . . . 0.0 111.146 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.619 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 42.0 t80 107.87 177.69 0.0 OUTLIER 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.537 -178.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.94 38.52 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.196 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.433 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 149.99 -72.56 0.29 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.179 -1.01 . . . . 0.0 113.436 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.488 ' O ' HG23 ' A' ' 6' ' ' VAL . 9.3 pt -158.9 -167.2 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 116.684 0.242 . . . . 0.0 111.178 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -119.81 134.39 55.25 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.305 0.574 . . . . 0.0 112.001 -179.857 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.795 ' HB2' HG22 ' A' ' 6' ' ' VAL . 0.3 OUTLIER -112.16 -164.61 0.93 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.188 -0.915 . . . . 0.0 108.823 178.213 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 59.0 mtp180 -155.52 91.11 1.29 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.069 0.462 . . . . 0.0 111.229 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.09 -86.42 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.846 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t 45.18 -92.03 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.559 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.9 mtp85 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.856 -179.953 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.429 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.159 0 CA-C-O 120.854 0.359 . . . . 0.0 110.879 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 90.0 m -135.37 -79.56 0.43 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.379 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -105.24 -21.41 13.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.356 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.453 ' NH1' ' CD2' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -82.3 55.98 3.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.862 0.363 . . . . 0.0 110.879 179.909 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.59 HG12 ' C ' ' A' ' 13' ' ' TYR . 2.7 m -58.29 132.93 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.572 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.601 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 71.4 m 108.12 77.74 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.177 0.991 . . . . 0.0 111.307 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.453 ' CD2' ' NH1' ' A' ' 5' ' ' ARG . 42.5 t80 -179.26 -104.85 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.25 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.46 ' O ' ' CZ ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -61.01 83.82 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.067 0 CA-C-O 120.816 0.341 . . . . 0.0 111.798 -179.228 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.469 ' O ' ' CG1' ' A' ' 11' ' ' ILE . . . 89.41 49.87 3.34 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.488 -0.863 . . . . 0.0 113.148 179.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.469 ' CG1' ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 69.17 -167.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.769 0.319 . . . . 0.0 111.788 179.559 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.601 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 19.0 m -88.2 -164.53 1.13 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.331 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.59 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 74.56 -67.15 0.27 Allowed 'General case' 0 CA--C 1.513 -0.481 0 CA-C-O 121.945 0.879 . . . . 0.0 110.165 -179.616 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.496 ' N ' ' CG ' ' A' ' 13' ' ' TYR . 0.5 OUTLIER 48.08 176.62 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 113.871 -1.513 . . . . 0.0 112.12 178.928 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.41 129.47 23.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.909 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 t -87.85 114.54 24.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.841 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.905 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 20.9 m0 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.619 0.247 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.408 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 46.7 t -133.84 -72.52 0.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.751 179.537 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -68.76 -120.52 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.405 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.814 ' O ' HG13 ' A' ' 6' ' ' VAL . 0.2 OUTLIER 49.99 -175.32 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.088 0 O-C-N 122.163 -0.336 . . . . 0.0 110.606 -179.715 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.834 HG12 ' O ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 174.08 113.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.982 0.42 . . . . 0.0 110.878 179.676 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.0 OUTLIER 67.63 70.56 0.35 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.776 -179.671 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.572 ' O ' ' N ' ' A' ' 10' ' ' GLY . 52.6 t80 -178.22 -73.78 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.839 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.403 ' O ' HG13 ' A' ' 11' ' ' ILE . 3.2 mmp_? -48.64 78.4 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.853 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 53.5 16.17 4.92 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 116.064 -0.516 . . . . 0.0 114.123 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.853 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER 163.96 -179.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 117.294 0.547 . . . . 0.0 110.951 179.73 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 3.4 t -97.81 93.41 6.34 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 121.243 0.544 . . . . 0.0 110.682 179.285 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.834 ' O ' HG12 ' A' ' 6' ' ' VAL . 4.5 t80 -75.73 166.33 23.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.444 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -177.4 64.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.943 179.796 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.403 ' HD3' ' HD3' ' A' ' 14' ' ' ARG . 3.2 mpp_? -166.33 81.73 0.27 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.274 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.2 t -161.84 137.94 7.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.915 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.897 179.943 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.472 ' CD1' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.946 ' O ' HG23 ' A' ' 6' ' ' VAL . 43.4 t -178.75 66.32 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.93 0.395 . . . . 0.0 110.959 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.438 ' CE2' ' HA ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER 44.78 29.31 0.42 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.661 179.766 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.451 ' HA ' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 42.29 59.66 2.59 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.974 0.416 . . . . 0.0 111.221 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.946 HG23 ' O ' ' A' ' 3' ' ' CYS . 11.2 t -82.97 87.74 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.66 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.586 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER 75.95 48.22 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.92 179.789 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.489 ' OH ' ' HB3' ' A' ' 3' ' ' CYS . 44.9 p90 174.73 176.08 0.17 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.952 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' TYR . 53.0 mtt-85 22.23 48.03 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.691 0.619 . . . . 0.0 112.559 179.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 151.21 -75.35 0.25 Allowed Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.388 -0.911 . . . . 0.0 113.341 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.44 HG23 ' O ' ' A' ' 10' ' ' GLY . 2.0 pt -159.72 -172.8 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.62 0.21 . . . . 0.0 111.433 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.586 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 8.8 t -109.93 118.15 35.69 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.302 0.572 . . . . 0.0 111.362 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.729 ' O ' HG13 ' A' ' 6' ' ' VAL . 1.8 t80 -126.15 60.27 1.3 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.457 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.454 ' C ' ' O ' ' A' ' 13' ' ' TYR . 2.2 mtm-85 -22.33 93.76 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.582 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.09 -82.59 0.0 OUTLIER 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.023 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.807 ' CA ' HG21 ' A' ' 6' ' ' VAL . 25.7 t 56.76 37.47 28.83 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.017 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.293 -0.86 . . . . 0.0 111.01 179.986 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.495 ' CG ' ' OH ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.169 0 CA-C-O 120.342 0.115 . . . . 0.0 110.845 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 4' ' ' PHE . 97.3 m -39.66 -74.0 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.881 0.372 . . . . 0.0 111.144 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER 176.36 -29.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.489 179.591 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.966 ' O ' HG22 ' A' ' 6' ' ' VAL . 89.6 mtt180 -147.3 -158.29 0.9 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.676 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.966 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.5 m 87.14 -166.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 123.226 0.61 . . . . 0.0 111.116 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.746 ' CA ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -52.88 161.74 0.72 Allowed 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.603 -179.465 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.691 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 8.2 p90 55.07 173.28 0.03 OUTLIER 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.7 OUTLIER 28.55 39.85 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 179.961 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.784 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 162.66 -68.51 0.23 Allowed Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.444 -0.884 . . . . 0.0 113.632 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.784 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER -177.43 -90.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 117.125 0.463 . . . . 0.0 111.933 -179.496 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.746 ' HA ' ' CA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -176.05 48.4 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.522 0.677 . . . . 0.0 110.782 179.471 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.589 ' O ' HG12 ' A' ' 6' ' ' VAL . 1.0 OUTLIER -80.9 81.81 7.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.072 179.044 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -44.69 99.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.443 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.787 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 176.44 -164.6 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.623 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 41.5 t 174.26 156.41 0.14 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.763 0.316 . . . . 0.0 110.511 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.308 179.972 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 11.9 t90 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.789 0.328 . . . . 0.0 111.126 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.6 t -96.34 -13.36 23.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.999 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.854 ' CE1' HG22 ' A' ' 6' ' ' VAL . 0.0 OUTLIER -164.42 -3.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.384 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.411 ' HA ' ' HG3' ' A' ' 9' ' ' ARG . 1.8 mtt-85 48.24 35.71 5.85 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.095 0.474 . . . . 0.0 110.632 -179.472 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.854 HG22 ' CE1' ' A' ' 4' ' ' PHE . 23.6 m -86.25 -142.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.289 -179.478 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.2 m -26.92 130.31 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.467 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.593 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.0 OUTLIER 73.75 -75.3 0.08 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.748 -178.652 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.582 ' N ' ' CG ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -51.79 75.86 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.664 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.898 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 93.4 -21.77 38.83 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 114.666 0.626 . . . . 0.0 114.666 178.397 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.898 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER 161.23 -164.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 117.42 0.61 . . . . 0.0 110.315 -179.151 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 m -125.53 102.99 7.63 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.65 0.262 . . . . 0.0 111.319 179.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.485 ' CD1' HG12 ' A' ' 6' ' ' VAL . 4.5 p90 -149.83 35.53 0.69 Allowed 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.972 0.415 . . . . 0.0 110.602 178.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.546 ' HA ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER -15.86 127.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.917 -179.895 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.443 ' N ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 165.36 94.78 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.869 179.76 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 4' ' ' PHE . 1.2 m -79.74 99.0 7.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.849 0.357 . . . . 0.0 110.927 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.909 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 8.2 m95 . . . . . 0 CA--C 1.53 0.177 0 CA-C-O 120.817 0.342 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 0.7 OUTLIER -103.47 69.98 1.02 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.804 -179.774 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.732 ' O ' HG22 ' A' ' 6' ' ' VAL . 0.5 OUTLIER 53.33 28.38 7.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.153 0.502 . . . . 0.0 110.667 -179.617 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 49.77 33.78 6.71 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.698 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 1.093 HG21 ' CZ ' ' A' ' 13' ' ' TYR . 1.7 m -148.95 50.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-O 121.545 0.688 . . . . 0.0 109.923 179.387 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER 179.44 136.21 0.1 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.976 179.854 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.592 ' O ' ' N ' ' A' ' 10' ' ' GLY . 7.7 t80 72.84 -138.97 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -177.877 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.536 ' HD2' ' CE2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -39.37 84.07 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.78 0.324 . . . . 0.0 111.408 179.649 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.592 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 137.98 -69.91 0.49 Allowed Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.788 -0.72 . . . . 0.0 113.191 -179.708 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 1.089 HD11 HG12 ' A' ' 6' ' ' VAL . 10.9 pt -158.38 -136.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 116.755 0.278 . . . . 0.0 111.031 -179.301 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 166.16 90.61 0.0 OUTLIER 'General case' 0 C--N 1.348 0.526 0 C-N-CA 122.324 0.25 . . . . 0.0 110.793 179.992 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 1.093 ' CZ ' HG21 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -101.45 25.26 8.56 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 119.37 -0.932 . . . . 0.0 111.956 179.297 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 42.13 95.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.127 178.589 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 167.21 59.01 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.504 179.505 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 4' ' ' PHE . 3.2 p -171.2 34.64 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.955 -179.638 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.809 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.491 ' CD1' ' HB3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.33 0 CA-C-O 120.821 0.343 . . . . 0.0 111.897 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 176.64 149.05 0.13 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -179.535 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -42.02 -34.32 0.69 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.489 0.661 . . . . 0.0 109.895 179.736 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.716 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 169.21 148.11 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.598 179.621 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.725 HG11 ' SG ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER 170.05 86.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 121.702 0.763 . . . . 0.0 109.673 -179.575 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.838 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER 32.88 39.99 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.769 -178.002 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.427 ' O ' ' N ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER 171.94 171.95 0.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 113.734 -1.575 . . . . 0.0 108.868 179.875 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.491 ' HB3' ' CD1' ' A' ' 2' ' ' TRP . 1.0 OUTLIER 32.39 37.23 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.526 0.516 . . . . 0.0 111.475 179.304 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.854 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 154.3 -73.03 0.26 Allowed Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.631 -179.865 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.854 HG23 ' O ' ' A' ' 10' ' ' GLY . 1.3 pp -173.27 173.84 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 CA-C-N 116.763 0.282 . . . . 0.0 111.113 -179.333 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.838 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -71.55 66.47 0.5 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.936 0.398 . . . . 0.0 111.624 179.641 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.606 ' CG ' ' HG3' ' A' ' 5' ' ' ARG . 1.5 t80 -73.96 134.79 43.17 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.06 178.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 49.81 0.92 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.477 -179.786 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.409 ' HB3' ' CE2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -154.7 -85.32 0.06 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.006 179.986 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.725 ' SG ' HG11 ' A' ' 6' ' ' VAL . 51.9 t 54.74 -100.89 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.457 0.17 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.0 mmm180 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.119 179.938 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.476 ' HD1' ' HH ' ' A' ' 8' ' ' TYR . 5.4 m0 . . . . . 0 CA--C 1.543 0.675 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -19.4 139.91 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.927 0.891 . . . . 0.0 113.396 -178.317 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.559 ' O ' HG12 ' A' ' 6' ' ' VAL . 11.8 m-85 85.95 149.41 0.06 Allowed 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 -179.741 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.469 ' HG2' ' HG3' ' A' ' 14' ' ' ARG . 23.0 mtt180 -74.54 57.88 0.75 Allowed 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.83 0.824 . . . . 0.0 110.014 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.559 HG12 ' O ' ' A' ' 4' ' ' PHE . 0.9 OUTLIER -74.58 -7.12 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.212 179.538 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 13.0 m 43.05 57.33 3.73 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.684 0.754 . . . . 0.0 111.08 179.707 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.601 ' CE1' ' HB2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -106.89 174.68 5.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.436 -1.257 . . . . 0.0 108.93 179.021 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.601 ' HB2' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 39.8 35.31 0.21 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.523 0.678 . . . . 0.0 110.97 178.154 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.466 ' C ' HG22 ' A' ' 11' ' ' ILE . . . 63.64 48.65 75.55 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 115.221 -0.899 . . . . 0.0 113.97 179.534 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.511 HD11 ' HA ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 177.98 127.52 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 117.373 0.587 . . . . 0.0 111.617 179.651 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 83.1 m -72.16 69.83 0.78 Allowed 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.422 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.511 ' HA ' HD11 ' A' ' 11' ' ' ILE . 46.6 t80 -41.21 146.37 0.19 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.461 -178.724 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.533 ' O ' ' CG ' ' A' ' 15' ' ' ARG . 2.0 mmt85 -171.13 79.38 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.027 -179.513 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.533 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER 169.32 73.36 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 120.706 0.288 . . . . 0.0 110.929 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -104.43 170.26 8.0 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.935 0.398 . . . . 0.0 111.455 -179.778 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.827 179.795 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.453 ' CD1' ' HG3' ' A' ' 9' ' ' ARG . 99.0 m95 . . . . . 0 CA--C 1.531 0.229 0 CA-C-O 120.662 0.268 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 1.5 m 64.77 102.92 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.058 179.679 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.471 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 11.3 t80 171.93 -18.11 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.813 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 44.7 mtp85 62.6 72.28 0.5 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.119 0.485 . . . . 0.0 109.879 -179.218 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.632 HG11 ' CE1' ' A' ' 8' ' ' TYR . 1.5 p -124.63 -24.35 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.937 -178.695 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 6' ' ' VAL . 42.2 t 67.73 72.33 0.33 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.592 0.234 . . . . 0.0 111.196 179.958 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.661 ' CE1' ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -178.59 -157.36 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.087 179.427 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.661 ' HG2' ' CE1' ' A' ' 8' ' ' TYR . 1.0 OUTLIER 61.54 48.93 5.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.115 0.483 . . . . 0.0 110.062 -178.791 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.783 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 111.61 -35.86 4.5 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.99 -179.535 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.783 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.8 OUTLIER -175.33 -177.44 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.816 0.341 . . . . 0.0 110.74 179.899 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.45 91.0 0.39 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.181 179.551 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -71.31 131.03 42.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.17 0.51 . . . . 0.0 111.793 -179.203 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.46 27.18 0.51 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.18 179.585 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.19 64.05 2.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.003 -179.631 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 t -166.3 163.76 17.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.054 179.851 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.2 mmp_? . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.937 -179.953 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.499 ' CD1' ' HB3' ' A' ' 8' ' ' TYR . 66.8 p-90 . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.563 ' HB3' ' OH ' ' A' ' 13' ' ' TYR . 5.1 t -127.07 -15.37 5.31 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.881 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.551 ' N ' ' OH ' ' A' ' 13' ' ' TYR . 11.2 t80 -160.43 -76.17 0.06 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.89 0.376 . . . . 0.0 110.488 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.423 ' O ' ' HB ' ' A' ' 6' ' ' VAL . 0.0 OUTLIER 178.33 26.66 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.915 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.957 ' C ' HD13 ' A' ' 11' ' ' ILE . 7.5 p -178.7 57.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 179.309 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.736 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 51.8 t -146.73 155.94 42.78 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.938 0.399 . . . . 0.0 111.229 177.271 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.666 ' O ' ' N ' ' A' ' 10' ' ' GLY . 30.8 t80 68.82 -70.65 0.13 Allowed 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -177.916 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -52.95 66.61 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.543 179.173 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.869 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 67.13 29.62 74.71 Favored Glycine 0 CA--C 1.52 0.398 0 CA-C-N 115.848 -0.615 . . . . 0.0 114.25 179.327 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.957 HD13 ' C ' ' A' ' 6' ' ' VAL . 0.8 OUTLIER 178.71 -169.37 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 117.769 0.784 . . . . 0.0 111.709 179.94 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.736 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 2.6 t 178.71 144.43 0.13 Allowed 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 122.331 1.062 . . . . 0.0 113.761 177.883 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.696 ' HD1' HG13 ' A' ' 6' ' ' VAL . 0.5 OUTLIER -105.64 -171.06 1.84 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.12 -1.854 . . . . 0.0 106.67 176.78 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 13' ' ' TYR . 4.0 mmp_? -145.08 63.49 1.29 Allowed 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.726 179.391 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ARG . 7.7 tmm_? -130.72 -76.18 0.53 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.808 179.909 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.4 m 50.8 -87.79 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.435 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.418 ' N ' ' O ' ' A' ' 15' ' ' ARG . 59.3 ttp85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.329 -0.844 . . . . 0.0 111.016 -179.988 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.493 ' HB2' ' CE2' ' A' ' 8' ' ' TYR . 29.1 m95 . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' HG22 ' A' ' 6' ' ' VAL . 28.2 p 179.27 57.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.068 0.461 . . . . 0.0 110.327 179.541 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.409 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 17.6 t80 70.88 33.29 2.2 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.677 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.427 ' HA ' ' HE1' ' A' ' 8' ' ' TYR . 3.3 ptp180 34.55 77.24 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.194 -179.831 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.73 HG21 ' HA ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -118.6 -86.09 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -178.878 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.683 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.5 OUTLIER -90.03 86.08 6.49 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -177.723 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.493 ' CE2' ' HB2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 153.89 -111.43 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.343 0.657 . . . . 0.0 111.134 177.48 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.514 ' CG ' ' O ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -26.8 108.46 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.311 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.07 -60.56 4.4 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 121.008 -0.615 . . . . 0.0 113.529 179.47 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.407 ' C ' HD13 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -157.48 149.39 9.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.236 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.683 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -86.01 99.81 11.71 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 120.095 -0.642 . . . . 0.0 112.17 -179.207 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.717 ' HB3' HG12 ' A' ' 6' ' ' VAL . 2.7 t80 -92.04 105.69 17.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.355 178.914 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 -52.12 93.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.622 -179.237 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -172.15 -88.47 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.845 179.375 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.73 ' HA ' HG21 ' A' ' 6' ' ' VAL . 35.6 t 40.52 -93.62 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 179.668 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.936 -179.87 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.043 0 CA-C-O 120.844 0.354 . . . . 0.0 110.995 . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 4' ' ' PHE . 4.7 t 67.86 -68.73 0.16 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.528 -179.816 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.473 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER 174.22 -33.32 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.23 179.487 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.595 ' O ' HG13 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 168.05 125.65 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.312 179.901 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.595 HG13 ' O ' ' A' ' 5' ' ' ARG . 3.0 m -159.97 171.02 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.147 -179.927 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.3 OUTLIER -40.24 135.44 1.43 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.153 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.565 ' CG ' ' N ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 73.4 179.35 0.22 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.264 -179.823 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.565 ' N ' ' CG ' ' A' ' 8' ' ' TYR . 0.4 OUTLIER 50.31 35.46 10.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 111.518 -179.313 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.422 ' C ' HG23 ' A' ' 11' ' ' ILE . . . 129.68 -58.96 0.7 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.361 -0.923 . . . . 0.0 113.964 179.089 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.422 HG23 ' C ' ' A' ' 10' ' ' GLY . 1.1 pt -157.22 -159.0 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 117.045 0.423 . . . . 0.0 110.968 -179.076 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 12.0 t -133.28 137.56 46.07 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 121.481 0.658 . . . . 0.0 112.021 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.473 ' O ' HG12 ' A' ' 6' ' ' VAL . 0.6 OUTLIER -145.05 83.68 1.69 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.368 179.427 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.2 mtm-85 -61.55 76.77 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.422 -178.945 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' A' ' 13' ' ' TYR . 34.5 mtt-85 -162.51 -96.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.632 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.6 t 42.99 84.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.754 0.312 . . . . 0.0 111.428 179.758 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.926 179.9 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.8 m95 . . . . . 0 N--CA 1.464 0.266 0 CA-C-O 120.643 0.259 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.3 t -58.99 -20.87 56.94 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.127 179.896 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.456 ' CD2' ' HB3' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -170.22 170.64 7.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.078 0.466 . . . . 0.0 111.233 179.971 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 7' ' ' CYS . 4.0 mtt85 -113.6 60.18 0.66 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.413 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.401 ' O ' HG23 ' A' ' 6' ' ' VAL . 15.6 m -63.93 71.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.3 0.572 . . . . 0.0 111.926 -179.284 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.563 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 98.5 m 67.74 52.21 0.76 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.46 179.422 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.452 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 178.77 -176.21 0.23 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.184 178.927 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.452 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 15.7 mmm180 37.24 34.51 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.615 -179.604 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.84 -72.05 0.37 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.121 179.859 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.471 HD13 ' N ' ' A' ' 11' ' ' ILE . 0.2 OUTLIER -156.76 -161.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.65 0.225 . . . . 0.0 111.128 -179.603 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.563 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 5.6 m -93.38 134.98 35.05 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.051 0.453 . . . . 0.0 111.167 179.604 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.42 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER -138.29 171.12 14.86 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.317 -179.767 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 -155.96 48.05 0.49 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.98 0.419 . . . . 0.0 110.963 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -179.99 132.15 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.886 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.456 ' HB3' ' CD2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -126.25 154.46 43.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.712 179.931 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.921 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.465 ' CE3' ' O ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.231 0 CA-C-O 120.66 0.266 . . . . 0.0 110.854 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.641 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 43.4 t 179.68 122.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.549 179.718 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.641 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 92.4 m-85 90.03 -44.65 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.916 -179.386 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 47.71 55.52 8.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.168 -179.919 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.506 HG12 ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -104.44 119.94 54.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.658 0.742 . . . . 0.0 112.447 -178.786 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.665 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 82.7 m 65.22 38.53 5.91 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.587 -1.188 . . . . 0.0 110.067 179.862 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.43 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 18.6 t80 -178.45 170.04 1.72 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.814 -1.084 . . . . 0.0 109.99 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.43 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 22.7 mmt180 34.63 36.97 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.516 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.81 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 148.28 -72.33 0.3 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.079 -179.914 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.81 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 179.31 -169.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 116.652 0.226 . . . . 0.0 110.779 -179.419 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.665 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 57.8 m -93.06 92.94 8.05 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.053 0.454 . . . . 0.0 111.0 179.885 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.581 ' O ' ' CG ' ' A' ' 13' ' ' TYR . 0.8 OUTLIER -137.29 99.45 3.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.596 179.676 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.427 ' HG2' HG11 ' A' ' 6' ' ' VAL . 0.4 OUTLIER -79.03 115.48 18.73 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.069 -177.97 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.461 ' HG3' ' CE2' ' A' ' 13' ' ' TYR . 1.0 OUTLIER 167.1 87.44 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.775 179.266 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' CG ' ' A' ' 4' ' ' PHE . 23.0 t -119.67 135.47 54.81 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.741 -179.989 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.833 -179.975 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.549 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.1 OUTLIER . . . . . 0 CA--C 1.538 0.491 0 CA-C-O 119.908 -0.091 . . . . 0.0 111.241 . . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.592 ' HB3' HG11 ' A' ' 6' ' ' VAL . 39.0 t -47.02 130.04 12.21 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.846 0.355 . . . . 0.0 111.018 179.994 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.48 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -77.85 150.62 34.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.459 -179.951 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.681 ' HA ' ' CD2' ' A' ' 13' ' ' TYR . 0.7 OUTLIER 47.18 81.78 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.107 -179.914 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.797 ' H ' ' HB3' ' A' ' 13' ' ' TYR . 2.5 p 173.14 166.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.81 -176.945 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.564 ' N ' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -57.45 88.48 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.676 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.473 ' HD2' HG13 ' A' ' 6' ' ' VAL . 8.6 p90 -135.74 153.04 51.69 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.395 0.617 . . . . 0.0 112.558 -178.931 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.441 ' HG3' ' N ' ' A' ' 10' ' ' GLY . 6.1 ptm180 39.06 -161.1 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.377 179.239 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.441 ' N ' ' HG3' ' A' ' 9' ' ' ARG . . . -47.78 -21.3 1.46 Allowed Glycine 0 CA--C 1.52 0.368 0 CA-C-N 115.781 -0.645 . . . . 0.0 114.525 -179.069 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.472 ' O ' HD12 ' A' ' 11' ' ' ILE . 1.5 pp -116.19 102.77 14.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 117.918 0.859 . . . . 0.0 111.824 -179.555 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.21 95.73 0.78 Allowed 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.301 179.596 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.797 ' HB3' ' H ' ' A' ' 6' ' ' VAL . 2.4 t80 -85.36 -165.37 1.2 Allowed 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.584 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.434 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 21.6 mtm-85 -156.77 114.53 3.21 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 119.994 -0.682 . . . . 0.0 112.233 -179.698 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 171.56 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.967 179.241 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.42 ' HB2' ' CG2' ' A' ' 6' ' ' VAL . 0.6 OUTLIER 51.22 -163.76 0.06 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.506 -179.956 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.893 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.789 0.328 . . . . 6.5 111.257 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 15.6 m95 -83.68 -154.85 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.102 -0.499 . . . . 6.15 110.572 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.5 t -45.0 -29.91 0.93 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.799 0.333 . . . . 2.77 111.137 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.406 ' O ' ' CD ' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 169.23 -3.86 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.173 -0.467 . . . . 6.77 111.891 179.713 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.406 ' CD ' ' O ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 38.14 43.17 0.55 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.021 0.439 . . . . 8.42 111.311 -179.728 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.825 HG12 ' O ' ' A' ' 13' ' ' TYR . 34.8 m -52.31 119.74 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.875 -0.602 . . . . 3.46 111.262 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.486 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 74.2 m 66.03 41.14 3.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.912 -0.585 . . . . 2.5 110.102 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.445 ' CE2' ' HG2' ' A' ' 9' ' ' ARG . 79.0 t80 -175.27 167.01 3.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.578 -0.737 . . . . 5.73 110.378 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.445 ' HG2' ' CE2' ' A' ' 8' ' ' TYR . 0.3 OUTLIER 35.23 36.89 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.298 -0.41 . . . . 5.72 111.685 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.813 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 158.64 -66.42 0.29 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.579 -0.819 . . . . 1.97 112.748 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.813 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 172.84 -178.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 120.864 0.364 . . . . 2.13 111.182 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.486 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 1.7 m -77.18 110.11 11.6 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.96 -0.564 . . . . 2.11 110.299 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.825 ' O ' HG12 ' A' ' 6' ' ' VAL . 2.4 t80 -137.54 68.67 1.41 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 4.0 111.519 -179.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -55.49 97.77 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.432 -0.349 . . . . 5.8 111.039 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.404 ' O ' ' CD2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 179.21 50.59 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.955 0.407 . . . . 5.46 111.099 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.38 -21.27 63.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.329 -0.396 . . . . 2.24 111.083 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.246 -0.883 . . . . 7.57 110.897 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.789 0.328 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.412 ' N ' ' OH ' ' A' ' 8' ' ' TYR . 0.5 OUTLIER 63.57 15.51 8.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.601 179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -50.08 -29.82 9.68 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.306 0.574 . . . . 0.0 110.003 179.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.462 ' O ' ' CB ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -178.01 -63.54 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.157 -0.928 . . . . 0.0 108.697 179.624 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.473 ' HG3' ' CE2' ' A' ' 13' ' ' TYR . 8.3 ptt-85 154.01 45.92 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.173 178.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.631 HG11 ' N ' ' A' ' 15' ' ' ARG . 4.5 m -105.65 116.25 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-O 121.369 0.604 . . . . 0.0 111.781 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.696 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 13.5 m 76.57 25.95 0.9 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.879 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.497 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.0 OUTLIER 171.69 -176.06 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.127 179.513 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.495 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 15.94 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.616 ' C ' HG23 ' A' ' 11' ' ' ILE . . . 131.54 15.8 1.56 Allowed Glycine 0 CA--C 1.524 0.638 0 C-N-CA 120.078 -1.058 . . . . 0.0 114.35 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.616 HG23 ' C ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 80.79 -169.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 117.247 0.523 . . . . 0.0 111.434 179.57 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.696 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 1.9 t -122.81 133.08 54.46 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.528 ' H ' HG12 ' A' ' 6' ' ' VAL . 5.8 p90 -147.53 25.81 1.06 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.908 177.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.84 92.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.697 -1.138 . . . . 0.0 112.347 178.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.631 ' N ' HG11 ' A' ' 6' ' ' VAL . 0.3 OUTLIER 176.65 156.7 0.27 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.2 t -145.64 84.25 1.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.658 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.969 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.859 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.507 ' O ' ' N ' ' A' ' 3' ' ' CYS . 21.2 mttp . . . . . 0 N--CA 1.479 0.99 0 CA-C-O 120.668 0.271 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.58 ' HB2' ' CZ ' ' A' ' 8' ' ' TYR . 4.0 m0 21.85 45.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.857 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 2' ' ' TRP . 1.8 t 95.25 -71.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.777 ' CD1' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -119.5 -19.56 8.12 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -177.198 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.623 ' HA ' ' CE1' ' A' ' 8' ' ' TYR . 2.0 mtp180 69.55 41.35 1.27 Allowed 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.726 -0.39 . . . . 0.0 110.187 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.777 HG22 ' CD1' ' A' ' 4' ' ' PHE . 28.5 m -90.51 91.31 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -178.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.817 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.8 OUTLIER 76.12 56.26 0.05 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.125 178.439 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.623 ' CE1' ' HA ' ' A' ' 5' ' ' ARG . 31.5 p90 175.0 171.08 0.27 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.794 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.563 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 47.23 21.66 0.2 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.77 0.795 . . . . 0.0 110.751 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.772 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 146.69 -62.27 0.45 Allowed Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.981 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.772 HG23 ' O ' ' A' ' 10' ' ' GLY . 1.5 pp -170.22 176.52 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 117.51 0.655 . . . . 0.0 112.505 -178.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.817 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -66.99 77.05 0.13 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.163 -0.472 . . . . 0.0 109.997 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.535 ' HB2' HD12 ' A' ' 11' ' ' ILE . 1.5 t80 -104.76 118.33 36.29 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.97 -178.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.564 ' HA ' ' CG1' ' A' ' 6' ' ' VAL . 0.2 OUTLIER -100.15 126.16 46.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.253 179.496 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.44 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -149.34 -78.14 0.14 Allowed 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.269 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.483 ' N ' ' HB3' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -26.17 136.86 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.111 -179.804 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.1 mmp_? . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.923 179.998 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.763 0.316 . . . . 0.0 111.171 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.446 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.1 OUTLIER -152.04 -168.11 2.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.696 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.887 ' O ' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER 46.52 38.02 5.04 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.958 179.867 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 56.24 -102.66 0.16 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.766 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.6 30.57 1.1 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.152 0.501 . . . . 0.0 110.601 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.887 HG22 ' O ' ' A' ' 3' ' ' CYS . 3.5 m -83.29 -174.17 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.061 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.621 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 3.6 m -41.09 86.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.725 -179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.557 ' O ' ' C ' ' A' ' 9' ' ' ARG . 86.3 t80 164.47 162.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.576 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.557 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 1.32 77.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.196 0.598 . . . . 0.0 112.385 179.581 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.491 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 143.45 -77.12 0.29 Allowed Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.054 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.491 HG23 ' O ' ' A' ' 10' ' ' GLY . 1.4 pp -158.08 -172.58 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.467 0.175 . . . . 0.0 110.739 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.621 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 16.2 t -134.39 84.29 2.1 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.758 0.313 . . . . 0.0 111.794 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.624 ' CZ ' HG13 ' A' ' 6' ' ' VAL . 7.9 p90 -98.84 12.22 36.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.453 0.645 . . . . 0.0 110.152 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.51 ' O ' ' O ' ' A' ' 13' ' ' TYR . 7.2 mtm-85 41.38 178.76 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.465 -1.243 . . . . 0.0 112.503 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 68.29 59.7 0.41 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.859 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.801 ' HB2' HG21 ' A' ' 6' ' ' VAL . 20.6 t -82.52 132.68 35.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.787 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.872 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.452 ' HG2' ' CD2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.456 0 CA-C-O 120.695 0.283 . . . . 0.0 111.422 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.452 ' CD2' ' HG2' ' A' ' 1' ' ' LYS . 5.6 m95 -94.01 -161.85 0.89 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.614 -0.267 . . . . 0.0 111.323 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.429 ' C ' ' O ' ' A' ' 2' ' ' TRP . 1.0 OUTLIER -25.52 -53.96 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.033 -0.531 . . . . 0.0 112.429 -179.773 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.566 ' CE2' ' CE1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 179.45 -32.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.715 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.479 ' HD2' ' HB2' ' A' ' 9' ' ' ARG . 5.7 mtm-85 62.87 115.96 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.969 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.897 HG12 ' C ' ' A' ' 13' ' ' TYR . 2.6 m -118.65 86.65 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.014 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.655 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 64.6 m 93.37 44.15 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.295 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.433 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 7.6 t80 -179.88 165.82 1.27 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.446 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.479 ' HB2' ' HD2' ' A' ' 5' ' ' ARG . 2.8 ptt180 31.46 38.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.285 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.795 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 156.55 -68.63 0.29 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.207 -0.997 . . . . 0.0 113.529 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.795 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 177.94 -178.42 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 120.522 0.201 . . . . 0.0 111.146 -179.396 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.655 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 15.2 m -82.12 65.8 7.42 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.375 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.897 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -63.48 -154.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.838 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.605 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER 162.69 109.2 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -179.421 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.605 ' HB2' ' O ' ' A' ' 14' ' ' ARG . 6.2 mmp_? 110.03 78.64 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.562 0.745 . . . . 0.0 111.301 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.421 ' HA ' ' CG ' ' A' ' 4' ' ' PHE . 29.7 t -69.59 -80.46 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.006 0.431 . . . . 0.0 110.655 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.9 mtm180 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.335 -0.84 . . . . 0.0 110.921 179.914 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.723 0.297 . . . . 0.0 111.079 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.425 ' CE2' ' HG2' ' A' ' 9' ' ' ARG . 10.9 m-90 -53.01 -81.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.291 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.87 ' O ' HG22 ' A' ' 6' ' ' VAL . 2.7 t -144.47 65.84 1.28 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.776 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.479 ' CD1' ' OH ' ' A' ' 13' ' ' TYR . 1.6 t80 57.47 21.03 6.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.9 mtm-85 62.7 38.62 11.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.767 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.87 HG22 ' O ' ' A' ' 3' ' ' CYS . 1.5 m -77.16 -104.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 C-N-CA 120.966 -0.294 . . . . 0.0 110.425 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.2 m -77.26 146.78 36.67 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 122.161 -0.337 . . . . 0.0 110.2 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.501 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 49.2 p90 49.7 176.61 0.01 OUTLIER 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.984 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.425 ' HG2' ' CE2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 34.28 34.73 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.974 0.416 . . . . 0.0 111.259 -179.189 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.869 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 166.59 -64.11 0.21 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.491 -179.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.869 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER -178.04 -104.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 179.765 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.0 OUTLIER 168.35 62.64 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.637 0.256 . . . . 0.0 110.713 -179.631 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.596 ' CE2' HG12 ' A' ' 6' ' ' VAL . 7.0 p90 -98.88 27.95 4.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.511 0.672 . . . . 0.0 110.779 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.448 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 44.61 -165.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.601 178.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.95 46.42 1.22 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.074 0.464 . . . . 0.0 110.695 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.795 ' HB2' HG21 ' A' ' 6' ' ' VAL . 39.1 t -100.83 -77.11 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.803 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.897 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.7 tttt . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.75 0.31 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.466 ' CE2' ' CB ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -62.38 89.23 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.607 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -103.73 -76.06 0.6 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.228 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.451 ' CE1' ' HD3' ' A' ' 14' ' ' ARG . 1.4 t80 -94.47 -34.16 12.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.129 0.49 . . . . 0.0 110.827 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.52 ' O ' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -89.58 32.09 0.89 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.802 178.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.939 HG21 ' CE1' ' A' ' 13' ' ' TYR . 10.1 p -60.07 -4.48 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 8' ' ' TYR . 0.5 OUTLIER -66.36 66.18 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.528 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.529 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER 175.01 -94.42 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.685 178.643 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.529 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 13.1 mmp_? -62.4 79.23 0.02 OUTLIER 'General case' 0 C--O 1.233 0.228 0 CA-C-O 120.984 0.421 . . . . 0.0 109.889 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.71 ' C ' HD13 ' A' ' 11' ' ' ILE . . . 116.56 48.06 0.48 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.539 -0.624 . . . . 0.0 111.539 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.71 HD13 ' C ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 45.82 -168.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-O 120.629 0.252 . . . . 0.0 111.569 -179.56 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.3 m -105.35 128.5 53.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.03 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.939 ' CE1' HG21 ' A' ' 6' ' ' VAL . 7.5 p90 -172.24 44.31 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.264 0.554 . . . . 0.0 111.048 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.451 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 61.2 mtt85 -34.05 110.59 0.09 Allowed 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.948 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -160.18 73.09 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.71 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t -131.55 132.21 43.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.628 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.939 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.0 mmtp . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.709 0.29 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 62.37 155.15 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.923 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER 178.79 -68.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.43 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -166.22 35.74 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.325 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 65.04 34.58 8.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.639 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.864 HG12 ' O ' ' A' ' 13' ' ' TYR . 16.5 m -66.87 178.42 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.515 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 20.3 m -35.5 129.41 0.56 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.048 0.451 . . . . 0.0 111.647 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.434 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 1.3 t80 82.85 -175.53 0.03 OUTLIER 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.829 -178.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.41 ' HD3' ' HB3' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 37.56 37.26 0.1 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.801 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.416 ' C ' HG23 ' A' ' 11' ' ' ILE . . . 137.83 -70.6 0.48 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.434 -0.889 . . . . 0.0 113.318 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.436 ' O ' ' O ' ' A' ' 6' ' ' VAL . 1.4 pt -157.59 -163.9 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.67 0.235 . . . . 0.0 111.084 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 m -113.44 123.16 49.38 Favored 'General case' 0 CA--C 1.523 -0.074 0 CA-C-O 121.212 0.529 . . . . 0.0 111.321 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.864 ' O ' HG12 ' A' ' 6' ' ' VAL . 0.7 OUTLIER -153.11 54.21 0.76 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.428 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -45.54 114.06 0.69 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.572 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 17' ' ' ARG . 17.5 tpp85 -178.52 -91.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.716 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.9 t 43.91 -92.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.63 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 15' ' ' ARG . 5.7 tmm_? . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.791 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.402 ' N ' ' HB3' ' A' ' 9' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.804 0.335 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 7.3 p-90 -164.03 -43.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.127 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.9 t -134.19 -79.68 0.46 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.953 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.536 ' O ' ' C ' ' A' ' 5' ' ' ARG . 1.5 p90 -147.09 -48.78 0.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.293 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.536 ' C ' ' O ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 4.94 89.14 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.491 -179.702 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.728 HG13 ' HG2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -54.22 -167.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.437 -179.542 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.626 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 64.2 m -19.39 87.28 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.795 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.726 ' O ' ' N ' ' A' ' 10' ' ' GLY . 54.1 t80 -177.33 -86.46 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.017 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.412 ' O ' HD12 ' A' ' 11' ' ' ILE . 29.3 mmt-85 -48.27 70.13 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.92 0.39 . . . . 0.0 111.705 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.955 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 58.84 12.47 14.79 Favored Glycine 0 CA--C 1.521 0.428 0 CA-C-N 116.122 -0.49 . . . . 0.0 113.496 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.955 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.9 OUTLIER 166.68 -177.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 CA-C-N 117.225 0.512 . . . . 0.0 111.32 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.698 ' HB3' HG12 ' A' ' 6' ' ' VAL . 3.1 m -106.71 -158.56 0.66 Allowed 'General case' 0 C--O 1.23 0.05 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.197 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.704 ' H ' HG12 ' A' ' 6' ' ' VAL . 0.1 OUTLIER 107.0 152.03 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.458 1.103 . . . . 0.0 111.034 179.71 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.728 ' HG2' HG13 ' A' ' 6' ' ' VAL . 6.9 mtp180 -150.17 110.22 4.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.327 -178.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -126.36 -82.13 0.62 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.925 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 15' ' ' ARG . 1.2 m 20.16 -89.05 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.272 0.629 . . . . 0.0 112.528 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.9 ptp85 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.481 179.903 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.949 0.404 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.42 ' CZ2' ' HG2' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -68.89 -165.25 0.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.485 179.808 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' ' CB ' ' A' ' 4' ' ' PHE . 7.6 t -48.65 -23.83 1.15 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.441 0.163 . . . . 0.0 111.386 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.473 ' CB ' ' O ' ' A' ' 3' ' ' CYS . 0.6 OUTLIER 85.42 97.96 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.972 179.85 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.517 ' O ' HG23 ' A' ' 6' ' ' VAL . 0.0 OUTLIER -90.97 49.62 1.67 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.503 179.592 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.773 HG12 ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 47.49 -178.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.456 179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.686 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 90.8 m 19.86 59.21 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 114.963 -1.017 . . . . 0.0 113.018 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 3.1 t80 174.38 170.77 0.23 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.314 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 mmt180 43.57 26.49 0.12 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.166 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.794 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 147.3 -63.55 0.43 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 119.958 -1.115 . . . . 0.0 113.923 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.794 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -174.17 -172.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 117.057 0.428 . . . . 0.0 111.661 -178.91 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.686 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 21.5 m -99.71 103.54 15.21 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.898 0.38 . . . . 0.0 111.699 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.773 ' N ' HG12 ' A' ' 6' ' ' VAL . 1.2 p90 -139.84 95.54 2.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.492 0.663 . . . . 0.0 110.019 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -66.38 94.28 0.26 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.359 -178.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.87 70.06 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.035 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.2 -28.01 9.26 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.759 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.965 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 120.783 0.325 . . . . 0.0 111.042 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.471 ' O ' ' N ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 63.52 -81.74 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.197 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.452 ' HB2' HG22 ' A' ' 6' ' ' VAL . 56.7 m 43.27 -89.65 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.471 ' N ' ' O ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -164.13 48.09 0.12 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.247 0.546 . . . . 0.0 109.635 179.101 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.604 ' O ' HD11 ' A' ' 11' ' ' ILE . 15.2 mtm-85 81.55 56.63 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.805 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.695 HG12 ' CE2' ' A' ' 13' ' ' TYR . 26.8 m -111.87 -139.31 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.395 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.7 m -54.11 149.31 9.64 Favored 'General case' 0 CA--C 1.52 -0.206 0 O-C-N 122.049 -0.407 . . . . 0.0 110.776 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.528 ' O ' ' N ' ' A' ' 10' ' ' GLY . 5.2 t80 72.21 -136.86 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.436 ' HD2' ' CD2' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -39.29 89.55 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.856 0.36 . . . . 0.0 111.174 179.395 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.617 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 135.48 -70.78 0.5 Allowed Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.503 -179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.753 HD12 ' N ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -179.71 -100.36 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 O-C-N 122.97 -0.135 . . . . 0.0 111.167 179.921 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 176.25 62.81 0.01 OUTLIER 'General case' 0 C--N 1.342 0.253 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.662 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.695 ' CE2' HG12 ' A' ' 6' ' ' VAL . 1.5 p90 -102.49 96.55 6.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.721 0.772 . . . . 0.0 109.316 178.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -57.02 117.05 3.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.716 -178.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HB2' ' CE1' ' A' ' 13' ' ' TYR . 1.5 mmm180 -159.08 -91.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.54 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.437 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER 31.69 61.85 0.28 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 111.939 179.547 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.936 -179.91 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.431 ' N ' ' CD1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.307 0 CA-C-O 120.776 0.322 . . . . 0.0 111.16 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.434 ' CH2' ' HG3' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -44.18 -38.23 3.62 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.131 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 t 177.43 122.55 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.644 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.483 ' C ' ' HG2' ' A' ' 5' ' ' ARG . 0.1 OUTLIER 54.22 -165.3 0.09 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.98 -179.41 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.483 ' HG2' ' C ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 45.07 40.04 4.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.015 0.436 . . . . 0.0 110.401 179.564 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.485 HG11 ' O ' ' A' ' 13' ' ' TYR . 31.0 m -40.77 162.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.413 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.641 ' HA ' ' O ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER 74.23 143.23 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.817 -179.662 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.56 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 35.1 t80 97.27 173.5 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.798 -178.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.428 ' HB3' ' NZ ' ' A' ' 1' ' ' LYS . 0.0 OUTLIER 35.3 37.71 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.984 179.825 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.418 ' C ' HG13 ' A' ' 11' ' ' ILE . . . 154.48 -68.64 0.3 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.251 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.643 ' N ' HD12 ' A' ' 11' ' ' ILE . 0.2 OUTLIER -173.06 -89.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-N 116.748 0.274 . . . . 0.0 111.562 -179.545 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -168.13 120.93 0.87 Allowed 'General case' 0 CA--C 1.522 -0.107 0 CA-C-O 120.747 0.308 . . . . 0.0 110.321 179.699 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.485 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -99.76 175.29 5.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.413 179.899 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.13 26.65 0.7 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.619 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.22 122.38 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.6 t -77.87 64.12 3.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.974 0.416 . . . . 0.0 110.828 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 ptp85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.862 179.952 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.835 0.35 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.493 ' HB2' ' CE2' ' A' ' 8' ' ' TYR . 87.8 m95 -68.63 -8.01 38.27 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.101 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 5' ' ' ARG . 1.6 t 69.6 -57.76 0.53 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 122.147 0.179 . . . . 0.0 111.401 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.727 ' HB3' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -43.32 -30.02 0.47 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.77 0.319 . . . . 0.0 111.682 -179.447 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.599 ' HA ' ' CD2' ' A' ' 8' ' ' TYR . 4.0 ptp180 37.73 35.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.746 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.727 HG22 ' HB3' ' A' ' 4' ' ' PHE . 1.7 m -109.22 77.77 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.452 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.669 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 62.0 m 83.45 44.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.487 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.599 ' CD2' ' HA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -147.81 147.13 29.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.722 -1.127 . . . . 0.0 109.004 179.089 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.563 ' HB2' ' CD1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 33.59 -85.68 0.0 OUTLIER 'General case' 0 CA--C 1.522 -0.105 0 CA-C-O 121.647 0.737 . . . . 0.0 111.895 179.312 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.837 ' O ' HG23 ' A' ' 11' ' ' ILE . . . -51.64 -75.27 0.23 Allowed Glycine 0 C--N 1.297 -1.623 0 CA-C-N 114.348 -1.297 . . . . 0.0 113.571 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.837 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -177.35 -174.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-N 116.823 0.312 . . . . 0.0 111.401 -179.063 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.669 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 23.8 m -84.13 60.0 5.65 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.252 0.548 . . . . 0.0 109.651 178.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.462 ' O ' ' CG1' ' A' ' 6' ' ' VAL . 2.6 t80 -87.27 105.02 16.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.792 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.541 ' HA ' HG12 ' A' ' 6' ' ' VAL . 36.4 mtp85 -66.59 64.48 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.859 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.428 ' O ' ' CG ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER 170.04 -163.49 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.259 179.585 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -145.06 56.88 1.26 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.919 0.39 . . . . 0.0 110.666 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.93 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.422 ' HB2' ' HB3' ' A' ' 9' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.788 0.327 . . . . 0.0 111.257 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.436 ' CD1' ' HG3' ' A' ' 5' ' ' ARG . 4.5 m95 43.38 -163.25 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.058 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -69.16 -54.97 12.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.914 0.387 . . . . 0.0 110.149 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.532 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -140.59 -58.5 0.52 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.368 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.436 ' HG3' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 47.54 93.76 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.81 -179.895 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.625 HG12 ' C ' ' A' ' 13' ' ' TYR . 0.9 OUTLIER -55.0 -174.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.101 -179.694 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.666 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 98.9 m 0.72 71.97 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.607 0.763 . . . . 0.0 112.671 -178.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.484 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 177.71 -165.21 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.081 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.479 ' C ' ' O ' ' A' ' 8' ' ' TYR . 4.5 mmm-85 -17.52 83.66 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.568 0 O-C-N 123.692 0.62 . . . . 0.0 112.557 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.8 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 124.07 -78.1 0.36 Allowed Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.792 -0.718 . . . . 0.0 113.177 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.8 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.9 OUTLIER -170.99 -172.94 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 122.18 0.192 . . . . 0.0 110.584 -179.424 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.666 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 72.4 m -92.92 73.97 4.82 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 120.775 0.322 . . . . 0.0 110.192 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.625 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -112.24 108.93 18.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.118 0.485 . . . . 0.0 111.977 -179.649 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.624 ' HA ' HG13 ' A' ' 6' ' ' VAL . 3.6 mtt180 -76.42 101.35 5.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.239 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER 170.22 -157.55 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.177 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.433 ' HA ' ' HB2' ' A' ' 4' ' ' PHE . 0.8 OUTLIER 169.05 -30.23 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.916 0.389 . . . . 0.0 110.854 179.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.916 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.862 0.363 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.472 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 11.7 m0 64.29 20.37 12.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.267 0.556 . . . . 0.0 110.868 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.477 ' C ' ' SG ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER 173.79 -46.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.018 179.275 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.86 48.52 1.23 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.548 179.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.424 ' NH1' ' CE2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -94.32 36.41 1.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.001 179.545 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.817 HG12 ' O ' ' A' ' 13' ' ' TYR . 27.1 m -75.14 72.51 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.798 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.682 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 70.9 m 98.93 42.27 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.05 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.46 ' O ' ' N ' ' A' ' 10' ' ' GLY . 28.7 t80 -155.43 -111.28 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.041 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.52 89.39 0.0 OUTLIER 'General case' 0 C--O 1.231 0.129 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.895 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 103.42 -48.68 1.0 Allowed Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.667 -0.777 . . . . 0.0 113.884 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.895 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER 162.39 -174.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 116.966 0.383 . . . . 0.0 110.748 -178.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.682 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 14.8 m -67.22 86.53 0.16 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.985 0.421 . . . . 0.0 110.81 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.817 ' O ' HG12 ' A' ' 6' ' ' VAL . 2.5 t80 -91.13 171.72 9.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.47 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.477 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 13.6 mtt-85 -163.99 96.37 0.81 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.614 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.487 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -175.58 -78.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 1.8 m 70.59 12.46 7.34 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.378 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.417 ' HG3' ' C ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.324 -0.846 . . . . 0.0 111.853 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.738 0.304 . . . . 0.0 111.129 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -55.82 -170.75 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.018 0.437 . . . . 0.0 111.112 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.0 t -52.74 165.74 0.25 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.117 179.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -41.35 -31.33 0.23 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.056 0.455 . . . . 0.0 111.138 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -71.88 92.12 1.23 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.045 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.795 HG22 ' HB2' ' A' ' 13' ' ' TYR . 8.5 m -52.33 -16.22 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.725 -179.101 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.619 ' O ' ' CB ' ' A' ' 8' ' ' TYR . 1.8 m -29.89 105.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.635 0.255 . . . . 0.0 111.146 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.619 ' CB ' ' O ' ' A' ' 7' ' ' CYS . 42.0 t80 107.87 177.69 0.0 OUTLIER 'General case' 0 C--O 1.238 0.492 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.537 -178.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.94 38.52 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.196 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.433 ' O ' ' CG2' ' A' ' 11' ' ' ILE . . . 149.99 -72.56 0.29 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.179 -1.01 . . . . 0.0 113.436 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.488 ' O ' HG23 ' A' ' 6' ' ' VAL . 9.3 pt -158.9 -167.2 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 116.684 0.242 . . . . 0.0 111.178 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -119.81 134.39 55.25 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.305 0.574 . . . . 0.0 112.001 -179.857 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.795 ' HB2' HG22 ' A' ' 6' ' ' VAL . 0.3 OUTLIER -112.16 -164.61 0.93 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.188 -0.915 . . . . 0.0 108.823 178.213 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 59.0 mtp180 -155.52 91.11 1.29 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.069 0.462 . . . . 0.0 111.229 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.09 -86.42 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.846 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t 45.18 -92.03 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.559 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.9 mtp85 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.856 -179.953 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.695 0.283 . . . . 0.0 111.38 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.429 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 51.43 49.73 20.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.854 0.359 . . . . 0.0 110.879 -179.968 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 90.0 m -135.37 -79.56 0.43 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.379 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -105.24 -21.41 13.25 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.356 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.453 ' NH1' ' CD2' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -82.3 55.98 3.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.862 0.363 . . . . 0.0 110.879 179.909 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.59 HG12 ' C ' ' A' ' 13' ' ' TYR . 2.7 m -58.29 132.93 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.572 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.601 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 71.4 m 108.12 77.74 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.177 0.991 . . . . 0.0 111.307 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.453 ' CD2' ' NH1' ' A' ' 5' ' ' ARG . 42.5 t80 -179.26 -104.85 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.25 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.46 ' O ' ' CZ ' ' A' ' 14' ' ' ARG . 0.1 OUTLIER -61.01 83.82 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.067 0 CA-C-O 120.816 0.341 . . . . 0.0 111.798 -179.228 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.469 ' O ' ' CG1' ' A' ' 11' ' ' ILE . . . 89.41 49.87 3.34 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.488 -0.863 . . . . 0.0 113.148 179.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.469 ' CG1' ' O ' ' A' ' 10' ' ' GLY . 0.1 OUTLIER 69.17 -167.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.769 0.319 . . . . 0.0 111.788 179.559 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.601 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 19.0 m -88.2 -164.53 1.13 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.331 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.59 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 74.56 -67.15 0.27 Allowed 'General case' 0 CA--C 1.513 -0.481 0 CA-C-O 121.945 0.879 . . . . 0.0 110.165 -179.616 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.496 ' N ' ' CG ' ' A' ' 13' ' ' TYR . 0.5 OUTLIER 48.08 176.62 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 113.871 -1.513 . . . . 0.0 112.12 178.928 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.41 129.47 23.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.909 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 t -87.85 114.54 24.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.841 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.905 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 120.704 0.288 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 20.9 m0 59.04 20.58 8.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.279 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.408 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 46.7 t -133.84 -72.52 0.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.751 179.537 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -68.76 -120.52 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.405 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.814 ' O ' HG13 ' A' ' 6' ' ' VAL . 0.2 OUTLIER 49.99 -175.32 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.088 0 O-C-N 122.163 -0.336 . . . . 0.0 110.606 -179.715 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.834 HG12 ' O ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 174.08 113.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.982 0.42 . . . . 0.0 110.878 179.676 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.0 OUTLIER 67.63 70.56 0.35 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.776 -179.671 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.572 ' O ' ' N ' ' A' ' 10' ' ' GLY . 52.6 t80 -178.22 -73.78 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.839 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.403 ' O ' HG13 ' A' ' 11' ' ' ILE . 3.2 mmp_? -48.64 78.4 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.853 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 53.5 16.17 4.92 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 116.064 -0.516 . . . . 0.0 114.123 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.853 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER 163.96 -179.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 117.294 0.547 . . . . 0.0 110.951 179.73 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 3.4 t -97.81 93.41 6.34 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 121.243 0.544 . . . . 0.0 110.682 179.285 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.834 ' O ' HG12 ' A' ' 6' ' ' VAL . 4.5 t80 -75.73 166.33 23.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.444 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -177.4 64.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.943 179.796 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.403 ' HD3' ' HD3' ' A' ' 14' ' ' ARG . 3.2 mpp_? -166.33 81.73 0.27 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.274 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.2 t -161.84 137.94 7.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.915 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.897 179.943 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.408 ' HB2' ' HD2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.696 0.284 . . . . 0.0 111.207 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.472 ' CD1' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -132.23 6.73 4.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.664 179.773 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.946 ' O ' HG23 ' A' ' 6' ' ' VAL . 43.4 t -178.75 66.32 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.93 0.395 . . . . 0.0 110.959 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.438 ' CE2' ' HA ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER 44.78 29.31 0.42 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.661 179.766 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.451 ' HA ' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 42.29 59.66 2.59 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.974 0.416 . . . . 0.0 111.221 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.946 HG23 ' O ' ' A' ' 3' ' ' CYS . 11.2 t -82.97 87.74 2.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.66 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.586 ' N ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER 75.95 48.22 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.92 179.789 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.489 ' OH ' ' HB3' ' A' ' 3' ' ' CYS . 44.9 p90 174.73 176.08 0.17 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.952 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' TYR . 53.0 mtt-85 22.23 48.03 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.691 0.619 . . . . 0.0 112.559 179.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.445 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 151.21 -75.35 0.25 Allowed Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.388 -0.911 . . . . 0.0 113.341 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.44 HG23 ' O ' ' A' ' 10' ' ' GLY . 2.0 pt -159.72 -172.8 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.62 0.21 . . . . 0.0 111.433 -179.248 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.586 ' HA ' ' N ' ' A' ' 7' ' ' CYS . 8.8 t -109.93 118.15 35.69 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.302 0.572 . . . . 0.0 111.362 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.729 ' O ' HG13 ' A' ' 6' ' ' VAL . 1.8 t80 -126.15 60.27 1.3 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.457 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.454 ' C ' ' O ' ' A' ' 13' ' ' TYR . 2.2 mtm-85 -22.33 93.76 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.582 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.09 -82.59 0.0 OUTLIER 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.023 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.807 ' CA ' HG21 ' A' ' 6' ' ' VAL . 25.7 t 56.76 37.47 28.83 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.017 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.293 -0.86 . . . . 0.0 111.01 179.986 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.941 0.4 . . . . 0.0 111.261 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.495 ' CG ' ' OH ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -85.99 -162.55 0.75 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.845 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 4' ' ' PHE . 97.3 m -39.66 -74.0 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.881 0.372 . . . . 0.0 111.144 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER 176.36 -29.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.489 179.591 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.966 ' O ' HG22 ' A' ' 6' ' ' VAL . 89.6 mtt180 -147.3 -158.29 0.9 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.676 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.966 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.5 m 87.14 -166.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 123.226 0.61 . . . . 0.0 111.116 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.746 ' CA ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -52.88 161.74 0.72 Allowed 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.603 -179.465 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.691 ' CG ' ' O ' ' A' ' 7' ' ' CYS . 8.2 p90 55.07 173.28 0.03 OUTLIER 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' TYR . 0.7 OUTLIER 28.55 39.85 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 179.961 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.784 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 162.66 -68.51 0.23 Allowed Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.444 -0.884 . . . . 0.0 113.632 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.784 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER -177.43 -90.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 117.125 0.463 . . . . 0.0 111.933 -179.496 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.746 ' HA ' ' CA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -176.05 48.4 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.522 0.677 . . . . 0.0 110.782 179.471 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.589 ' O ' HG12 ' A' ' 6' ' ' VAL . 1.0 OUTLIER -80.9 81.81 7.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.072 179.044 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -44.69 99.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.443 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.787 ' O ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 176.44 -164.6 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.623 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 15' ' ' ARG . 41.5 t 174.26 156.41 0.14 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.763 0.316 . . . . 0.0 110.511 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.308 179.972 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.405 ' HA ' ' NH2' ' A' ' 9' ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.833 0.349 . . . . 0.0 111.178 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 11.9 t90 65.46 38.78 5.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.126 179.937 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.6 t -96.34 -13.36 23.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.999 179.643 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.854 ' CE1' HG22 ' A' ' 6' ' ' VAL . 0.0 OUTLIER -164.42 -3.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.384 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.411 ' HA ' ' HG3' ' A' ' 9' ' ' ARG . 1.8 mtt-85 48.24 35.71 5.85 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.095 0.474 . . . . 0.0 110.632 -179.472 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.854 HG22 ' CE1' ' A' ' 4' ' ' PHE . 23.6 m -86.25 -142.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.289 -179.478 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 1.2 m -26.92 130.31 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.467 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.593 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.0 OUTLIER 73.75 -75.3 0.08 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.748 -178.652 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.582 ' N ' ' CG ' ' A' ' 8' ' ' TYR . 0.0 OUTLIER -51.79 75.86 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -179.664 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.898 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 93.4 -21.77 38.83 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 114.666 0.626 . . . . 0.0 114.666 178.397 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.898 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER 161.23 -164.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 117.42 0.61 . . . . 0.0 110.315 -179.151 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 m -125.53 102.99 7.63 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.65 0.262 . . . . 0.0 111.319 179.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.485 ' CD1' HG12 ' A' ' 6' ' ' VAL . 4.5 p90 -149.83 35.53 0.69 Allowed 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.972 0.415 . . . . 0.0 110.602 178.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.546 ' HA ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER -15.86 127.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.917 -179.895 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.443 ' N ' HG11 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 165.36 94.78 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.869 179.76 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 4' ' ' PHE . 1.2 m -79.74 99.0 7.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.849 0.357 . . . . 0.0 110.927 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.909 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.449 ' HB2' ' HG2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.696 0.284 . . . . 0.0 111.619 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -66.71 -16.26 64.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.817 0.342 . . . . 0.0 111.071 179.879 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 7' ' ' CYS . 0.7 OUTLIER -103.47 69.98 1.02 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.804 -179.774 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.732 ' O ' HG22 ' A' ' 6' ' ' VAL . 0.5 OUTLIER 53.33 28.38 7.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.153 0.502 . . . . 0.0 110.667 -179.617 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.449 ' HG2' ' HB2' ' A' ' 1' ' ' LYS . 2.5 mtm180 49.77 33.78 6.71 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.698 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 1.093 HG21 ' CZ ' ' A' ' 13' ' ' TYR . 1.7 m -148.95 50.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-O 121.545 0.688 . . . . 0.0 109.923 179.387 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER 179.44 136.21 0.1 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.488 -1.233 . . . . 0.0 109.976 179.854 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.592 ' O ' ' N ' ' A' ' 10' ' ' GLY . 7.7 t80 72.84 -138.97 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -177.877 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.536 ' HD2' ' CE2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -39.37 84.07 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.78 0.324 . . . . 0.0 111.408 179.649 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.592 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 137.98 -69.91 0.49 Allowed Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.788 -0.72 . . . . 0.0 113.191 -179.708 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 1.089 HD11 HG12 ' A' ' 6' ' ' VAL . 10.9 pt -158.38 -136.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 116.755 0.278 . . . . 0.0 111.031 -179.301 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 166.16 90.61 0.0 OUTLIER 'General case' 0 C--N 1.348 0.526 0 C-N-CA 122.324 0.25 . . . . 0.0 110.793 179.992 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 1.093 ' CZ ' HG21 ' A' ' 6' ' ' VAL . 0.2 OUTLIER -101.45 25.26 8.56 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 119.37 -0.932 . . . . 0.0 111.956 179.297 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 42.13 95.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.127 178.589 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 167.21 59.01 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.504 179.505 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 4' ' ' PHE . 3.2 p -171.2 34.64 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.955 -179.638 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.809 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.854 0.359 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.491 ' CD1' ' HB3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -45.02 -94.77 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.897 -179.72 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 176.64 149.05 0.13 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -179.535 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -42.02 -34.32 0.69 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.489 0.661 . . . . 0.0 109.895 179.736 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.716 ' C ' HG12 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 169.21 148.11 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.598 179.621 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.725 HG11 ' SG ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER 170.05 86.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 121.702 0.763 . . . . 0.0 109.673 -179.575 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.838 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER 32.88 39.99 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.769 -178.002 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.427 ' O ' ' N ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER 171.94 171.95 0.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 113.734 -1.575 . . . . 0.0 108.868 179.875 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.491 ' HB3' ' CD1' ' A' ' 2' ' ' TRP . 1.0 OUTLIER 32.39 37.23 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.526 0.516 . . . . 0.0 111.475 179.304 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.854 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 154.3 -73.03 0.26 Allowed Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.631 -179.865 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.854 HG23 ' O ' ' A' ' 10' ' ' GLY . 1.3 pp -173.27 173.84 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 CA-C-N 116.763 0.282 . . . . 0.0 111.113 -179.333 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.838 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -71.55 66.47 0.5 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.936 0.398 . . . . 0.0 111.624 179.641 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.606 ' CG ' ' HG3' ' A' ' 5' ' ' ARG . 1.5 t80 -73.96 134.79 43.17 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.06 178.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 49.81 0.92 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.477 -179.786 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.409 ' HB3' ' CE2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -154.7 -85.32 0.06 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.006 179.986 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.725 ' SG ' HG11 ' A' ' 6' ' ' VAL . 51.9 t 54.74 -100.89 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.457 0.17 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.0 mmm180 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.119 179.938 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.499 ' H3 ' HG21 ' A' ' 6' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 120.649 0.261 . . . . 0.0 111.458 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.476 ' HD1' ' HH ' ' A' ' 8' ' ' TYR . 5.4 m0 76.06 -145.61 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 179.142 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -19.4 139.91 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.927 0.891 . . . . 0.0 113.396 -178.317 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.559 ' O ' HG12 ' A' ' 6' ' ' VAL . 11.8 m-85 85.95 149.41 0.06 Allowed 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 -179.741 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.469 ' HG2' ' HG3' ' A' ' 14' ' ' ARG . 23.0 mtt180 -74.54 57.88 0.75 Allowed 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.83 0.824 . . . . 0.0 110.014 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.559 HG12 ' O ' ' A' ' 4' ' ' PHE . 0.9 OUTLIER -74.58 -7.12 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.212 179.538 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 13.0 m 43.05 57.33 3.73 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.684 0.754 . . . . 0.0 111.08 179.707 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.601 ' CE1' ' HB2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -106.89 174.68 5.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.436 -1.257 . . . . 0.0 108.93 179.021 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.601 ' HB2' ' CE1' ' A' ' 8' ' ' TYR . 0.0 OUTLIER 39.8 35.31 0.21 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.523 0.678 . . . . 0.0 110.97 178.154 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.466 ' C ' HG22 ' A' ' 11' ' ' ILE . . . 63.64 48.65 75.55 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 115.221 -0.899 . . . . 0.0 113.97 179.534 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.511 HD11 ' HA ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER 177.98 127.52 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 117.373 0.587 . . . . 0.0 111.617 179.651 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 83.1 m -72.16 69.83 0.78 Allowed 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.422 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.511 ' HA ' HD11 ' A' ' 11' ' ' ILE . 46.6 t80 -41.21 146.37 0.19 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.461 -178.724 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.533 ' O ' ' CG ' ' A' ' 15' ' ' ARG . 2.0 mmt85 -171.13 79.38 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.027 -179.513 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.533 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER 169.32 73.36 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 120.706 0.288 . . . . 0.0 110.929 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -104.43 170.26 8.0 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.935 0.398 . . . . 0.0 111.455 -179.778 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.207 -0.902 . . . . 0.0 110.827 179.795 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 13' ' ' TYR . 37.1 mttm . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.614 0.245 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.453 ' CD1' ' HG3' ' A' ' 9' ' ' ARG . 99.0 m95 -57.65 -17.87 17.12 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.662 0.268 . . . . 0.0 111.18 179.724 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 1.5 m 64.77 102.92 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.058 179.679 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.471 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 11.3 t80 171.93 -18.11 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.813 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 44.7 mtp85 62.6 72.28 0.5 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.119 0.485 . . . . 0.0 109.879 -179.218 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.632 HG11 ' CE1' ' A' ' 8' ' ' TYR . 1.5 p -124.63 -24.35 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.937 -178.695 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 6' ' ' VAL . 42.2 t 67.73 72.33 0.33 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.592 0.234 . . . . 0.0 111.196 179.958 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.661 ' CE1' ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -178.59 -157.36 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.087 179.427 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.661 ' HG2' ' CE1' ' A' ' 8' ' ' TYR . 1.0 OUTLIER 61.54 48.93 5.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.115 0.483 . . . . 0.0 110.062 -178.791 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.783 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 111.61 -35.86 4.5 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.99 -179.535 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.783 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.8 OUTLIER -175.33 -177.44 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.816 0.341 . . . . 0.0 110.74 179.899 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.45 91.0 0.39 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.181 179.551 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.443 ' CZ ' ' HB2' ' A' ' 1' ' ' LYS . 0.9 OUTLIER -71.31 131.03 42.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.17 0.51 . . . . 0.0 111.793 -179.203 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.46 27.18 0.51 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.18 179.585 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.19 64.05 2.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.003 -179.631 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 t -166.3 163.76 17.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.054 179.851 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.2 mmp_? . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.937 -179.953 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.469 ' CB ' ' HA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.534 0.207 . . . . 0.0 111.472 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.499 ' CD1' ' HB3' ' A' ' 8' ' ' TYR . 66.8 p-90 -65.59 -20.25 66.24 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.134 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.563 ' HB3' ' OH ' ' A' ' 13' ' ' TYR . 5.1 t -127.07 -15.37 5.31 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.881 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.551 ' N ' ' OH ' ' A' ' 13' ' ' TYR . 11.2 t80 -160.43 -76.17 0.06 Allowed 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.89 0.376 . . . . 0.0 110.488 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.469 ' HA ' ' CB ' ' A' ' 1' ' ' LYS . 0.0 OUTLIER 178.33 26.66 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.915 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.957 ' C ' HD13 ' A' ' 11' ' ' ILE . 7.5 p -178.7 57.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 179.309 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.736 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 51.8 t -146.73 155.94 42.78 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.938 0.399 . . . . 0.0 111.229 177.271 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.666 ' O ' ' N ' ' A' ' 10' ' ' GLY . 30.8 t80 68.82 -70.65 0.13 Allowed 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -177.916 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -52.95 66.61 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.543 179.173 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.869 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 67.13 29.62 74.71 Favored Glycine 0 CA--C 1.52 0.398 0 CA-C-N 115.848 -0.615 . . . . 0.0 114.25 179.327 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.957 HD13 ' C ' ' A' ' 6' ' ' VAL . 0.8 OUTLIER 178.71 -169.37 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 117.769 0.784 . . . . 0.0 111.709 179.94 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.736 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 2.6 t 178.71 144.43 0.13 Allowed 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 122.331 1.062 . . . . 0.0 113.761 177.883 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.696 ' HD1' HG13 ' A' ' 6' ' ' VAL . 0.5 OUTLIER -105.64 -171.06 1.84 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.12 -1.854 . . . . 0.0 106.67 176.78 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 13' ' ' TYR . 4.0 mmp_? -145.08 63.49 1.29 Allowed 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.726 179.391 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ARG . 7.7 tmm_? -130.72 -76.18 0.53 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.808 179.909 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.4 m 50.8 -87.79 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.435 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.418 ' N ' ' O ' ' A' ' 15' ' ' ARG . 59.3 ttp85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.329 -0.844 . . . . 0.0 111.016 -179.988 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.868 0.366 . . . . 0.0 111.232 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.493 ' HB2' ' CE2' ' A' ' 8' ' ' TYR . 29.1 m95 -79.21 -1.96 38.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.783 -179.956 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' HG22 ' A' ' 6' ' ' VAL . 28.2 p 179.27 57.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.068 0.461 . . . . 0.0 110.327 179.541 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.409 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 17.6 t80 70.88 33.29 2.2 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.677 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.427 ' HA ' ' HE1' ' A' ' 8' ' ' TYR . 3.3 ptp180 34.55 77.24 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.194 -179.831 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.73 HG21 ' HA ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -118.6 -86.09 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -178.878 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.683 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.5 OUTLIER -90.03 86.08 6.49 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -177.723 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.493 ' CE2' ' HB2' ' A' ' 2' ' ' TRP . 0.0 OUTLIER 153.89 -111.43 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.343 0.657 . . . . 0.0 111.134 177.48 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.514 ' CG ' ' O ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -26.8 108.46 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.311 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.07 -60.56 4.4 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 121.008 -0.615 . . . . 0.0 113.529 179.47 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.407 ' C ' HD13 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -157.48 149.39 9.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.236 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.683 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -86.01 99.81 11.71 Favored 'General case' 0 C--O 1.232 0.135 0 C-N-CA 120.095 -0.642 . . . . 0.0 112.17 -179.207 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.717 ' HB3' HG12 ' A' ' 6' ' ' VAL . 2.7 t80 -92.04 105.69 17.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.355 178.914 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 -52.12 93.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.622 -179.237 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -172.15 -88.47 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.845 179.375 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.73 ' HA ' HG21 ' A' ' 6' ' ' VAL . 35.6 t 40.52 -93.62 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 179.668 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.936 -179.87 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.864 0.364 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.2 OUTLIER -62.19 144.65 55.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.995 -179.9 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 4' ' ' PHE . 4.7 t 67.86 -68.73 0.16 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.528 -179.816 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.473 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER 174.22 -33.32 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.23 179.487 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.595 ' O ' HG13 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 168.05 125.65 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.312 179.901 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.595 HG13 ' O ' ' A' ' 5' ' ' ARG . 3.0 m -159.97 171.02 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.147 -179.927 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 12' ' ' CYS . 0.3 OUTLIER -40.24 135.44 1.43 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.153 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.565 ' CG ' ' N ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 73.4 179.35 0.22 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.264 -179.823 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.565 ' N ' ' CG ' ' A' ' 8' ' ' TYR . 0.4 OUTLIER 50.31 35.46 10.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 111.518 -179.313 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.422 ' C ' HG23 ' A' ' 11' ' ' ILE . . . 129.68 -58.96 0.7 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.361 -0.923 . . . . 0.0 113.964 179.089 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.422 HG23 ' C ' ' A' ' 10' ' ' GLY . 1.1 pt -157.22 -159.0 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 CA-C-N 117.045 0.423 . . . . 0.0 110.968 -179.076 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 7' ' ' CYS . 12.0 t -133.28 137.56 46.07 Favored 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 121.481 0.658 . . . . 0.0 112.021 179.643 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.473 ' O ' HG12 ' A' ' 6' ' ' VAL . 0.6 OUTLIER -145.05 83.68 1.69 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.368 179.427 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.2 mtm-85 -61.55 76.77 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.422 -178.945 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' A' ' 13' ' ' TYR . 34.5 mtt-85 -162.51 -96.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.632 179.838 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.6 t 42.99 84.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.754 0.312 . . . . 0.0 111.428 179.758 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.926 179.9 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 120.646 0.26 . . . . 0.0 111.412 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 27.8 m95 43.94 -158.84 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.343 179.769 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.3 t -58.99 -20.87 56.94 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.127 179.896 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.456 ' CD2' ' HB3' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -170.22 170.64 7.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.078 0.466 . . . . 0.0 111.233 179.971 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 7' ' ' CYS . 4.0 mtt85 -113.6 60.18 0.66 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.413 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.401 ' O ' HG23 ' A' ' 6' ' ' VAL . 15.6 m -63.93 71.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.3 0.572 . . . . 0.0 111.926 -179.284 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.563 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 98.5 m 67.74 52.21 0.76 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.46 179.422 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.452 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 0.0 OUTLIER 178.77 -176.21 0.23 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.184 178.927 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.452 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 15.7 mmm180 37.24 34.51 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.615 -179.604 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.84 -72.05 0.37 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.121 179.859 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.471 HD13 ' N ' ' A' ' 11' ' ' ILE . 0.2 OUTLIER -156.76 -161.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.65 0.225 . . . . 0.0 111.128 -179.603 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.563 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 5.6 m -93.38 134.98 35.05 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.051 0.453 . . . . 0.0 111.167 179.604 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.42 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER -138.29 171.12 14.86 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.317 -179.767 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 -155.96 48.05 0.49 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.98 0.419 . . . . 0.0 110.963 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -179.99 132.15 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.886 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.456 ' HB3' ' CD2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -126.25 154.46 43.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.712 179.931 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.921 -179.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.421 ' HG3' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 111.507 0.188 . . . . 0.0 111.507 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.465 ' CE3' ' O ' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -94.87 -72.02 0.64 Allowed 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.854 179.391 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.641 ' O ' ' HB2' ' A' ' 4' ' ' PHE . 43.4 t 179.68 122.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.549 179.718 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.641 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 92.4 m-85 90.03 -44.65 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.916 -179.386 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 47.71 55.52 8.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.168 -179.919 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.506 HG12 ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -104.44 119.94 54.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.658 0.742 . . . . 0.0 112.447 -178.786 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.665 ' H ' ' HA ' ' A' ' 12' ' ' CYS . 82.7 m 65.22 38.53 5.91 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.587 -1.188 . . . . 0.0 110.067 179.862 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.43 ' CD2' ' HG2' ' A' ' 9' ' ' ARG . 18.6 t80 -178.45 170.04 1.72 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.814 -1.084 . . . . 0.0 109.99 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.43 ' HG2' ' CD2' ' A' ' 8' ' ' TYR . 22.7 mmt180 34.63 36.97 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.516 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.81 ' O ' HG23 ' A' ' 11' ' ' ILE . . . 148.28 -72.33 0.3 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.079 -179.914 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.81 HG23 ' O ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER 179.31 -169.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 116.652 0.226 . . . . 0.0 110.779 -179.419 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.665 ' HA ' ' H ' ' A' ' 7' ' ' CYS . 57.8 m -93.06 92.94 8.05 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.053 0.454 . . . . 0.0 111.0 179.885 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.581 ' O ' ' CG ' ' A' ' 13' ' ' TYR . 0.8 OUTLIER -137.29 99.45 3.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.596 179.676 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.427 ' HG2' HG11 ' A' ' 6' ' ' VAL . 0.4 OUTLIER -79.03 115.48 18.73 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.069 -177.97 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.461 ' HG3' ' CE2' ' A' ' 13' ' ' TYR . 1.0 OUTLIER 167.1 87.44 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.775 179.266 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' CG ' ' A' ' 4' ' ' PHE . 23.0 t -119.67 135.47 54.81 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.741 -179.989 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.833 -179.975 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.6 ttpp . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.85 0.357 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.549 ' CD1' ' N ' ' A' ' 2' ' ' TRP . 0.1 OUTLIER -178.85 -111.14 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.241 -179.964 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.592 ' HB3' HG11 ' A' ' 6' ' ' VAL . 39.0 t -47.02 130.04 12.21 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.846 0.355 . . . . 0.0 111.018 179.994 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.48 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -77.85 150.62 34.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.459 -179.951 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.681 ' HA ' ' CD2' ' A' ' 13' ' ' TYR . 0.7 OUTLIER 47.18 81.78 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.107 -179.914 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.797 ' H ' ' HB3' ' A' ' 13' ' ' TYR . 2.5 p 173.14 166.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.81 -176.945 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.564 ' N ' HG22 ' A' ' 6' ' ' VAL . 0.1 OUTLIER -57.45 88.48 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.676 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.473 ' HD2' HG13 ' A' ' 6' ' ' VAL . 8.6 p90 -135.74 153.04 51.69 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.395 0.617 . . . . 0.0 112.558 -178.931 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.441 ' HG3' ' N ' ' A' ' 10' ' ' GLY . 6.1 ptm180 39.06 -161.1 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.063 -0.971 . . . . 0.0 112.377 179.239 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.441 ' N ' ' HG3' ' A' ' 9' ' ' ARG . . . -47.78 -21.3 1.46 Allowed Glycine 0 CA--C 1.52 0.368 0 CA-C-N 115.781 -0.645 . . . . 0.0 114.525 -179.069 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.472 ' O ' HD12 ' A' ' 11' ' ' ILE . 1.5 pp -116.19 102.77 14.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 117.918 0.859 . . . . 0.0 111.824 -179.555 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.21 95.73 0.78 Allowed 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.301 179.596 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.797 ' HB3' ' H ' ' A' ' 6' ' ' VAL . 2.4 t80 -85.36 -165.37 1.2 Allowed 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.584 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.434 ' CG ' ' O ' ' A' ' 13' ' ' TYR . 21.6 mtm-85 -156.77 114.53 3.21 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 119.994 -0.682 . . . . 0.0 112.233 -179.698 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 171.56 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.967 179.241 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.42 ' HB2' ' CG2' ' A' ' 6' ' ' VAL . 0.6 OUTLIER 51.22 -163.76 0.06 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.506 -179.956 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.893 179.784 . . . . . . . . 1 1 . 1 stop_ save_