data_5znu_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 5znu _Structure_validation_residue.Date_analyzed 2019-04-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.7 p . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.698 0.285 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.526 ' HD3' ' HB3' ' A' ' 14' ' ' ASP . 13.5 mptt -98.9 152.7 19.47 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.044 0.537 . . . . 0.0 109.894 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -97.13 152.64 18.59 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.358 177.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.423 ' HB2' HG23 ' A' ' 17' ' ' THR . 0.4 OUTLIER -63.82 126.64 28.29 Favored 'General case' 0 C--O 1.244 0.772 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 171.839 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.02 -22.48 33.25 Favored Glycine 0 C--N 1.337 0.637 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.903 -176.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 t -78.84 178.62 7.8 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.243 0.617 . . . . 0.0 109.454 173.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.495 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 22.0 p -97.26 136.1 38.23 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.956 0.502 . . . . 0.0 110.717 176.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.669 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 30.7 p -147.95 148.43 30.77 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.853 0.461 . . . . 0.0 110.126 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -73.75 146.15 44.57 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.504 0.722 . . . . 0.0 111.196 -173.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.601 ' HG2' HG21 ' A' ' 11' ' ' THR . 54.5 ttp180 -35.46 -61.25 0.46 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 126.91 2.084 . . . . 0.0 115.521 -166.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.601 HG21 ' HG2' ' A' ' 10' ' ' ARG . 19.4 p -133.73 28.68 3.9 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 120.892 0.377 . . . . 0.0 110.996 -175.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.7 m -86.61 4.05 41.91 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.394 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 60.15 23.32 12.61 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 124.857 1.263 . . . . 0.0 112.49 176.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.622 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 83.6 m-20 -61.35 -36.26 79.71 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -169.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.669 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 99.6 m -75.86 152.49 37.19 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.6 m -89.33 -23.63 22.2 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.248 165.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.423 HG23 ' HB2' ' A' ' 4' ' ' LYS . 11.5 t -156.4 147.05 21.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.891 0.876 . . . . 0.0 108.79 172.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.16 141.22 11.9 Favored Glycine 0 C--N 1.343 0.952 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -176.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.6 m -83.6 126.36 32.75 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 94.0 m -71.58 76.88 0.81 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 121.844 0.83 . . . . 0.0 110.749 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.2 ttt180 -117.19 133.4 56.03 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 124.56 1.144 . . . . 0.0 108.382 -174.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 64.9 t30 62.18 35.91 15.28 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 124.538 1.135 . . . . 0.0 110.152 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.15 13.11 64.13 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 114.455 -1.248 . . . . 0.0 114.196 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.5 mtmp? -136.86 160.41 38.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.683 0.793 . . . . 0.0 111.182 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t . . . . . 0 CA--C 1.547 0.857 0 C-N-CA 124.121 0.969 . . . . 0.0 110.055 -173.971 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.0 p . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.615 ' HG2' ' HB3' ' A' ' 8' ' ' CYS . 5.6 mptp? -65.21 119.34 10.7 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.528 0.731 . . . . 0.0 112.923 -173.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -78.78 159.68 27.77 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.726 0.81 . . . . 0.0 109.995 171.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -62.67 123.79 19.32 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.692 0.397 . . . . 0.0 110.699 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.89 -27.56 10.22 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.595 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.4 t -75.69 148.84 38.32 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.116 0.566 . . . . 0.0 110.241 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 62.3 p -77.94 134.94 37.79 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 120.897 0.379 . . . . 0.0 110.249 -176.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.615 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 14.8 p -145.69 165.25 29.3 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.786 0.834 . . . . 0.0 109.893 -179.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.75 153.18 44.27 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 173.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -50.49 -45.15 56.17 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.432 1.093 . . . . 0.0 112.665 -172.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -126.56 48.68 2.12 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.061 0.944 . . . . 0.0 109.271 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.0 p -55.16 -40.35 70.53 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.881 0.873 . . . . 0.0 112.229 -176.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.9 t80 65.55 9.78 6.13 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 125.221 1.409 . . . . 0.0 111.638 -174.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -93.16 -14.42 27.21 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.445 1.098 . . . . 0.0 109.592 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.0 t -62.88 108.55 1.22 Allowed 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.007 -178.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.4 t -50.83 -45.95 59.79 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 126.328 1.851 . . . . 0.0 113.255 -168.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.3 t -158.91 39.66 0.22 Allowed 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.074 0.94 . . . . 0.0 109.451 -174.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -150.77 174.51 30.06 Favored Glycine 0 C--N 1.339 0.699 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.48 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 36.9 m -112.74 133.93 54.52 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 174.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.9 m -72.3 84.16 1.06 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.744 0.783 . . . . 0.0 110.553 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.8 mtt180 -100.77 132.71 46.03 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.112 1.365 . . . . 0.0 109.327 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 61.7 25.21 15.15 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.207 1.003 . . . . 0.0 111.534 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.54 2.79 81.9 Favored Glycine 0 CA--C 1.538 1.521 0 CA-C-N 115.565 -0.743 . . . . 0.0 114.685 178.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -139.45 159.71 41.52 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-N 118.154 0.977 . . . . 0.0 109.761 174.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.581 ' SG ' ' HB3' ' A' ' 2' ' ' LYS . 49.5 m . . . . . 0 N--CA 1.478 0.956 0 C-N-CA 123.178 0.591 . . . . 0.0 111.721 176.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.7 p . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 7' ' ' SER . 2.3 mptm? -69.51 137.27 52.38 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.248 0.619 . . . . 0.0 111.974 -174.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 71.7 mtp180 -90.12 177.66 6.38 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.742 0.817 . . . . 0.0 110.074 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.0 125.94 16.91 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.371 1.068 . . . . 0.0 111.222 179.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.27 -23.07 33.44 Favored Glycine 0 C--N 1.348 1.216 0 O-C-N 123.396 0.435 . . . . 0.0 113.626 178.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.1 t -85.41 165.72 16.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.157 0.583 . . . . 0.0 111.056 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.409 ' O ' ' HG2' ' A' ' 2' ' ' LYS . 37.3 p -79.34 104.86 10.25 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 123.944 0.898 . . . . 0.0 113.101 -166.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.6 p -119.39 153.31 35.39 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.45 0.7 . . . . 0.0 110.617 176.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.1 mmt-85 -74.66 -177.26 3.12 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 122.574 0.35 . . . . 0.0 110.439 -174.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -50.47 -66.88 0.31 Allowed 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.349 1.059 . . . . 0.0 113.077 -173.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.3 p -140.84 24.57 2.19 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.424 0.69 . . . . 0.0 110.481 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.3 p -64.64 -20.98 66.6 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.646 1.178 . . . . 0.0 113.853 -173.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER 65.86 26.05 11.16 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.849 1.26 . . . . 0.0 110.633 -169.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.27 -31.73 72.95 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 124.093 0.957 . . . . 0.0 109.666 169.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.556 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 5.4 t -67.62 125.75 27.19 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.967 171.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 t -69.06 -36.48 77.72 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.301 1.041 . . . . 0.0 111.3 -170.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 t -160.65 80.48 0.65 Allowed 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.506 0.722 . . . . 0.0 109.834 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 167.2 158.52 11.6 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.153 -0.931 . . . . 0.0 112.616 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.4 m -86.28 138.95 31.45 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.236 0.614 . . . . 0.0 109.737 175.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.556 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 83.8 m -93.94 132.74 38.09 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 123.238 0.615 . . . . 0.0 111.612 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.4 ttm-85 -141.94 137.48 31.3 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.373 1.069 . . . . 0.0 109.089 174.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.9 t30 58.89 39.43 23.84 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-O 122.582 1.182 . . . . 0.0 110.782 175.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.84 8.25 81.97 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 114.329 -1.305 . . . . 0.0 114.857 175.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 10.0 mtmp? -139.03 158.81 43.52 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 118.122 0.961 . . . . 0.0 111.433 -177.142 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 66.0 m . . . . . 0 N--CA 1.474 0.774 0 C-N-CA 124.256 1.022 . . . . 0.0 110.702 174.142 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.9 p . . . . . 0 N--CA 1.485 1.313 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -119.5 157.64 27.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.048 0.539 . . . . 0.0 110.16 174.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -94.1 155.26 17.18 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.746 0.819 . . . . 0.0 109.656 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HB2' HG22 ' A' ' 17' ' ' THR . 0.2 OUTLIER -63.16 111.07 2.06 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 172.751 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 126.89 -27.42 4.88 Favored Glycine 0 C--N 1.342 0.909 0 O-C-N 123.455 0.472 . . . . 0.0 112.642 -176.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 t -74.11 -174.99 2.07 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.63 0.772 . . . . 0.0 111.763 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.463 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 49.2 m -101.93 133.14 47.19 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.099 0.559 . . . . 0.0 109.655 173.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.567 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.2 p -155.23 150.37 26.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.44 0.696 . . . . 0.0 110.294 -176.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -70.81 140.72 51.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.513 0.325 . . . . 0.0 110.859 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.661 ' HG2' HG23 ' A' ' 11' ' ' THR . 44.3 ttp180 -34.21 -53.23 0.49 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 127.155 2.182 . . . . 0.0 115.939 -169.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.661 HG23 ' HG2' ' A' ' 10' ' ' ARG . 24.6 p -137.74 28.12 2.69 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 120.926 0.393 . . . . 0.0 111.716 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.421 ' OG ' ' HB2' ' A' ' 14' ' ' ASP . 27.4 p -77.39 -6.45 53.42 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.624 0.602 . . . . 0.0 112.624 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 62.44 29.17 17.11 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.983 0.913 . . . . 0.0 110.217 -173.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.564 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 45.4 t0 -69.77 -29.67 67.06 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.634 1.174 . . . . 0.0 111.281 -172.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.567 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 71.7 m -84.78 152.74 23.45 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.516 0.726 . . . . 0.0 111.466 176.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 72.0 m -84.97 -28.36 25.86 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.862 165.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.406 HG22 ' HB2' ' A' ' 4' ' ' LYS . 10.0 t -151.96 152.52 32.6 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.165 0.586 . . . . 0.0 110.158 175.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.66 164.45 36.9 Favored Glycine 0 C--N 1.346 1.118 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.076 -174.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.5 m -107.58 122.55 46.9 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 122.745 0.418 . . . . 0.0 109.9 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.436 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 85.6 m -69.26 87.75 0.43 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.268 0.556 . . . . 0.0 110.532 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -120.01 136.85 54.4 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.965 0.906 . . . . 0.0 109.732 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 59.27 32.01 21.62 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.568 1.147 . . . . 0.0 111.582 -176.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.32 8.57 87.03 Favored Glycine 0 C--N 1.343 0.926 0 CA-C-N 115.064 -0.971 . . . . 0.0 114.707 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.3 mtmp? -136.07 147.0 47.66 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.56 0.695 . . . . 0.0 111.717 178.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.0 t . . . . . 0 CA--C 1.547 0.85 0 C-N-CA 125.014 1.326 . . . . 0.0 110.737 177.707 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.0 p . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -105.57 153.27 22.0 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.5 0.72 . . . . 0.0 110.606 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -70.99 166.97 20.18 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.481 0.713 . . . . 0.0 111.236 178.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -66.28 118.99 10.75 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 174.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.22 -0.52 63.99 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 123.026 0.346 . . . . 0.0 112.832 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.0 t -92.12 152.3 19.98 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.102 0.561 . . . . 0.0 110.097 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.8 m -79.25 120.87 24.34 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.864 0.466 . . . . 0.0 111.108 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.562 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 9.8 p -109.5 -92.39 0.44 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.745 0.818 . . . . 0.0 109.557 178.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 177.09 131.3 0.05 Allowed 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -43.72 -37.56 2.73 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 115.761 1.763 . . . . 0.0 115.761 -165.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.2 p -124.87 6.46 8.05 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.918 0.711 . . . . 0.0 112.918 -176.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.2 m -78.37 -24.09 46.57 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 119.346 -0.359 . . . . 0.0 111.921 174.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.6 t80 53.32 39.04 29.21 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.226 1.01 . . . . 0.0 111.079 -174.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -88.14 36.77 0.79 Allowed 'General case' 0 CA--C 1.554 1.119 0 CA-C-O 122.117 0.961 . . . . 0.0 111.184 -169.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.562 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 61.0 m -107.85 134.41 50.83 Favored 'General case' 0 C--N 1.348 0.507 0 C-N-CA 124.126 0.971 . . . . 0.0 109.127 177.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -37.44 83.12 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.533 0.733 . . . . 0.0 110.591 173.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.7 t -141.9 144.12 33.65 Favored 'General case' 0 C--O 1.243 0.741 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 167.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.54 162.34 30.26 Favored Glycine 0 C--N 1.338 0.689 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.989 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.3 m -94.95 145.43 24.93 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.076 0.95 . . . . 0.0 109.714 177.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 62.7 m -74.11 76.06 1.75 Allowed 'General case' 0 CA--C 1.549 0.92 0 CA-C-O 122.07 0.938 . . . . 0.0 110.957 175.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.1 mtp180 -84.26 112.86 20.68 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 124.627 1.171 . . . . 0.0 109.28 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.7 t30 58.99 40.54 22.22 Favored 'General case' 0 CA--C 1.557 1.23 0 CA-C-O 122.576 1.179 . . . . 0.0 109.894 178.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.83 -13.78 61.96 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 114.658 -1.155 . . . . 0.0 114.397 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.487 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 9.9 mtmp? -126.79 154.2 44.58 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 117.952 0.876 . . . . 0.0 111.25 -171.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.5 m . . . . . 0 CA--C 1.547 0.863 0 C-N-CA 124.193 0.997 . . . . 0.0 111.098 -175.446 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 14' ' ' ASP . 14.6 p . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.669 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 47.5 mmtm -80.28 126.77 31.56 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 118.272 0.487 . . . . 0.0 110.304 -171.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 172.13 9.27 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 175.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -66.81 118.0 9.71 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.089 0.471 . . . . 0.0 110.329 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 107.62 -14.05 38.76 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 115.279 -0.873 . . . . 0.0 113.016 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.0 t -72.97 152.75 41.24 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.102 0.561 . . . . 0.0 111.106 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.555 ' HA ' ' HG2' ' A' ' 24' ' ' LYS . 31.8 m -80.18 140.41 36.34 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 122.953 0.501 . . . . 0.0 110.12 177.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.45 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 6.3 p -149.2 -177.19 5.69 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.705 0.802 . . . . 0.0 110.124 178.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.47 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 49.0 ttp85 -84.53 173.46 10.8 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 168.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.47 ' H ' ' HG2' ' A' ' 9' ' ' ARG . 57.8 ttp180 -49.82 -34.0 18.4 Favored 'General case' 0 N--CA 1.5 2.055 0 C-N-CA 123.999 0.919 . . . . 0.0 112.106 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.4 t -155.14 96.04 1.78 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-O 121.895 0.855 . . . . 0.0 108.866 163.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.6 p -82.66 -12.52 57.57 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.001 -0.999 . . . . 0.0 111.696 176.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 70.9 -22.78 0.18 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 126.038 1.735 . . . . 0.0 114.278 177.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' A' ' 1' ' ' CYS . 3.7 p-10 -86.83 2.77 47.88 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 118.339 0.518 . . . . 0.0 111.03 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.669 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 42.4 t -64.1 97.32 0.17 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.1 m -60.22 -34.94 74.36 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.078 0.951 . . . . 0.0 112.737 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.4 t -148.58 138.01 21.93 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 120.755 0.312 . . . . 0.0 110.415 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.3 164.42 40.25 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.605 -173.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 60.7 m -104.75 148.04 27.04 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.5 m -75.65 71.51 2.54 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.823 0.82 . . . . 0.0 112.373 -176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -84.06 124.92 31.6 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.965 1.306 . . . . 0.0 109.055 178.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 59.66 32.87 21.75 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.347 1.07 . . . . 0.0 109.335 -173.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.38 36.09 92.6 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 113.816 -1.538 . . . . 0.0 113.308 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.555 ' HG2' ' HA ' ' A' ' 7' ' ' SER . 36.2 mtmm -148.0 140.07 24.13 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.522 0.729 . . . . 0.0 110.19 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 84.6 m . . . . . 0 CA--C 1.546 0.794 0 C-N-CA 123.094 0.558 . . . . 0.0 110.913 -178.377 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 28.5 p . . . . . 0 N--CA 1.484 1.239 0 CA-C-O 120.693 0.282 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -96.68 129.01 44.16 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.787 0.835 . . . . 0.0 110.671 -176.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -82.98 178.68 8.04 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.077 1.351 . . . . 0.0 111.439 177.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -66.19 100.25 0.6 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.799 0.84 . . . . 0.0 110.353 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 113.09 -17.01 22.44 Favored Glycine 0 C--N 1.343 0.946 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.367 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 45.6 t -69.8 143.01 53.07 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.256 0.622 . . . . 0.0 110.558 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 21.4 p -78.01 117.04 18.94 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.016 0.526 . . . . 0.0 111.347 -173.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.5 p -115.56 -163.86 0.91 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.015 0.926 . . . . 0.0 109.576 177.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.03 -164.21 1.14 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.298 0.639 . . . . 0.0 109.908 172.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -62.02 -62.22 1.94 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.721 0.808 . . . . 0.0 112.329 -175.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.7 p -144.76 22.41 1.61 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.864 0.866 . . . . 0.0 109.824 -175.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.0 m -76.78 13.58 1.0 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -168.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 64.04 18.21 11.09 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.254 1.022 . . . . 0.0 112.893 171.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -60.26 -28.99 68.5 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.383 0.673 . . . . 0.0 111.483 -177.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.6 m -58.62 133.07 55.55 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.773 1.229 . . . . 0.0 113.025 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -72.72 -28.7 62.82 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.421 0.689 . . . . 0.0 109.855 164.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.0 t -155.19 145.56 21.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.745 0.818 . . . . 0.0 109.705 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 83.65 -168.99 46.44 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 116.264 -0.425 . . . . 0.0 112.552 -175.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.8 t -134.95 152.8 52.06 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.331 0.652 . . . . 0.0 109.816 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.2 m -72.49 114.96 11.18 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.386 0.675 . . . . 0.0 112.675 -173.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.0 mmt-85 -102.26 105.25 15.86 Favored 'General case' 0 C--O 1.245 0.823 0 C-N-CA 124.459 1.104 . . . . 0.0 109.864 170.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.1 t30 50.55 70.38 0.52 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.783 1.233 . . . . 0.0 112.006 171.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.36 7.78 34.55 Favored Glycine 0 CA--C 1.539 1.576 0 N-CA-C 114.69 0.636 . . . . 0.0 114.69 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.689 ' HZ1' ' HB2' ' A' ' 24' ' ' LYS . 8.5 mtmp? -131.94 161.0 34.14 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.494 1.118 . . . . 0.0 108.37 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 48.5 t . . . . . 0 N--CA 1.476 0.825 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -178.128 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 52.2 t . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.597 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 73.8 mmtt -127.2 141.83 51.64 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.492 0.717 . . . . 0.0 110.095 177.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -120.61 173.51 7.14 Favored 'General case' 0 C--O 1.245 0.836 0 C-N-CA 124.438 1.095 . . . . 0.0 108.755 173.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -64.04 113.52 3.55 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.187 0.595 . . . . 0.0 111.046 -178.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 121.65 -29.23 5.7 Favored Glycine 0 C--N 1.339 0.748 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.737 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.0 t -77.35 137.16 38.58 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.95 0.5 . . . . 0.0 111.002 -175.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.6 p -79.21 126.86 31.31 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.256 0.622 . . . . 0.0 111.387 -175.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.56 ' SG ' ' HB2' ' A' ' 25' ' ' CYS . 8.0 p -152.66 155.3 37.02 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.378 0.671 . . . . 0.0 110.848 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -70.34 144.42 51.67 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.1 ttp180 -43.23 -43.11 4.6 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 125.111 1.364 . . . . 0.0 114.145 -164.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.3 p -133.5 75.14 1.59 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.589 0.709 . . . . 0.0 109.741 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.4 m -88.12 -11.97 45.42 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.709 172.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.3 t80 61.06 19.28 9.79 Favored 'General case' 0 CA--C 1.559 1.296 0 C-N-CA 124.622 1.169 . . . . 0.0 112.244 -174.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -96.98 -15.7 20.97 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.569 -174.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 52.4 m -64.78 110.17 2.3 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.129 0.571 . . . . 0.0 111.278 176.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 79.4 m -74.97 -46.89 32.36 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.351 0.661 . . . . 0.0 110.034 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.2 p -130.6 101.14 5.57 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.842 0.857 . . . . 0.0 108.916 175.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 125.94 -166.27 18.77 Favored Glycine 0 C--N 1.348 1.235 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.869 -177.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 63.1 m -146.88 143.32 28.46 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.176 0.991 . . . . 0.0 108.956 174.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 61.7 m -73.13 99.4 2.8 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.292 0.637 . . . . 0.0 110.446 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -111.98 128.39 56.15 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.914 0.486 . . . . 0.0 110.288 177.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 58.98 26.21 14.76 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 125.652 1.581 . . . . 0.0 112.073 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 100.42 -0.9 55.77 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-N 115.007 -0.997 . . . . 0.0 115.021 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -138.49 144.38 40.0 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 118.901 1.351 . . . . 0.0 110.876 176.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.56 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 10.8 t . . . . . 0 N--CA 1.475 0.82 0 C-N-CA 124.409 1.084 . . . . 0.0 110.898 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.4 p . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.423 ' HE3' ' N ' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -71.18 139.41 50.16 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 123.314 0.384 . . . . 0.0 111.131 -178.191 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -82.18 173.23 12.31 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.497 0.719 . . . . 0.0 110.394 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.543 ' HZ3' ' HB2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -67.0 124.57 23.4 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-O 120.836 0.351 . . . . 0.0 110.574 -178.365 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.42 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . 96.18 -17.35 59.44 Favored Glycine 0 C--N 1.352 1.451 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.653 -172.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.7 t -79.28 149.2 31.88 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.256 0.622 . . . . 0.0 111.125 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.7 m -79.03 101.1 7.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.51 0.724 . . . . 0.0 111.323 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.51 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 20.1 p -107.31 148.22 29.28 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.964 0.905 . . . . 0.0 110.31 177.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.432 ' HB3' ' OG ' ' A' ' 12' ' ' SER . 44.6 ttt180 -59.97 131.29 50.39 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 122.787 0.435 . . . . 0.0 110.086 -179.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -50.34 -40.85 50.26 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 115.668 1.729 . . . . 0.0 115.668 -153.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.3 p -135.46 14.22 3.47 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.432 ' OG ' ' HB3' ' A' ' 9' ' ' ARG . 81.0 p -83.55 -12.92 55.57 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.134 0.573 . . . . 0.0 110.842 175.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 61.93 40.02 12.91 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 124.793 1.237 . . . . 0.0 110.329 -176.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -70.64 -4.23 22.39 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 113.505 -1.679 . . . . 0.0 112.006 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.51 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 11.5 t -85.47 164.86 17.59 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.788 0.835 . . . . 0.0 110.9 176.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.78 -21.59 16.28 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.462 1.105 . . . . 0.0 110.015 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.0 t -153.92 143.82 21.9 Favored 'General case' 0 C--N 1.353 0.735 0 C-N-CA 123.609 0.764 . . . . 0.0 109.735 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.3 -162.53 49.68 Favored Glycine 0 C--N 1.337 0.628 0 CA-C-N 116.586 -0.279 . . . . 0.0 112.63 -177.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.0 t -119.74 158.29 26.82 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.816 0.846 . . . . 0.0 109.18 176.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 96.7 m -84.42 69.06 10.47 Favored 'General case' 0 CA--C 1.558 1.256 0 CA-C-O 121.678 0.751 . . . . 0.0 111.195 -177.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -68.07 115.39 7.51 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.237 1.415 . . . . 0.0 109.654 177.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 60.85 28.09 17.87 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 122.383 1.087 . . . . 0.0 110.218 -178.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.49 28.9 66.76 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 114.523 -1.217 . . . . 0.0 113.643 -176.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -141.15 158.8 43.42 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.809 0.844 . . . . 0.0 110.216 173.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.42 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 76.5 m . . . . . 0 CA--C 1.542 0.668 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.404 -175.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.9 p . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.703 0.287 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.634 ' HG3' ' HA ' ' A' ' 8' ' ' CYS . 74.7 mmtt -93.4 155.5 17.33 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-O 120.683 0.277 . . . . 0.0 110.271 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -107.25 170.67 7.82 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.029 0.532 . . . . 0.0 109.672 -177.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -63.41 128.64 36.77 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.109 0.564 . . . . 0.0 110.747 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.8 -9.32 77.62 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.327 -177.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.1 t -94.3 148.88 21.77 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.333 0.653 . . . . 0.0 110.043 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.9 p -79.35 108.07 12.59 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.322 0.649 . . . . 0.0 110.58 -176.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.634 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 2.9 p -89.39 -97.62 0.1 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.541 0.736 . . . . 0.0 109.869 178.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.6 ttt180 175.46 142.57 0.06 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.674 1.19 . . . . 0.0 108.073 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -29.13 -66.26 0.09 Allowed 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 127.043 2.137 . . . . 0.0 115.697 -162.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.7 p -129.55 18.32 5.79 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.767 0.827 . . . . 0.0 111.405 -174.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.9 m -71.84 -35.31 69.82 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.066 0.546 . . . . 0.0 112.446 -176.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.6 t80 55.7 32.82 20.12 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.8 1.24 . . . . 0.0 112.36 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -70.59 -14.71 62.6 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.723 168.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.6 t -66.71 130.19 42.34 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.673 0.789 . . . . 0.0 109.892 171.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.97 -37.66 85.61 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.543 0.527 . . . . 0.0 111.703 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.4 t -154.39 140.52 18.45 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 122.73 0.412 . . . . 0.0 110.158 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.67 140.26 10.88 Favored Glycine 0 C--N 1.343 0.966 0 C-N-CA 123.247 0.451 . . . . 0.0 112.2 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.2 m -80.12 127.32 32.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 122.98 0.512 . . . . 0.0 109.845 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.1 m -68.69 80.04 0.28 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.902 0.881 . . . . 0.0 112.694 -177.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -84.43 125.27 32.19 Favored 'General case' 0 C--O 1.243 0.752 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.5 t30 59.26 29.92 19.57 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.048 0.939 . . . . 0.0 110.184 -174.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.93 32.69 77.81 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.515 -175.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.581 ' HZ2' ' HB3' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -145.78 133.12 20.63 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -176.734 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 CA--C 1.549 0.91 0 C-N-CA 124.175 0.99 . . . . 0.0 111.969 -177.148 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 120.304 0.097 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -118.45 166.53 12.57 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 121.459 0.647 . . . . 0.0 111.308 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -120.97 169.44 10.47 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.911 174.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.39 139.23 43.88 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 122.68 0.392 . . . . 0.0 110.931 175.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.38 -0.3 89.15 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-N 116.211 -0.45 . . . . 0.0 113.78 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t -88.82 -173.43 4.1 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 117.568 0.684 . . . . 0.0 109.673 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.556 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 79.6 p -113.1 118.49 34.89 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.586 0.755 . . . . 0.0 109.034 174.4 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.9 p -124.88 174.88 7.65 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 122.741 0.416 . . . . 0.0 111.511 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.484 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 4.7 mpt_? -76.53 169.79 17.6 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.851 0.861 . . . . 0.0 110.01 176.11 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -55.73 -57.47 11.87 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.84 0.856 . . . . 0.0 113.14 -171.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -157.41 26.68 0.29 Allowed 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.248 0.547 . . . . 0.0 110.15 -178.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -78.0 10.05 3.18 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 124.235 1.014 . . . . 0.0 112.12 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 62.6 30.57 17.02 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.64 1.176 . . . . 0.0 111.011 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -67.79 -21.13 65.26 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.851 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 75.0 m -92.64 146.01 23.99 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 121.904 -0.498 . . . . 0.0 111.036 174.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.8 m -86.19 -50.8 6.71 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 166.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.4 p -127.32 112.11 14.67 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.232 1.013 . . . . 0.0 109.398 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.96 137.64 4.35 Favored Glycine 0 C--N 1.35 1.334 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -177.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.429 ' HB2' ' NH1' ' A' ' 21' ' ' ARG . 25.4 m -89.56 131.5 35.55 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 117.374 0.587 . . . . 0.0 109.511 177.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.1 m -79.31 115.08 18.74 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -173.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.429 ' NH1' ' HB2' ' A' ' 19' ' ' SER . 7.9 mpt_? -103.36 -168.44 1.51 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.223 1.009 . . . . 0.0 109.549 172.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -52.15 99.08 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.743 1.217 . . . . 0.0 112.481 -177.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.35 0.62 47.25 Favored Glycine 0 C--N 1.356 1.661 0 CA-C-N 115.161 -0.927 . . . . 0.0 114.581 175.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.62 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 9.9 mtmp? -136.94 155.73 49.37 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-N 117.463 0.632 . . . . 0.0 111.816 -168.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.1 t . . . . . 0 N--CA 1.467 0.396 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 170.762 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.478 0.973 0 CA-C-O 120.704 0.288 . . . . 0.0 110.62 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.461 ' HD3' ' HB3' ' A' ' 14' ' ' ASP . 4.4 mptp? -83.89 129.07 34.94 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.245 0.618 . . . . 0.0 110.384 -177.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.94 177.85 7.81 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.21 0.604 . . . . 0.0 109.506 177.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -59.21 115.77 3.43 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.155 0.582 . . . . 0.0 111.1 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.33 -20.98 36.34 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-O 119.838 -0.423 . . . . 0.0 113.268 -178.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.1 t -76.5 153.18 35.74 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.924 0.49 . . . . 0.0 110.886 178.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 30.5 p -79.13 103.45 9.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.533 0.733 . . . . 0.0 111.678 -174.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.476 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 30.1 p -114.9 131.56 56.83 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.656 0.782 . . . . 0.0 109.857 177.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.654 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 96.5 mtt180 -58.21 139.75 54.38 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.048 0.539 . . . . 0.0 111.784 -174.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.2 ttp-105 -39.43 -46.76 1.71 Allowed 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 126.634 1.974 . . . . 0.0 115.126 -162.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -139.03 7.35 2.44 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.812 0.445 . . . . 0.0 111.377 -176.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.654 ' HB3' ' HB2' ' A' ' 9' ' ' ARG . 47.4 t -80.77 -0.65 39.54 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.49 0.716 . . . . 0.0 111.502 179.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.0 t80 59.83 34.37 21.82 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.886 1.274 . . . . 0.0 112.727 170.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.461 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 7.2 m-20 -68.09 -17.1 64.28 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.309 0.644 . . . . 0.0 112.192 176.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.454 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 4.8 t -72.65 150.69 42.79 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 123.351 0.66 . . . . 0.0 110.269 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.6 m -64.88 -42.78 94.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.769 0.828 . . . . 0.0 109.719 176.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.5 t -172.01 148.98 2.33 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.89 1.276 . . . . 0.0 108.716 167.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 125.11 -171.92 17.14 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-N 116.432 -0.349 . . . . 0.0 112.639 -178.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.6 m -101.97 114.63 28.91 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.659 0.783 . . . . 0.0 110.257 -175.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 94.9 m -76.19 74.67 3.02 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.233 0.613 . . . . 0.0 110.53 175.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -89.27 128.33 35.85 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.2 t30 55.29 31.17 16.08 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.508 1.123 . . . . 0.0 110.316 -175.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.13 40.61 92.77 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 114.375 -1.284 . . . . 0.0 113.871 -176.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -151.37 141.17 21.88 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 117.288 0.544 . . . . 0.0 109.661 179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.476 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 88.8 m . . . . . 0 N--CA 1.483 1.218 0 C-N-CA 124.238 1.015 . . . . 0.0 111.696 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.3 p . . . . . 0 N--CA 1.475 0.796 0 CA-C-O 121.49 0.662 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.457 ' HG3' ' HB3' ' A' ' 8' ' ' CYS . 43.7 mmtm -91.85 154.09 19.12 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.457 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -107.01 177.96 4.7 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -67.8 106.89 2.41 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 125.72 -19.26 6.62 Favored Glycine 0 C--N 1.337 0.585 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.13 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.2 t -91.71 152.09 20.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.676 0.79 . . . . 0.0 110.755 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 72.4 p -77.36 136.64 38.46 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.389 0.676 . . . . 0.0 110.052 -178.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 25' ' ' CYS . 7.5 p -154.48 163.17 40.6 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.932 0.493 . . . . 0.0 112.013 -171.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -64.0 136.26 57.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.824 0.85 . . . . 0.0 109.985 173.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.48 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 30.4 ttp-105 -52.06 -58.34 6.84 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 124.762 1.289 . . . . 0.0 113.378 -166.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.4 p -132.46 18.32 4.37 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.567 -0.708 . . . . 0.0 111.827 -178.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.4 t -87.76 11.33 15.66 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.998 0.519 . . . . 0.0 111.419 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 59.01 35.67 24.11 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.24 1.016 . . . . 0.0 112.129 176.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -72.62 -30.86 64.69 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.319 177.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.2 t -80.86 139.74 35.78 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 166.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.64 -48.69 76.23 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.517 0.727 . . . . 0.0 112.471 -172.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.0 t -146.62 31.0 0.98 Allowed 'General case' 0 N--CA 1.486 1.333 0 CA-C-O 122.15 0.976 . . . . 0.0 112.017 -171.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.429 ' HA3' ' SG ' ' A' ' 25' ' ' CYS . . . -140.6 150.7 21.85 Favored Glycine 0 N--CA 1.469 0.867 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.656 -179.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.0 m -82.37 124.37 29.95 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.185 0.594 . . . . 0.0 110.963 -179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 98.6 m -90.25 119.44 30.56 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.658 0.783 . . . . 0.0 110.767 -178.12 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -141.59 155.18 45.76 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 173.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 60.39 22.81 12.37 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.733 0.813 . . . . 0.0 110.574 -170.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.24 32.22 83.11 Favored Glycine 0 C--N 1.342 0.869 0 CA-C-N 115.163 -0.926 . . . . 0.0 114.122 -172.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 1.0 OUTLIER -154.48 139.71 17.55 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 117.655 0.727 . . . . 0.0 110.667 -179.0 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.468 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 43.7 t . . . . . 0 N--CA 1.472 0.664 0 C-N-CA 124.222 1.009 . . . . 0.0 109.742 -179.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.449 ' HG3' ' HA ' ' A' ' 8' ' ' CYS . 75.3 mmtt -130.31 130.61 44.71 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.135 0.974 . . . . 0.0 109.801 -175.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -72.99 172.03 11.74 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.115 0.566 . . . . 0.0 111.498 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -62.01 106.11 0.67 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.779 0.832 . . . . 0.0 111.151 -177.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 116.39 -10.35 17.0 Favored Glycine 0 C--N 1.356 1.639 0 C-N-CA 123.132 0.396 . . . . 0.0 113.484 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.4 t -92.8 150.86 20.35 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 117.492 0.646 . . . . 0.0 110.49 177.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.607 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 38.5 p -78.85 112.4 15.97 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.962 0.505 . . . . 0.0 111.362 -175.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.449 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 27.9 p -100.85 152.36 20.61 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.091 0.556 . . . . 0.0 111.418 -178.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -59.03 131.97 52.63 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.689 0.796 . . . . 0.0 110.461 175.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -45.79 -45.61 14.86 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 125.219 1.574 . . . . 0.0 114.46 -161.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.4 p -137.23 12.94 3.05 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.873 0.469 . . . . 0.0 111.674 -175.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.7 t -93.94 21.9 6.22 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -168.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.8 t80 52.3 40.84 29.96 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 124.515 1.126 . . . . 0.0 111.759 -179.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -91.71 7.59 40.97 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.05 -175.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.5 m -89.48 122.89 33.1 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.177 0.591 . . . . 0.0 111.27 174.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 83.5 m -69.3 -38.03 78.08 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.812 0.845 . . . . 0.0 109.539 166.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.2 t -158.46 134.42 9.09 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.943 0.897 . . . . 0.0 109.094 176.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.71 -170.83 20.46 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 112.348 -0.301 . . . . 0.0 112.348 -177.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 37.7 m -116.59 146.3 42.76 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.555 0.742 . . . . 0.0 110.248 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.3 m -75.28 82.21 2.41 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 122.139 0.971 . . . . 0.0 111.004 174.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 -92.33 111.39 22.95 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.517 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.7 t30 61.12 30.15 19.25 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 124.666 1.186 . . . . 0.0 110.791 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.4 29.01 68.73 Favored Glycine 0 C--N 1.342 0.909 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.937 -175.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.607 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.4 mtmp? -135.31 136.85 41.9 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.554 0.741 . . . . 0.0 109.685 175.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.3 t . . . . . 0 N--CA 1.473 0.694 0 C-N-CA 123.093 0.557 . . . . 0.0 110.475 -173.865 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 120.926 0.393 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -109.17 165.68 11.42 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.539 0.735 . . . . 0.0 109.447 169.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -109.03 -177.88 3.43 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.395 0.678 . . . . 0.0 110.781 177.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -63.5 122.25 15.81 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.82 0.848 . . . . 0.0 110.515 -177.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.4 -9.07 72.03 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 116.076 -0.511 . . . . 0.0 113.105 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.5 t -90.42 152.35 21.01 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 117.328 0.564 . . . . 0.0 110.202 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.1 m -78.71 126.31 30.55 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.378 0.671 . . . . 0.0 111.171 -172.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 23.9 p -146.45 147.29 31.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.658 0.783 . . . . 0.0 109.364 -176.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.437 ' HB2' ' OG ' ' A' ' 12' ' ' SER . 28.4 mmt180 -60.11 138.47 57.88 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 122.839 0.456 . . . . 0.0 111.402 -173.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -44.53 -44.96 9.07 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 125.694 1.598 . . . . 0.0 115.289 -159.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.6 t -129.0 1.13 5.28 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 122.0 -0.438 . . . . 0.0 112.047 -175.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 9' ' ' ARG . 99.0 p -66.75 -19.22 65.7 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -174.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 63.48 39.29 9.23 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 124.655 1.182 . . . . 0.0 109.992 -172.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 22.0 t0 -68.54 -22.23 64.51 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.155 176.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 25' ' ' CYS . 48.9 t -80.15 145.01 32.56 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.344 0.657 . . . . 0.0 109.549 166.251 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.76 -42.96 99.65 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.205 0.602 . . . . 0.0 111.996 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.5 t -148.25 137.26 21.85 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.191 0.596 . . . . 0.0 110.251 175.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.9 151.96 14.94 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.951 -176.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.4 t -82.97 131.09 35.2 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.445 0.698 . . . . 0.0 110.428 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.2 m -75.23 79.71 2.34 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-O 121.764 0.793 . . . . 0.0 110.984 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -85.71 130.7 34.49 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.776 0.831 . . . . 0.0 109.373 -175.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 61.0 28.99 18.75 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.992 0.917 . . . . 0.0 111.028 -175.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.26 36.1 91.27 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 114.782 -1.099 . . . . 0.0 112.853 -174.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.448 ' HE3' ' HB3' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -155.29 131.77 10.43 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.237 0.615 . . . . 0.0 109.669 -177.735 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 46.2 t . . . . . 0 CA--C 1.55 0.972 0 C-N-CA 124.506 1.123 . . . . 0.0 112.888 -174.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.6 p . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.392 0.139 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.77 146.42 35.86 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 176.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -87.14 162.34 17.58 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.87 0.468 . . . . 0.0 111.089 -170.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -70.39 117.0 11.38 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 102.03 -18.6 51.74 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.517 -173.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.3 t -83.49 162.97 20.75 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.332 0.653 . . . . 0.0 110.382 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.465 ' HA ' ' HG2' ' A' ' 24' ' ' LYS . 58.2 p -78.65 131.78 36.81 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.19 0.596 . . . . 0.0 110.742 -177.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.75 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 23.4 p -150.84 170.39 19.39 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.108 0.563 . . . . 0.0 111.435 -176.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -76.06 -156.19 0.06 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.215 0.606 . . . . 0.0 111.011 -178.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -74.59 -73.63 0.23 Allowed 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 122.465 0.306 . . . . 0.0 111.716 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.5 p -146.26 18.61 1.38 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.975 0.51 . . . . 0.0 112.337 -167.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.6 m -87.88 48.26 1.62 Allowed 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.907 -0.496 . . . . 0.0 111.948 -174.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.3 t80 53.03 38.08 26.38 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.176 1.39 . . . . 0.0 111.772 -178.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.75 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 13.5 m-20 -71.03 -60.14 2.39 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.483 -1.235 . . . . 0.0 112.149 -174.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.8 t -69.4 135.7 50.64 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.6 t -67.58 -37.56 82.8 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.798 0.839 . . . . 0.0 111.2 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.1 t -153.07 83.24 1.2 Allowed 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 122.209 1.004 . . . . 0.0 108.575 173.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 161.13 -173.5 37.58 Favored Glycine 0 C--N 1.341 0.825 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.386 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.4 m -109.51 144.14 38.2 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.374 0.67 . . . . 0.0 110.002 176.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 25' ' ' CYS . 52.0 m -87.47 98.86 11.62 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.735 0.814 . . . . 0.0 110.556 177.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -87.56 107.06 18.41 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.395 1.078 . . . . 0.0 109.437 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.8 t30 46.79 69.65 0.47 Allowed 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 125.051 1.34 . . . . 0.0 112.659 173.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.71 -7.41 58.65 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.616 -1.102 . . . . 0.0 115.221 173.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.476 ' HB2' ' HZ3' ' A' ' 24' ' ' LYS . 10.4 mtmp? -145.12 147.9 33.03 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 118.781 1.29 . . . . 0.0 110.195 176.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 20' ' ' CYS . 41.6 t . . . . . 0 N--CA 1.477 0.923 0 O-C-N 122.114 -0.366 . . . . 0.0 110.329 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 C--O 1.243 0.748 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -74.32 146.58 42.99 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.482 0.713 . . . . 0.0 111.665 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -87.49 165.7 15.33 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.562 0.745 . . . . 0.0 109.196 171.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 25' ' ' CYS . 86.9 tttt -63.67 126.78 28.66 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 123.494 0.496 . . . . 0.0 110.6 -176.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 112.19 -40.95 2.36 Favored Glycine 0 C--N 1.342 0.903 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.684 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.9 t -70.42 146.75 50.16 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 122.942 0.497 . . . . 0.0 110.693 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 34.7 p -76.3 101.92 5.67 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.443 0.64 . . . . 0.0 110.433 -175.338 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.516 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 19.1 p -93.53 178.9 5.55 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.814 174.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -73.1 178.96 4.05 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.009 0.524 . . . . 0.0 111.072 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 70.8 mmt-85 -69.28 -67.49 0.47 Allowed 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.908 0.483 . . . . 0.0 111.097 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 71.8 p -131.58 13.11 4.95 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.95 0.5 . . . . 0.0 111.331 -175.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.6 t -82.01 10.52 6.41 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.068 0.547 . . . . 0.0 112.417 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 58.6 34.84 24.16 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.486 1.114 . . . . 0.0 111.644 176.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.516 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 28.2 t70 -74.45 -8.34 55.98 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.224 -177.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 m -64.36 147.31 52.86 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.567 0.747 . . . . 0.0 111.455 166.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 t -90.57 -47.47 7.67 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.2 t -155.04 80.6 1.07 Allowed 'General case' 0 CA--C 1.556 1.186 0 CA-C-O 122.483 1.135 . . . . 0.0 108.465 172.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -174.61 -165.22 30.72 Favored Glycine 0 C--N 1.342 0.895 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.951 -175.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.3 m -126.08 104.9 8.51 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 122.98 0.512 . . . . 0.0 110.479 -177.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.0 m -59.61 115.44 3.32 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 121.122 0.487 . . . . 0.0 110.483 172.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -169.19 137.25 1.91 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.803 1.241 . . . . 0.0 108.414 -167.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 60.97 26.17 16.14 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.359 1.064 . . . . 0.0 111.75 178.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.96 4.13 90.54 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 114.966 -1.016 . . . . 0.0 114.799 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.571 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 10.2 mtmp? -133.67 161.63 34.13 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.421 0.688 . . . . 0.0 110.416 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 4' ' ' LYS . 34.5 t . . . . . 0 CA--C 1.537 0.462 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.336 0.112 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.439 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.4 OUTLIER -97.3 155.88 16.68 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.464 0.706 . . . . 0.0 110.746 179.095 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -117.63 -178.68 3.53 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.46 1.104 . . . . 0.0 109.461 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.464 ' HE3' ' HB ' ' A' ' 17' ' ' THR . 34.3 mmtp -54.01 114.96 1.78 Allowed 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.06 0.944 . . . . 0.0 112.954 -172.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.21 -23.44 24.28 Favored Glycine 0 C--N 1.349 1.304 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.233 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.4 t -65.24 137.59 57.68 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 123.156 0.582 . . . . 0.0 109.942 178.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 24.3 m -78.94 104.85 9.87 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.989 -167.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.6 p -91.63 -160.62 0.74 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.354 1.061 . . . . 0.0 110.155 175.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -95.33 -164.89 1.21 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.524 0.73 . . . . 0.0 110.851 178.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -69.05 -63.27 1.09 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.007 0.523 . . . . 0.0 110.923 177.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.5 t -148.46 21.44 1.05 Allowed 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 122.866 0.466 . . . . 0.0 111.639 -172.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.4 m -68.21 -16.15 63.86 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.068 0.547 . . . . 0.0 111.756 177.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.0 t80 58.43 31.86 21.44 Favored 'General case' 0 C--N 1.358 0.967 0 C-N-CA 125.152 1.381 . . . . 0.0 111.243 -176.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -78.22 0.81 23.69 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.622 175.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 50.3 t -90.98 134.55 34.39 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.234 1.013 . . . . 0.0 109.369 168.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.2 m -77.19 -65.6 0.93 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.006 0.522 . . . . 0.0 110.754 174.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.464 ' HB ' ' HE3' ' A' ' 4' ' ' LYS . 33.3 p -97.45 111.91 23.97 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.69 -0.687 . . . . 0.0 111.443 -170.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.73 -173.31 35.01 Favored Glycine 0 C--N 1.35 1.311 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.226 -177.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 57.2 m -113.02 163.84 14.2 Favored 'General case' 0 C--O 1.243 0.743 0 C-N-CA 123.328 0.651 . . . . 0.0 110.3 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 96.8 m -84.39 101.95 12.39 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.27 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -108.46 125.37 51.7 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 169.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.4 t30 56.98 37.68 28.93 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.181 0.992 . . . . 0.0 110.505 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.26 31.27 78.58 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 114.304 -1.316 . . . . 0.0 113.377 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.625 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 9.2 mtmp? -139.09 159.01 43.17 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.174 0.99 . . . . 0.0 109.52 177.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.439 ' SG ' ' HB3' ' A' ' 2' ' ' LYS . 86.0 m . . . . . 0 N--CA 1.477 0.878 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.5 p . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.49 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 73.8 mmtt -56.02 122.94 12.77 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.775 0.83 . . . . 0.0 111.871 -176.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -69.05 177.58 2.61 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.983 0.913 . . . . 0.0 111.692 -179.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -70.31 104.08 2.58 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 122.845 0.458 . . . . 0.0 109.998 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.77 10.43 58.93 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.986 -178.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 40.2 t -75.5 149.14 38.49 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 117.135 0.467 . . . . 0.0 110.248 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.1 p -76.89 100.39 5.53 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.363 0.665 . . . . 0.0 111.148 -169.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.0 p -108.46 178.13 4.58 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.556 0.743 . . . . 0.0 110.796 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -77.05 -158.46 0.11 Allowed 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.839 0.856 . . . . 0.0 111.826 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -62.93 -45.26 93.32 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.189 0.595 . . . . 0.0 111.436 177.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 t -158.39 76.53 0.76 Allowed 'General case' 0 CA--C 1.548 0.899 0 CA-C-O 122.376 1.084 . . . . 0.0 108.076 175.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 89.9 p -71.37 -41.0 70.25 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.222 -170.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 66.25 8.72 5.8 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.122 1.369 . . . . 0.0 112.213 -167.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -80.47 -18.09 49.71 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.569 0.748 . . . . 0.0 109.356 176.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 61.7 m -50.65 111.31 0.52 Allowed 'General case' 0 C--N 1.355 0.83 0 C-N-CA 124.539 1.136 . . . . 0.0 111.102 174.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.64 -39.01 61.33 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.966 1.306 . . . . 0.0 110.784 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.4 t -155.89 116.03 3.7 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 114.633 -1.167 . . . . 0.0 107.927 166.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.77 -173.74 22.2 Favored Glycine 0 C--N 1.352 1.445 0 N-CA-C 114.003 0.361 . . . . 0.0 114.003 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.4 m -134.49 150.03 50.76 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.061 0.944 . . . . 0.0 110.481 -178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 95.5 m -74.7 85.69 2.14 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.395 0.678 . . . . 0.0 112.021 -177.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -111.73 129.78 56.0 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 124.804 1.242 . . . . 0.0 108.68 174.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 60.0 t30 62.5 30.91 17.23 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 122.466 1.127 . . . . 0.0 110.351 -176.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.43 20.24 69.47 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-N 114.328 -1.306 . . . . 0.0 114.465 -178.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 9.7 mtmp? -138.42 158.96 43.27 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.716 0.806 . . . . 0.0 109.551 178.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 82.8 m . . . . . 0 N--CA 1.477 0.887 0 CA-C-O 121.62 0.724 . . . . 0.0 110.044 179.13 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.1 p . . . . . 0 N--CA 1.475 0.814 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 6' ' ' SER . 13.0 mptt -76.11 142.89 41.55 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.237 0.615 . . . . 0.0 111.656 -174.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -89.43 176.85 6.75 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.33 0.652 . . . . 0.0 110.552 177.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.97 118.65 10.07 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.422 0.689 . . . . 0.0 110.867 -174.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.89 -3.58 55.86 Favored Glycine 0 C--N 1.338 0.642 0 CA-C-N 115.545 -0.752 . . . . 0.0 113.41 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.473 ' HB3' ' HB3' ' A' ' 2' ' ' LYS . 34.9 t -82.44 176.19 9.61 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.008 0.523 . . . . 0.0 110.449 174.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.2 m -108.39 138.9 43.9 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.297 0.639 . . . . 0.0 111.411 -173.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.6 p -135.9 -156.38 0.71 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -110.43 -175.62 2.77 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 166.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -54.6 -47.56 73.24 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.337 0.655 . . . . 0.0 112.332 -170.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 p -141.56 66.12 1.36 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.832 0.853 . . . . 0.0 109.897 177.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.1 m -79.1 -29.24 43.17 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.907 171.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 60.9 16.3 6.78 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 125.009 1.324 . . . . 0.0 111.47 -174.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -92.63 -5.58 51.19 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 122.843 0.457 . . . . 0.0 111.218 -173.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 73.9 m -64.27 106.86 1.18 Allowed 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 169.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -51.69 -61.68 2.1 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.181 1.392 . . . . 0.0 111.753 -171.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.8 p -123.28 89.07 3.03 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 170.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.51 174.55 28.36 Favored Glycine 0 C--N 1.337 0.636 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.697 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.0 m -110.0 153.42 24.61 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.42 0.688 . . . . 0.0 109.39 176.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.0 m -74.63 79.25 2.0 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.43 0.633 . . . . 0.0 109.538 172.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -73.49 101.42 3.53 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.229 1.412 . . . . 0.0 108.716 -176.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.1 t30 55.76 36.04 26.49 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.59 1.156 . . . . 0.0 111.55 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.07 5.85 65.56 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 115.244 -0.889 . . . . 0.0 114.629 175.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HZ1' ' HB2' ' A' ' 24' ' ' LYS . 10.7 mtmp? -138.44 145.29 40.74 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 117.895 0.848 . . . . 0.0 110.111 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.9 m . . . . . 0 CA--C 1.547 0.83 0 C-N-CA 123.686 0.794 . . . . 0.0 111.512 -179.404 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.7 p . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.698 0.285 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.526 ' HD3' ' HB3' ' A' ' 14' ' ' ASP . 13.5 mptt -98.9 152.7 19.47 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.044 0.537 . . . . 0.0 109.894 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -97.13 152.64 18.59 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.358 177.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.423 ' HB2' HG23 ' A' ' 17' ' ' THR . 0.4 OUTLIER -63.82 126.64 28.29 Favored 'General case' 0 C--O 1.244 0.772 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 171.839 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.02 -22.48 33.25 Favored Glycine 0 C--N 1.337 0.637 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.903 -176.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 t -78.84 178.62 7.8 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.243 0.617 . . . . 0.0 109.454 173.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.495 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 22.0 p -97.26 136.1 38.23 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.956 0.502 . . . . 0.0 110.717 176.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.669 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 30.7 p -147.95 148.43 30.77 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.853 0.461 . . . . 0.0 110.126 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -73.75 146.15 44.57 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.504 0.722 . . . . 0.0 111.196 -173.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.601 ' HG2' HG21 ' A' ' 11' ' ' THR . 54.5 ttp180 -35.46 -61.25 0.46 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 126.91 2.084 . . . . 0.0 115.521 -166.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.601 HG21 ' HG2' ' A' ' 10' ' ' ARG . 19.4 p -133.73 28.68 3.9 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 120.892 0.377 . . . . 0.0 110.996 -175.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.7 m -86.61 4.05 41.91 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.394 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 60.15 23.32 12.61 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 124.857 1.263 . . . . 0.0 112.49 176.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.622 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 83.6 m-20 -61.35 -36.26 79.71 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -169.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.669 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 99.6 m -75.86 152.49 37.19 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.6 m -89.33 -23.63 22.2 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.248 165.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.423 HG23 ' HB2' ' A' ' 4' ' ' LYS . 11.5 t -156.4 147.05 21.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.891 0.876 . . . . 0.0 108.79 172.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.16 141.22 11.9 Favored Glycine 0 C--N 1.343 0.952 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -176.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.6 m -83.6 126.36 32.75 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 94.0 m -71.58 76.88 0.81 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 121.844 0.83 . . . . 0.0 110.749 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.2 ttt180 -117.19 133.4 56.03 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 124.56 1.144 . . . . 0.0 108.382 -174.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 64.9 t30 62.18 35.91 15.28 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 124.538 1.135 . . . . 0.0 110.152 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.15 13.11 64.13 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 114.455 -1.248 . . . . 0.0 114.196 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.495 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.5 mtmp? -136.86 160.41 38.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.683 0.793 . . . . 0.0 111.182 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -88.65 76.76 8.05 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.121 0.969 . . . . 0.0 110.055 -173.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 0.484 0 CA-C-N 115.525 -0.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.0 p . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.615 ' HG2' ' HB3' ' A' ' 8' ' ' CYS . 5.6 mptp? -65.21 119.34 10.7 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.528 0.731 . . . . 0.0 112.923 -173.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -78.78 159.68 27.77 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.726 0.81 . . . . 0.0 109.995 171.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -62.67 123.79 19.32 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.692 0.397 . . . . 0.0 110.699 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.89 -27.56 10.22 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.595 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.4 t -75.69 148.84 38.32 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.116 0.566 . . . . 0.0 110.241 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 62.3 p -77.94 134.94 37.79 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 120.897 0.379 . . . . 0.0 110.249 -176.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.615 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 14.8 p -145.69 165.25 29.3 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.786 0.834 . . . . 0.0 109.893 -179.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.75 153.18 44.27 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 173.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -50.49 -45.15 56.17 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.432 1.093 . . . . 0.0 112.665 -172.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -126.56 48.68 2.12 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.061 0.944 . . . . 0.0 109.271 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.0 p -55.16 -40.35 70.53 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.881 0.873 . . . . 0.0 112.229 -176.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.9 t80 65.55 9.78 6.13 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 125.221 1.409 . . . . 0.0 111.638 -174.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -93.16 -14.42 27.21 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.445 1.098 . . . . 0.0 109.592 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.0 t -62.88 108.55 1.22 Allowed 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.007 -178.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.4 t -50.83 -45.95 59.79 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 126.328 1.851 . . . . 0.0 113.255 -168.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.3 t -158.91 39.66 0.22 Allowed 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.074 0.94 . . . . 0.0 109.451 -174.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -150.77 174.51 30.06 Favored Glycine 0 C--N 1.339 0.699 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.48 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 36.9 m -112.74 133.93 54.52 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 174.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.9 m -72.3 84.16 1.06 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.744 0.783 . . . . 0.0 110.553 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.8 mtt180 -100.77 132.71 46.03 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.112 1.365 . . . . 0.0 109.327 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 61.7 25.21 15.15 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.207 1.003 . . . . 0.0 111.534 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.54 2.79 81.9 Favored Glycine 0 CA--C 1.538 1.521 0 CA-C-N 115.565 -0.743 . . . . 0.0 114.685 178.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -139.45 159.71 41.52 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-N 118.154 0.977 . . . . 0.0 109.761 174.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.581 ' SG ' ' HB3' ' A' ' 2' ' ' LYS . 49.5 m -60.32 143.61 52.54 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.178 0.591 . . . . 0.0 111.721 176.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 0.408 0 O-C-N 123.542 0.526 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.7 p . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 7' ' ' SER . 2.3 mptm? -69.51 137.27 52.38 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.248 0.619 . . . . 0.0 111.974 -174.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 71.7 mtp180 -90.12 177.66 6.38 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.742 0.817 . . . . 0.0 110.074 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.0 125.94 16.91 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.371 1.068 . . . . 0.0 111.222 179.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.27 -23.07 33.44 Favored Glycine 0 C--N 1.348 1.216 0 O-C-N 123.396 0.435 . . . . 0.0 113.626 178.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.1 t -85.41 165.72 16.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.157 0.583 . . . . 0.0 111.056 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.409 ' O ' ' HG2' ' A' ' 2' ' ' LYS . 37.3 p -79.34 104.86 10.25 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 123.944 0.898 . . . . 0.0 113.101 -166.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.6 p -119.39 153.31 35.39 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.45 0.7 . . . . 0.0 110.617 176.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.1 mmt-85 -74.66 -177.26 3.12 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 122.574 0.35 . . . . 0.0 110.439 -174.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -50.47 -66.88 0.31 Allowed 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.349 1.059 . . . . 0.0 113.077 -173.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.3 p -140.84 24.57 2.19 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.424 0.69 . . . . 0.0 110.481 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.3 p -64.64 -20.98 66.6 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.646 1.178 . . . . 0.0 113.853 -173.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER 65.86 26.05 11.16 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.849 1.26 . . . . 0.0 110.633 -169.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.27 -31.73 72.95 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 124.093 0.957 . . . . 0.0 109.666 169.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.556 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 5.4 t -67.62 125.75 27.19 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.967 171.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 t -69.06 -36.48 77.72 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.301 1.041 . . . . 0.0 111.3 -170.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 t -160.65 80.48 0.65 Allowed 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.506 0.722 . . . . 0.0 109.834 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 167.2 158.52 11.6 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.153 -0.931 . . . . 0.0 112.616 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.4 m -86.28 138.95 31.45 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.236 0.614 . . . . 0.0 109.737 175.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.556 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 83.8 m -93.94 132.74 38.09 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 123.238 0.615 . . . . 0.0 111.612 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.4 ttm-85 -141.94 137.48 31.3 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.373 1.069 . . . . 0.0 109.089 174.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.9 t30 58.89 39.43 23.84 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-O 122.582 1.182 . . . . 0.0 110.782 175.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.84 8.25 81.97 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 114.329 -1.305 . . . . 0.0 114.857 175.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 10.0 mtmp? -139.03 158.81 43.52 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 118.122 0.961 . . . . 0.0 111.433 -177.142 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 66.0 m -68.36 129.59 40.39 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.256 1.022 . . . . 0.0 110.702 174.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.284 0 O-C-N 123.606 0.566 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.9 p . . . . . 0 N--CA 1.485 1.313 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -119.5 157.64 27.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.048 0.539 . . . . 0.0 110.16 174.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -94.1 155.26 17.18 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.746 0.819 . . . . 0.0 109.656 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HB2' HG22 ' A' ' 17' ' ' THR . 0.2 OUTLIER -63.16 111.07 2.06 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 172.751 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 126.89 -27.42 4.88 Favored Glycine 0 C--N 1.342 0.909 0 O-C-N 123.455 0.472 . . . . 0.0 112.642 -176.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 t -74.11 -174.99 2.07 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.63 0.772 . . . . 0.0 111.763 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.463 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 49.2 m -101.93 133.14 47.19 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.099 0.559 . . . . 0.0 109.655 173.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.567 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.2 p -155.23 150.37 26.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.44 0.696 . . . . 0.0 110.294 -176.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -70.81 140.72 51.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.513 0.325 . . . . 0.0 110.859 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.661 ' HG2' HG23 ' A' ' 11' ' ' THR . 44.3 ttp180 -34.21 -53.23 0.49 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 127.155 2.182 . . . . 0.0 115.939 -169.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.661 HG23 ' HG2' ' A' ' 10' ' ' ARG . 24.6 p -137.74 28.12 2.69 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 120.926 0.393 . . . . 0.0 111.716 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.421 ' OG ' ' HB2' ' A' ' 14' ' ' ASP . 27.4 p -77.39 -6.45 53.42 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.624 0.602 . . . . 0.0 112.624 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 62.44 29.17 17.11 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.983 0.913 . . . . 0.0 110.217 -173.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.564 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 45.4 t0 -69.77 -29.67 67.06 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.634 1.174 . . . . 0.0 111.281 -172.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.567 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 71.7 m -84.78 152.74 23.45 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.516 0.726 . . . . 0.0 111.466 176.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 72.0 m -84.97 -28.36 25.86 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.862 165.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.406 HG22 ' HB2' ' A' ' 4' ' ' LYS . 10.0 t -151.96 152.52 32.6 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.165 0.586 . . . . 0.0 110.158 175.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.66 164.45 36.9 Favored Glycine 0 C--N 1.346 1.118 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.076 -174.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.5 m -107.58 122.55 46.9 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 122.745 0.418 . . . . 0.0 109.9 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.436 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 85.6 m -69.26 87.75 0.43 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.268 0.556 . . . . 0.0 110.532 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -120.01 136.85 54.4 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.965 0.906 . . . . 0.0 109.732 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 59.27 32.01 21.62 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.568 1.147 . . . . 0.0 111.582 -176.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.32 8.57 87.03 Favored Glycine 0 C--N 1.343 0.926 0 CA-C-N 115.064 -0.971 . . . . 0.0 114.707 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.3 mtmp? -136.07 147.0 47.66 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.56 0.695 . . . . 0.0 111.717 178.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.0 t -72.45 124.87 26.06 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.014 1.326 . . . . 0.0 110.737 177.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.237 0 CA-C-N 117.683 0.22 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.0 p . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -105.57 153.27 22.0 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.5 0.72 . . . . 0.0 110.606 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -70.99 166.97 20.18 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.481 0.713 . . . . 0.0 111.236 178.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -66.28 118.99 10.75 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 174.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.22 -0.52 63.99 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 123.026 0.346 . . . . 0.0 112.832 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.0 t -92.12 152.3 19.98 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.102 0.561 . . . . 0.0 110.097 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.8 m -79.25 120.87 24.34 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.864 0.466 . . . . 0.0 111.108 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.562 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 9.8 p -109.5 -92.39 0.44 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.745 0.818 . . . . 0.0 109.557 178.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 177.09 131.3 0.05 Allowed 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -43.72 -37.56 2.73 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 115.761 1.763 . . . . 0.0 115.761 -165.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.2 p -124.87 6.46 8.05 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.918 0.711 . . . . 0.0 112.918 -176.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.2 m -78.37 -24.09 46.57 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 119.346 -0.359 . . . . 0.0 111.921 174.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.6 t80 53.32 39.04 29.21 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.226 1.01 . . . . 0.0 111.079 -174.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -88.14 36.77 0.79 Allowed 'General case' 0 CA--C 1.554 1.119 0 CA-C-O 122.117 0.961 . . . . 0.0 111.184 -169.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.562 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 61.0 m -107.85 134.41 50.83 Favored 'General case' 0 C--N 1.348 0.507 0 C-N-CA 124.126 0.971 . . . . 0.0 109.127 177.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -37.44 83.12 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.533 0.733 . . . . 0.0 110.591 173.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.7 t -141.9 144.12 33.65 Favored 'General case' 0 C--O 1.243 0.741 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 167.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.54 162.34 30.26 Favored Glycine 0 C--N 1.338 0.689 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.989 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.3 m -94.95 145.43 24.93 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.076 0.95 . . . . 0.0 109.714 177.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 62.7 m -74.11 76.06 1.75 Allowed 'General case' 0 CA--C 1.549 0.92 0 CA-C-O 122.07 0.938 . . . . 0.0 110.957 175.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.1 mtp180 -84.26 112.86 20.68 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 124.627 1.171 . . . . 0.0 109.28 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.7 t30 58.99 40.54 22.22 Favored 'General case' 0 CA--C 1.557 1.23 0 CA-C-O 122.576 1.179 . . . . 0.0 109.894 178.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.83 -13.78 61.96 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 114.658 -1.155 . . . . 0.0 114.397 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.487 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 9.9 mtmp? -126.79 154.2 44.58 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 117.952 0.876 . . . . 0.0 111.25 -171.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.5 m -72.48 95.8 1.84 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.193 0.997 . . . . 0.0 111.098 -175.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.204 0 CA-C-N 116.517 -0.311 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 14' ' ' ASP . 14.6 p . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.669 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 47.5 mmtm -80.28 126.77 31.56 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 118.272 0.487 . . . . 0.0 110.304 -171.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 172.13 9.27 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 175.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -66.81 118.0 9.71 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.089 0.471 . . . . 0.0 110.329 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 107.62 -14.05 38.76 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 115.279 -0.873 . . . . 0.0 113.016 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.0 t -72.97 152.75 41.24 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.102 0.561 . . . . 0.0 111.106 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.555 ' HA ' ' HG2' ' A' ' 24' ' ' LYS . 31.8 m -80.18 140.41 36.34 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 122.953 0.501 . . . . 0.0 110.12 177.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.45 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 6.3 p -149.2 -177.19 5.69 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.705 0.802 . . . . 0.0 110.124 178.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.47 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 49.0 ttp85 -84.53 173.46 10.8 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 168.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' H ' ' HG2' ' A' ' 9' ' ' ARG . 57.8 ttp180 -49.82 -34.0 18.4 Favored 'General case' 0 N--CA 1.5 2.055 0 C-N-CA 123.999 0.919 . . . . 0.0 112.106 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.4 t -155.14 96.04 1.78 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-O 121.895 0.855 . . . . 0.0 108.866 163.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.6 p -82.66 -12.52 57.57 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.001 -0.999 . . . . 0.0 111.696 176.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 70.9 -22.78 0.18 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 126.038 1.735 . . . . 0.0 114.278 177.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' A' ' 1' ' ' CYS . 3.7 p-10 -86.83 2.77 47.88 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 118.339 0.518 . . . . 0.0 111.03 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.669 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 42.4 t -64.1 97.32 0.17 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.1 m -60.22 -34.94 74.36 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.078 0.951 . . . . 0.0 112.737 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.4 t -148.58 138.01 21.93 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 120.755 0.312 . . . . 0.0 110.415 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.3 164.42 40.25 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.605 -173.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 60.7 m -104.75 148.04 27.04 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.5 m -75.65 71.51 2.54 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.823 0.82 . . . . 0.0 112.373 -176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -84.06 124.92 31.6 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.965 1.306 . . . . 0.0 109.055 178.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 59.66 32.87 21.75 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.347 1.07 . . . . 0.0 109.335 -173.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.38 36.09 92.6 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 113.816 -1.538 . . . . 0.0 113.308 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.555 ' HG2' ' HA ' ' A' ' 7' ' ' SER . 36.2 mtmm -148.0 140.07 24.13 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.522 0.729 . . . . 0.0 110.19 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 84.6 m -66.06 132.98 49.8 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.094 0.558 . . . . 0.0 110.913 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.32 0 O-C-N 122.998 0.186 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 28.5 p . . . . . 0 N--CA 1.484 1.239 0 CA-C-O 120.693 0.282 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -96.68 129.01 44.16 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.787 0.835 . . . . 0.0 110.671 -176.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -82.98 178.68 8.04 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.077 1.351 . . . . 0.0 111.439 177.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -66.19 100.25 0.6 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.799 0.84 . . . . 0.0 110.353 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 113.09 -17.01 22.44 Favored Glycine 0 C--N 1.343 0.946 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.367 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 45.6 t -69.8 143.01 53.07 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.256 0.622 . . . . 0.0 110.558 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 21.4 p -78.01 117.04 18.94 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.016 0.526 . . . . 0.0 111.347 -173.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.5 p -115.56 -163.86 0.91 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.015 0.926 . . . . 0.0 109.576 177.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.03 -164.21 1.14 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.298 0.639 . . . . 0.0 109.908 172.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -62.02 -62.22 1.94 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.721 0.808 . . . . 0.0 112.329 -175.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.7 p -144.76 22.41 1.61 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.864 0.866 . . . . 0.0 109.824 -175.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.0 m -76.78 13.58 1.0 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -168.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 64.04 18.21 11.09 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.254 1.022 . . . . 0.0 112.893 171.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -60.26 -28.99 68.5 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.383 0.673 . . . . 0.0 111.483 -177.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.6 m -58.62 133.07 55.55 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.773 1.229 . . . . 0.0 113.025 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -72.72 -28.7 62.82 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.421 0.689 . . . . 0.0 109.855 164.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.0 t -155.19 145.56 21.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.745 0.818 . . . . 0.0 109.705 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 83.65 -168.99 46.44 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 116.264 -0.425 . . . . 0.0 112.552 -175.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.8 t -134.95 152.8 52.06 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.331 0.652 . . . . 0.0 109.816 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.2 m -72.49 114.96 11.18 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.386 0.675 . . . . 0.0 112.675 -173.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.0 mmt-85 -102.26 105.25 15.86 Favored 'General case' 0 C--O 1.245 0.823 0 C-N-CA 124.459 1.104 . . . . 0.0 109.864 170.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.1 t30 50.55 70.38 0.52 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.783 1.233 . . . . 0.0 112.006 171.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.36 7.78 34.55 Favored Glycine 0 CA--C 1.539 1.576 0 N-CA-C 114.69 0.636 . . . . 0.0 114.69 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.689 ' HZ1' ' HB2' ' A' ' 24' ' ' LYS . 8.5 mtmp? -131.94 161.0 34.14 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.494 1.118 . . . . 0.0 108.37 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 48.5 t -104.99 136.22 44.86 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -178.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.282 0 O-C-N 122.913 0.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 52.2 t . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.597 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 73.8 mmtt -127.2 141.83 51.64 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.492 0.717 . . . . 0.0 110.095 177.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -120.61 173.51 7.14 Favored 'General case' 0 C--O 1.245 0.836 0 C-N-CA 124.438 1.095 . . . . 0.0 108.755 173.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -64.04 113.52 3.55 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.187 0.595 . . . . 0.0 111.046 -178.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 121.65 -29.23 5.7 Favored Glycine 0 C--N 1.339 0.748 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.737 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.0 t -77.35 137.16 38.58 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.95 0.5 . . . . 0.0 111.002 -175.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.6 p -79.21 126.86 31.31 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.256 0.622 . . . . 0.0 111.387 -175.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.56 ' SG ' ' HB2' ' A' ' 25' ' ' CYS . 8.0 p -152.66 155.3 37.02 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.378 0.671 . . . . 0.0 110.848 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -70.34 144.42 51.67 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.1 ttp180 -43.23 -43.11 4.6 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 125.111 1.364 . . . . 0.0 114.145 -164.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.3 p -133.5 75.14 1.59 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.589 0.709 . . . . 0.0 109.741 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.4 m -88.12 -11.97 45.42 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.709 172.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.3 t80 61.06 19.28 9.79 Favored 'General case' 0 CA--C 1.559 1.296 0 C-N-CA 124.622 1.169 . . . . 0.0 112.244 -174.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -96.98 -15.7 20.97 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.569 -174.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 52.4 m -64.78 110.17 2.3 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.129 0.571 . . . . 0.0 111.278 176.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 79.4 m -74.97 -46.89 32.36 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.351 0.661 . . . . 0.0 110.034 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.2 p -130.6 101.14 5.57 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.842 0.857 . . . . 0.0 108.916 175.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 125.94 -166.27 18.77 Favored Glycine 0 C--N 1.348 1.235 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.869 -177.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 63.1 m -146.88 143.32 28.46 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.176 0.991 . . . . 0.0 108.956 174.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 61.7 m -73.13 99.4 2.8 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.292 0.637 . . . . 0.0 110.446 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -111.98 128.39 56.15 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.914 0.486 . . . . 0.0 110.288 177.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 58.98 26.21 14.76 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 125.652 1.581 . . . . 0.0 112.073 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 100.42 -0.9 55.77 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-N 115.007 -0.997 . . . . 0.0 115.021 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -138.49 144.38 40.0 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 118.901 1.351 . . . . 0.0 110.876 176.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.56 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 10.8 t -76.7 143.51 39.97 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.409 1.084 . . . . 0.0 110.898 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.199 0 CA-C-N 117.0 -0.091 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.4 p . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.423 ' HE3' ' N ' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -71.18 139.41 50.16 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 123.314 0.384 . . . . 0.0 111.131 -178.191 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -82.18 173.23 12.31 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.497 0.719 . . . . 0.0 110.394 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.543 ' HZ3' ' HB2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -67.0 124.57 23.4 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-O 120.836 0.351 . . . . 0.0 110.574 -178.365 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.42 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . 96.18 -17.35 59.44 Favored Glycine 0 C--N 1.352 1.451 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.653 -172.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.7 t -79.28 149.2 31.88 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.256 0.622 . . . . 0.0 111.125 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.7 m -79.03 101.1 7.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.51 0.724 . . . . 0.0 111.323 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.51 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 20.1 p -107.31 148.22 29.28 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.964 0.905 . . . . 0.0 110.31 177.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.432 ' HB3' ' OG ' ' A' ' 12' ' ' SER . 44.6 ttt180 -59.97 131.29 50.39 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 122.787 0.435 . . . . 0.0 110.086 -179.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -50.34 -40.85 50.26 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 115.668 1.729 . . . . 0.0 115.668 -153.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.3 p -135.46 14.22 3.47 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.432 ' OG ' ' HB3' ' A' ' 9' ' ' ARG . 81.0 p -83.55 -12.92 55.57 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.134 0.573 . . . . 0.0 110.842 175.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 61.93 40.02 12.91 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 124.793 1.237 . . . . 0.0 110.329 -176.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -70.64 -4.23 22.39 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 113.505 -1.679 . . . . 0.0 112.006 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.51 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 11.5 t -85.47 164.86 17.59 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.788 0.835 . . . . 0.0 110.9 176.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.78 -21.59 16.28 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.462 1.105 . . . . 0.0 110.015 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.0 t -153.92 143.82 21.9 Favored 'General case' 0 C--N 1.353 0.735 0 C-N-CA 123.609 0.764 . . . . 0.0 109.735 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.3 -162.53 49.68 Favored Glycine 0 C--N 1.337 0.628 0 CA-C-N 116.586 -0.279 . . . . 0.0 112.63 -177.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.0 t -119.74 158.29 26.82 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.816 0.846 . . . . 0.0 109.18 176.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 96.7 m -84.42 69.06 10.47 Favored 'General case' 0 CA--C 1.558 1.256 0 CA-C-O 121.678 0.751 . . . . 0.0 111.195 -177.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -68.07 115.39 7.51 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.237 1.415 . . . . 0.0 109.654 177.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 60.85 28.09 17.87 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 122.383 1.087 . . . . 0.0 110.218 -178.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.49 28.9 66.76 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 114.523 -1.217 . . . . 0.0 113.643 -176.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -141.15 158.8 43.42 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.809 0.844 . . . . 0.0 110.216 173.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.42 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 76.5 m -77.73 123.41 26.66 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.404 -175.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.288 0 O-C-N 123.284 0.365 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.9 p . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.703 0.287 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.634 ' HG3' ' HA ' ' A' ' 8' ' ' CYS . 74.7 mmtt -93.4 155.5 17.33 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-O 120.683 0.277 . . . . 0.0 110.271 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -107.25 170.67 7.82 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.029 0.532 . . . . 0.0 109.672 -177.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -63.41 128.64 36.77 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.109 0.564 . . . . 0.0 110.747 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.8 -9.32 77.62 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.327 -177.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.1 t -94.3 148.88 21.77 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.333 0.653 . . . . 0.0 110.043 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.9 p -79.35 108.07 12.59 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.322 0.649 . . . . 0.0 110.58 -176.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.634 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 2.9 p -89.39 -97.62 0.1 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.541 0.736 . . . . 0.0 109.869 178.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.6 ttt180 175.46 142.57 0.06 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.674 1.19 . . . . 0.0 108.073 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -29.13 -66.26 0.09 Allowed 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 127.043 2.137 . . . . 0.0 115.697 -162.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.7 p -129.55 18.32 5.79 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.767 0.827 . . . . 0.0 111.405 -174.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.9 m -71.84 -35.31 69.82 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.066 0.546 . . . . 0.0 112.446 -176.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.6 t80 55.7 32.82 20.12 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.8 1.24 . . . . 0.0 112.36 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -70.59 -14.71 62.6 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.723 168.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.6 t -66.71 130.19 42.34 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.673 0.789 . . . . 0.0 109.892 171.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.97 -37.66 85.61 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.543 0.527 . . . . 0.0 111.703 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.4 t -154.39 140.52 18.45 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 122.73 0.412 . . . . 0.0 110.158 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.67 140.26 10.88 Favored Glycine 0 C--N 1.343 0.966 0 C-N-CA 123.247 0.451 . . . . 0.0 112.2 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.2 m -80.12 127.32 32.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 122.98 0.512 . . . . 0.0 109.845 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.1 m -68.69 80.04 0.28 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.902 0.881 . . . . 0.0 112.694 -177.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -84.43 125.27 32.19 Favored 'General case' 0 C--O 1.243 0.752 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.5 t30 59.26 29.92 19.57 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.048 0.939 . . . . 0.0 110.184 -174.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.93 32.69 77.81 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.515 -175.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.581 ' HZ2' ' HB3' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -145.78 133.12 20.63 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -176.734 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.5 m -58.75 109.02 0.73 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.175 0.99 . . . . 0.0 111.969 -177.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.05 0 CA-C-N 116.306 -0.406 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 120.304 0.097 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -118.45 166.53 12.57 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 121.459 0.647 . . . . 0.0 111.308 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -120.97 169.44 10.47 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.911 174.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.39 139.23 43.88 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 122.68 0.392 . . . . 0.0 110.931 175.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.38 -0.3 89.15 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-N 116.211 -0.45 . . . . 0.0 113.78 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t -88.82 -173.43 4.1 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 117.568 0.684 . . . . 0.0 109.673 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.556 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 79.6 p -113.1 118.49 34.89 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.586 0.755 . . . . 0.0 109.034 174.4 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.9 p -124.88 174.88 7.65 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 122.741 0.416 . . . . 0.0 111.511 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.484 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 4.7 mpt_? -76.53 169.79 17.6 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.851 0.861 . . . . 0.0 110.01 176.11 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -55.73 -57.47 11.87 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.84 0.856 . . . . 0.0 113.14 -171.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -157.41 26.68 0.29 Allowed 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.248 0.547 . . . . 0.0 110.15 -178.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -78.0 10.05 3.18 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 124.235 1.014 . . . . 0.0 112.12 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 62.6 30.57 17.02 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.64 1.176 . . . . 0.0 111.011 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -67.79 -21.13 65.26 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.851 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 75.0 m -92.64 146.01 23.99 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 121.904 -0.498 . . . . 0.0 111.036 174.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.8 m -86.19 -50.8 6.71 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 166.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.4 p -127.32 112.11 14.67 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.232 1.013 . . . . 0.0 109.398 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.96 137.64 4.35 Favored Glycine 0 C--N 1.35 1.334 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -177.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.429 ' HB2' ' NH1' ' A' ' 21' ' ' ARG . 25.4 m -89.56 131.5 35.55 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 117.374 0.587 . . . . 0.0 109.511 177.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.1 m -79.31 115.08 18.74 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -173.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.429 ' NH1' ' HB2' ' A' ' 19' ' ' SER . 7.9 mpt_? -103.36 -168.44 1.51 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.223 1.009 . . . . 0.0 109.549 172.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -52.15 99.08 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.743 1.217 . . . . 0.0 112.481 -177.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.35 0.62 47.25 Favored Glycine 0 C--N 1.356 1.661 0 CA-C-N 115.161 -0.927 . . . . 0.0 114.581 175.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.62 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 9.9 mtmp? -136.94 155.73 49.37 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-N 117.463 0.632 . . . . 0.0 111.816 -168.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.1 t -91.98 86.89 5.99 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 170.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.175 0 CA-C-N 115.913 -0.585 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.478 0.973 0 CA-C-O 120.704 0.288 . . . . 0.0 110.62 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.461 ' HD3' ' HB3' ' A' ' 14' ' ' ASP . 4.4 mptp? -83.89 129.07 34.94 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.245 0.618 . . . . 0.0 110.384 -177.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.94 177.85 7.81 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.21 0.604 . . . . 0.0 109.506 177.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -59.21 115.77 3.43 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.155 0.582 . . . . 0.0 111.1 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.33 -20.98 36.34 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-O 119.838 -0.423 . . . . 0.0 113.268 -178.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.1 t -76.5 153.18 35.74 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.924 0.49 . . . . 0.0 110.886 178.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 30.5 p -79.13 103.45 9.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.533 0.733 . . . . 0.0 111.678 -174.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.476 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 30.1 p -114.9 131.56 56.83 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.656 0.782 . . . . 0.0 109.857 177.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.654 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 96.5 mtt180 -58.21 139.75 54.38 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.048 0.539 . . . . 0.0 111.784 -174.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.2 ttp-105 -39.43 -46.76 1.71 Allowed 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 126.634 1.974 . . . . 0.0 115.126 -162.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -139.03 7.35 2.44 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.812 0.445 . . . . 0.0 111.377 -176.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.654 ' HB3' ' HB2' ' A' ' 9' ' ' ARG . 47.4 t -80.77 -0.65 39.54 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.49 0.716 . . . . 0.0 111.502 179.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.0 t80 59.83 34.37 21.82 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.886 1.274 . . . . 0.0 112.727 170.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.461 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 7.2 m-20 -68.09 -17.1 64.28 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.309 0.644 . . . . 0.0 112.192 176.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.454 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 4.8 t -72.65 150.69 42.79 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 123.351 0.66 . . . . 0.0 110.269 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.6 m -64.88 -42.78 94.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.769 0.828 . . . . 0.0 109.719 176.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.5 t -172.01 148.98 2.33 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.89 1.276 . . . . 0.0 108.716 167.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 125.11 -171.92 17.14 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-N 116.432 -0.349 . . . . 0.0 112.639 -178.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.6 m -101.97 114.63 28.91 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.659 0.783 . . . . 0.0 110.257 -175.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 94.9 m -76.19 74.67 3.02 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.233 0.613 . . . . 0.0 110.53 175.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -89.27 128.33 35.85 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.2 t30 55.29 31.17 16.08 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.508 1.123 . . . . 0.0 110.316 -175.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.13 40.61 92.77 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 114.375 -1.284 . . . . 0.0 113.871 -176.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -151.37 141.17 21.88 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 117.288 0.544 . . . . 0.0 109.661 179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.476 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 88.8 m -67.2 104.23 1.41 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.238 1.015 . . . . 0.0 111.696 179.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.133 0 CA-C-N 115.447 -0.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.3 p . . . . . 0 N--CA 1.475 0.796 0 CA-C-O 121.49 0.662 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.457 ' HG3' ' HB3' ' A' ' 8' ' ' CYS . 43.7 mmtm -91.85 154.09 19.12 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.457 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -107.01 177.96 4.7 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -67.8 106.89 2.41 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 125.72 -19.26 6.62 Favored Glycine 0 C--N 1.337 0.585 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.13 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.2 t -91.71 152.09 20.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.676 0.79 . . . . 0.0 110.755 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 72.4 p -77.36 136.64 38.46 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.389 0.676 . . . . 0.0 110.052 -178.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 25' ' ' CYS . 7.5 p -154.48 163.17 40.6 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.932 0.493 . . . . 0.0 112.013 -171.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -64.0 136.26 57.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.824 0.85 . . . . 0.0 109.985 173.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.48 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 30.4 ttp-105 -52.06 -58.34 6.84 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 124.762 1.289 . . . . 0.0 113.378 -166.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.4 p -132.46 18.32 4.37 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.567 -0.708 . . . . 0.0 111.827 -178.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.4 t -87.76 11.33 15.66 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.998 0.519 . . . . 0.0 111.419 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 59.01 35.67 24.11 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.24 1.016 . . . . 0.0 112.129 176.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -72.62 -30.86 64.69 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.319 177.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.2 t -80.86 139.74 35.78 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 166.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.64 -48.69 76.23 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.517 0.727 . . . . 0.0 112.471 -172.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.0 t -146.62 31.0 0.98 Allowed 'General case' 0 N--CA 1.486 1.333 0 CA-C-O 122.15 0.976 . . . . 0.0 112.017 -171.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.429 ' HA3' ' SG ' ' A' ' 25' ' ' CYS . . . -140.6 150.7 21.85 Favored Glycine 0 N--CA 1.469 0.867 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.656 -179.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.0 m -82.37 124.37 29.95 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.185 0.594 . . . . 0.0 110.963 -179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 98.6 m -90.25 119.44 30.56 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.658 0.783 . . . . 0.0 110.767 -178.12 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -141.59 155.18 45.76 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 173.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 60.39 22.81 12.37 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.733 0.813 . . . . 0.0 110.574 -170.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.24 32.22 83.11 Favored Glycine 0 C--N 1.342 0.869 0 CA-C-N 115.163 -0.926 . . . . 0.0 114.122 -172.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 1.0 OUTLIER -154.48 139.71 17.55 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 117.655 0.727 . . . . 0.0 110.667 -179.0 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.468 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 43.7 t -70.24 100.78 1.75 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.222 1.009 . . . . 0.0 109.742 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.098 0 CA-C-N 116.368 -0.378 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.449 ' HG3' ' HA ' ' A' ' 8' ' ' CYS . 75.3 mmtt -130.31 130.61 44.71 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.135 0.974 . . . . 0.0 109.801 -175.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -72.99 172.03 11.74 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.115 0.566 . . . . 0.0 111.498 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -62.01 106.11 0.67 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.779 0.832 . . . . 0.0 111.151 -177.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 116.39 -10.35 17.0 Favored Glycine 0 C--N 1.356 1.639 0 C-N-CA 123.132 0.396 . . . . 0.0 113.484 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.4 t -92.8 150.86 20.35 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 117.492 0.646 . . . . 0.0 110.49 177.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.607 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 38.5 p -78.85 112.4 15.97 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.962 0.505 . . . . 0.0 111.362 -175.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.449 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 27.9 p -100.85 152.36 20.61 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.091 0.556 . . . . 0.0 111.418 -178.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -59.03 131.97 52.63 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.689 0.796 . . . . 0.0 110.461 175.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -45.79 -45.61 14.86 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 125.219 1.574 . . . . 0.0 114.46 -161.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.4 p -137.23 12.94 3.05 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.873 0.469 . . . . 0.0 111.674 -175.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.7 t -93.94 21.9 6.22 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -168.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.8 t80 52.3 40.84 29.96 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 124.515 1.126 . . . . 0.0 111.759 -179.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -91.71 7.59 40.97 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.05 -175.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.5 m -89.48 122.89 33.1 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.177 0.591 . . . . 0.0 111.27 174.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 83.5 m -69.3 -38.03 78.08 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.812 0.845 . . . . 0.0 109.539 166.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.2 t -158.46 134.42 9.09 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.943 0.897 . . . . 0.0 109.094 176.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.71 -170.83 20.46 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 112.348 -0.301 . . . . 0.0 112.348 -177.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 37.7 m -116.59 146.3 42.76 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.555 0.742 . . . . 0.0 110.248 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.3 m -75.28 82.21 2.41 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 122.139 0.971 . . . . 0.0 111.004 174.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 -92.33 111.39 22.95 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.517 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.7 t30 61.12 30.15 19.25 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 124.666 1.186 . . . . 0.0 110.791 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.4 29.01 68.73 Favored Glycine 0 C--N 1.342 0.909 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.937 -175.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.607 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.4 mtmp? -135.31 136.85 41.9 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.554 0.741 . . . . 0.0 109.685 175.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.3 t -82.49 113.12 20.01 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.093 0.557 . . . . 0.0 110.475 -173.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.183 0 CA-C-N 116.027 -0.533 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 120.926 0.393 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -109.17 165.68 11.42 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.539 0.735 . . . . 0.0 109.447 169.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -109.03 -177.88 3.43 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.395 0.678 . . . . 0.0 110.781 177.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -63.5 122.25 15.81 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.82 0.848 . . . . 0.0 110.515 -177.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.4 -9.07 72.03 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 116.076 -0.511 . . . . 0.0 113.105 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.5 t -90.42 152.35 21.01 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 117.328 0.564 . . . . 0.0 110.202 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.1 m -78.71 126.31 30.55 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.378 0.671 . . . . 0.0 111.171 -172.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 23.9 p -146.45 147.29 31.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.658 0.783 . . . . 0.0 109.364 -176.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.437 ' HB2' ' OG ' ' A' ' 12' ' ' SER . 28.4 mmt180 -60.11 138.47 57.88 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 122.839 0.456 . . . . 0.0 111.402 -173.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -44.53 -44.96 9.07 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 125.694 1.598 . . . . 0.0 115.289 -159.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.6 t -129.0 1.13 5.28 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 122.0 -0.438 . . . . 0.0 112.047 -175.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 9' ' ' ARG . 99.0 p -66.75 -19.22 65.7 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -174.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 63.48 39.29 9.23 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 124.655 1.182 . . . . 0.0 109.992 -172.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 22.0 t0 -68.54 -22.23 64.51 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.155 176.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 25' ' ' CYS . 48.9 t -80.15 145.01 32.56 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.344 0.657 . . . . 0.0 109.549 166.251 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.76 -42.96 99.65 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.205 0.602 . . . . 0.0 111.996 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.5 t -148.25 137.26 21.85 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.191 0.596 . . . . 0.0 110.251 175.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.9 151.96 14.94 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.951 -176.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.4 t -82.97 131.09 35.2 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.445 0.698 . . . . 0.0 110.428 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.2 m -75.23 79.71 2.34 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-O 121.764 0.793 . . . . 0.0 110.984 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -85.71 130.7 34.49 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.776 0.831 . . . . 0.0 109.373 -175.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 61.0 28.99 18.75 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.992 0.917 . . . . 0.0 111.028 -175.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.26 36.1 91.27 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 114.782 -1.099 . . . . 0.0 112.853 -174.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.448 ' HE3' ' HB3' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -155.29 131.77 10.43 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.237 0.615 . . . . 0.0 109.669 -177.735 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.435 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 46.2 t -58.92 96.65 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.506 1.123 . . . . 0.0 112.888 -174.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.047 0 CA-C-N 115.571 -0.741 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.6 p . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.392 0.139 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.77 146.42 35.86 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 176.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -87.14 162.34 17.58 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.87 0.468 . . . . 0.0 111.089 -170.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -70.39 117.0 11.38 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 102.03 -18.6 51.74 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.517 -173.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.3 t -83.49 162.97 20.75 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.332 0.653 . . . . 0.0 110.382 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.465 ' HA ' ' HG2' ' A' ' 24' ' ' LYS . 58.2 p -78.65 131.78 36.81 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.19 0.596 . . . . 0.0 110.742 -177.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.75 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 23.4 p -150.84 170.39 19.39 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.108 0.563 . . . . 0.0 111.435 -176.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -76.06 -156.19 0.06 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.215 0.606 . . . . 0.0 111.011 -178.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -74.59 -73.63 0.23 Allowed 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 122.465 0.306 . . . . 0.0 111.716 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.5 p -146.26 18.61 1.38 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.975 0.51 . . . . 0.0 112.337 -167.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.6 m -87.88 48.26 1.62 Allowed 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.907 -0.496 . . . . 0.0 111.948 -174.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.3 t80 53.03 38.08 26.38 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.176 1.39 . . . . 0.0 111.772 -178.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.75 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 13.5 m-20 -71.03 -60.14 2.39 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.483 -1.235 . . . . 0.0 112.149 -174.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.8 t -69.4 135.7 50.64 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.6 t -67.58 -37.56 82.8 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.798 0.839 . . . . 0.0 111.2 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.1 t -153.07 83.24 1.2 Allowed 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 122.209 1.004 . . . . 0.0 108.575 173.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 161.13 -173.5 37.58 Favored Glycine 0 C--N 1.341 0.825 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.386 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.4 m -109.51 144.14 38.2 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.374 0.67 . . . . 0.0 110.002 176.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 25' ' ' CYS . 52.0 m -87.47 98.86 11.62 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.735 0.814 . . . . 0.0 110.556 177.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -87.56 107.06 18.41 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.395 1.078 . . . . 0.0 109.437 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.8 t30 46.79 69.65 0.47 Allowed 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 125.051 1.34 . . . . 0.0 112.659 173.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.71 -7.41 58.65 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.616 -1.102 . . . . 0.0 115.221 173.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.476 ' HB2' ' HZ3' ' A' ' 24' ' ' LYS . 10.4 mtmp? -145.12 147.9 33.03 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 118.781 1.29 . . . . 0.0 110.195 176.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 20' ' ' CYS . 41.6 t -71.06 108.91 4.83 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 122.114 -0.366 . . . . 0.0 110.329 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 0.473 0 CA-C-N 115.959 -0.564 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 C--O 1.243 0.748 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -74.32 146.58 42.99 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.482 0.713 . . . . 0.0 111.665 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -87.49 165.7 15.33 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.562 0.745 . . . . 0.0 109.196 171.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 25' ' ' CYS . 86.9 tttt -63.67 126.78 28.66 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 123.494 0.496 . . . . 0.0 110.6 -176.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 112.19 -40.95 2.36 Favored Glycine 0 C--N 1.342 0.903 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.684 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.9 t -70.42 146.75 50.16 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 122.942 0.497 . . . . 0.0 110.693 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.513 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 34.7 p -76.3 101.92 5.67 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.443 0.64 . . . . 0.0 110.433 -175.338 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.516 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 19.1 p -93.53 178.9 5.55 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.814 174.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -73.1 178.96 4.05 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.009 0.524 . . . . 0.0 111.072 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 70.8 mmt-85 -69.28 -67.49 0.47 Allowed 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.908 0.483 . . . . 0.0 111.097 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 71.8 p -131.58 13.11 4.95 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.95 0.5 . . . . 0.0 111.331 -175.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.6 t -82.01 10.52 6.41 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.068 0.547 . . . . 0.0 112.417 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 58.6 34.84 24.16 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.486 1.114 . . . . 0.0 111.644 176.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.516 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 28.2 t70 -74.45 -8.34 55.98 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.224 -177.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 m -64.36 147.31 52.86 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.567 0.747 . . . . 0.0 111.455 166.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 t -90.57 -47.47 7.67 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.2 t -155.04 80.6 1.07 Allowed 'General case' 0 CA--C 1.556 1.186 0 CA-C-O 122.483 1.135 . . . . 0.0 108.465 172.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -174.61 -165.22 30.72 Favored Glycine 0 C--N 1.342 0.895 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.951 -175.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.3 m -126.08 104.9 8.51 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 122.98 0.512 . . . . 0.0 110.479 -177.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.0 m -59.61 115.44 3.32 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 121.122 0.487 . . . . 0.0 110.483 172.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -169.19 137.25 1.91 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.803 1.241 . . . . 0.0 108.414 -167.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 60.97 26.17 16.14 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.359 1.064 . . . . 0.0 111.75 178.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.96 4.13 90.54 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 114.966 -1.016 . . . . 0.0 114.799 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.571 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 10.2 mtmp? -133.67 161.63 34.13 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.421 0.688 . . . . 0.0 110.416 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 4' ' ' LYS . 34.5 t -81.24 82.31 7.16 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.294 0 CA-C-N 116.322 -0.399 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.336 0.112 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.439 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.4 OUTLIER -97.3 155.88 16.68 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.464 0.706 . . . . 0.0 110.746 179.095 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -117.63 -178.68 3.53 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.46 1.104 . . . . 0.0 109.461 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.464 ' HE3' ' HB ' ' A' ' 17' ' ' THR . 34.3 mmtp -54.01 114.96 1.78 Allowed 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.06 0.944 . . . . 0.0 112.954 -172.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.21 -23.44 24.28 Favored Glycine 0 C--N 1.349 1.304 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.233 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.4 t -65.24 137.59 57.68 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 123.156 0.582 . . . . 0.0 109.942 178.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 24.3 m -78.94 104.85 9.87 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.989 -167.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.6 p -91.63 -160.62 0.74 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.354 1.061 . . . . 0.0 110.155 175.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -95.33 -164.89 1.21 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.524 0.73 . . . . 0.0 110.851 178.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -69.05 -63.27 1.09 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.007 0.523 . . . . 0.0 110.923 177.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.5 t -148.46 21.44 1.05 Allowed 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 122.866 0.466 . . . . 0.0 111.639 -172.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.4 m -68.21 -16.15 63.86 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.068 0.547 . . . . 0.0 111.756 177.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.0 t80 58.43 31.86 21.44 Favored 'General case' 0 C--N 1.358 0.967 0 C-N-CA 125.152 1.381 . . . . 0.0 111.243 -176.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -78.22 0.81 23.69 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.622 175.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 50.3 t -90.98 134.55 34.39 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.234 1.013 . . . . 0.0 109.369 168.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.2 m -77.19 -65.6 0.93 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.006 0.522 . . . . 0.0 110.754 174.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.464 ' HB ' ' HE3' ' A' ' 4' ' ' LYS . 33.3 p -97.45 111.91 23.97 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.69 -0.687 . . . . 0.0 111.443 -170.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.73 -173.31 35.01 Favored Glycine 0 C--N 1.35 1.311 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.226 -177.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 57.2 m -113.02 163.84 14.2 Favored 'General case' 0 C--O 1.243 0.743 0 C-N-CA 123.328 0.651 . . . . 0.0 110.3 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 96.8 m -84.39 101.95 12.39 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.27 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -108.46 125.37 51.7 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 169.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.4 t30 56.98 37.68 28.93 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.181 0.992 . . . . 0.0 110.505 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.26 31.27 78.58 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 114.304 -1.316 . . . . 0.0 113.377 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.625 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 9.2 mtmp? -139.09 159.01 43.17 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.174 0.99 . . . . 0.0 109.52 177.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.439 ' SG ' ' HB3' ' A' ' 2' ' ' LYS . 86.0 m -75.27 81.18 2.38 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.313 0 CA-C-N 115.3 -0.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.5 p . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.49 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 73.8 mmtt -56.02 122.94 12.77 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.775 0.83 . . . . 0.0 111.871 -176.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -69.05 177.58 2.61 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.983 0.913 . . . . 0.0 111.692 -179.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -70.31 104.08 2.58 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 122.845 0.458 . . . . 0.0 109.998 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.77 10.43 58.93 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.986 -178.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 40.2 t -75.5 149.14 38.49 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 117.135 0.467 . . . . 0.0 110.248 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.1 p -76.89 100.39 5.53 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.363 0.665 . . . . 0.0 111.148 -169.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.0 p -108.46 178.13 4.58 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.556 0.743 . . . . 0.0 110.796 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -77.05 -158.46 0.11 Allowed 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.839 0.856 . . . . 0.0 111.826 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -62.93 -45.26 93.32 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.189 0.595 . . . . 0.0 111.436 177.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 t -158.39 76.53 0.76 Allowed 'General case' 0 CA--C 1.548 0.899 0 CA-C-O 122.376 1.084 . . . . 0.0 108.076 175.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 89.9 p -71.37 -41.0 70.25 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.222 -170.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 66.25 8.72 5.8 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.122 1.369 . . . . 0.0 112.213 -167.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -80.47 -18.09 49.71 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.569 0.748 . . . . 0.0 109.356 176.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 61.7 m -50.65 111.31 0.52 Allowed 'General case' 0 C--N 1.355 0.83 0 C-N-CA 124.539 1.136 . . . . 0.0 111.102 174.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.64 -39.01 61.33 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.966 1.306 . . . . 0.0 110.784 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.4 t -155.89 116.03 3.7 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 114.633 -1.167 . . . . 0.0 107.927 166.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.77 -173.74 22.2 Favored Glycine 0 C--N 1.352 1.445 0 N-CA-C 114.003 0.361 . . . . 0.0 114.003 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.4 m -134.49 150.03 50.76 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.061 0.944 . . . . 0.0 110.481 -178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 95.5 m -74.7 85.69 2.14 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.395 0.678 . . . . 0.0 112.021 -177.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -111.73 129.78 56.0 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 124.804 1.242 . . . . 0.0 108.68 174.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 60.0 t30 62.5 30.91 17.23 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 122.466 1.127 . . . . 0.0 110.351 -176.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.43 20.24 69.47 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-N 114.328 -1.306 . . . . 0.0 114.465 -178.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 9.7 mtmp? -138.42 158.96 43.27 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.716 0.806 . . . . 0.0 109.551 178.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 82.8 m -77.65 71.04 4.11 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 121.62 0.724 . . . . 0.0 110.044 179.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.51 0 CA-C-N 115.404 -0.816 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.1 p . . . . . 0 N--CA 1.475 0.814 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 6' ' ' SER . 13.0 mptt -76.11 142.89 41.55 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.237 0.615 . . . . 0.0 111.656 -174.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -89.43 176.85 6.75 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.33 0.652 . . . . 0.0 110.552 177.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.97 118.65 10.07 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.422 0.689 . . . . 0.0 110.867 -174.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.89 -3.58 55.86 Favored Glycine 0 C--N 1.338 0.642 0 CA-C-N 115.545 -0.752 . . . . 0.0 113.41 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.473 ' HB3' ' HB3' ' A' ' 2' ' ' LYS . 34.9 t -82.44 176.19 9.61 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.008 0.523 . . . . 0.0 110.449 174.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.2 m -108.39 138.9 43.9 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.297 0.639 . . . . 0.0 111.411 -173.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.6 p -135.9 -156.38 0.71 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -110.43 -175.62 2.77 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 166.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -54.6 -47.56 73.24 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.337 0.655 . . . . 0.0 112.332 -170.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 p -141.56 66.12 1.36 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.832 0.853 . . . . 0.0 109.897 177.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.1 m -79.1 -29.24 43.17 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.907 171.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 60.9 16.3 6.78 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 125.009 1.324 . . . . 0.0 111.47 -174.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -92.63 -5.58 51.19 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 122.843 0.457 . . . . 0.0 111.218 -173.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 73.9 m -64.27 106.86 1.18 Allowed 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 169.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -51.69 -61.68 2.1 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.181 1.392 . . . . 0.0 111.753 -171.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.8 p -123.28 89.07 3.03 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 170.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.51 174.55 28.36 Favored Glycine 0 C--N 1.337 0.636 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.697 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.0 m -110.0 153.42 24.61 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.42 0.688 . . . . 0.0 109.39 176.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.0 m -74.63 79.25 2.0 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.43 0.633 . . . . 0.0 109.538 172.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -73.49 101.42 3.53 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.229 1.412 . . . . 0.0 108.716 -176.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.1 t30 55.76 36.04 26.49 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.59 1.156 . . . . 0.0 111.55 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.07 5.85 65.56 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 115.244 -0.889 . . . . 0.0 114.629 175.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HZ1' ' HB2' ' A' ' 24' ' ' LYS . 10.7 mtmp? -138.44 145.29 40.74 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 117.895 0.848 . . . . 0.0 110.111 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.9 m -59.3 108.94 0.77 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.686 0.794 . . . . 0.0 111.512 -179.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.234 0 CA-C-N 116.048 -0.524 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.7 p . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.698 0.285 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.522 ' HD3' ' HB3' ' A' ' 14' ' ' ASP . 13.5 mptt -98.9 152.7 19.47 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.044 0.537 . . . . 0.0 109.894 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -97.13 152.64 18.59 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.358 177.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HB2' HG23 ' A' ' 17' ' ' THR . 0.4 OUTLIER -63.82 126.64 28.29 Favored 'General case' 0 C--O 1.244 0.772 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 171.839 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.02 -22.48 33.25 Favored Glycine 0 C--N 1.337 0.637 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.903 -176.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 t -78.84 178.62 7.8 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.243 0.617 . . . . 0.0 109.454 173.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 22.0 p -97.26 136.1 38.23 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.956 0.502 . . . . 0.0 110.717 176.222 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.669 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 30.7 p -147.95 148.43 30.77 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.853 0.461 . . . . 0.0 110.126 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -73.75 146.15 44.57 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.504 0.722 . . . . 0.0 111.196 -173.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.616 ' HG2' HG23 ' A' ' 11' ' ' THR . 54.5 ttp180 -35.46 -61.25 0.46 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 126.91 2.084 . . . . 0.0 115.521 -166.393 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.616 HG23 ' HG2' ' A' ' 10' ' ' ARG . 19.4 p -133.73 28.68 3.9 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 120.892 0.377 . . . . 0.0 110.996 -175.221 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.7 m -86.61 4.05 41.91 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.394 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 60.15 23.32 12.61 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 124.857 1.263 . . . . 0.0 112.49 176.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.639 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 83.6 m-20 -61.35 -36.26 79.71 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -169.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.669 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 99.6 m -75.86 152.49 37.19 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.6 m -89.33 -23.63 22.2 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.248 165.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.435 HG23 ' HB2' ' A' ' 4' ' ' LYS . 11.5 t -156.4 147.05 21.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.891 0.876 . . . . 0.0 108.79 172.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.16 141.22 11.9 Favored Glycine 0 C--N 1.343 0.952 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -176.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.6 m -83.6 126.36 32.75 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 94.0 m -71.58 76.88 0.81 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 121.844 0.83 . . . . 0.0 110.749 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.2 ttt180 -117.19 133.4 56.03 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 124.56 1.144 . . . . 0.0 108.382 -174.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 64.9 t30 62.18 35.91 15.28 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 124.538 1.135 . . . . 0.0 110.152 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.15 13.11 64.13 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 114.455 -1.248 . . . . 0.0 114.196 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.5 mtmp? -136.86 160.41 38.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.683 0.793 . . . . 0.0 111.182 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t . . . . . 0 CA--C 1.547 0.857 0 C-N-CA 124.121 0.969 . . . . 0.0 110.055 -173.971 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.0 p . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.627 ' HG2' ' HB3' ' A' ' 8' ' ' CYS . 5.6 mptp? -65.21 119.34 10.7 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.528 0.731 . . . . 0.0 112.923 -173.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -78.78 159.68 27.77 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.726 0.81 . . . . 0.0 109.995 171.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -62.67 123.79 19.32 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.692 0.397 . . . . 0.0 110.699 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.89 -27.56 10.22 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.595 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.4 t -75.69 148.84 38.32 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.116 0.566 . . . . 0.0 110.241 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 62.3 p -77.94 134.94 37.79 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 120.897 0.379 . . . . 0.0 110.249 -176.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.627 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 14.8 p -145.69 165.25 29.3 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.786 0.834 . . . . 0.0 109.893 -179.076 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.75 153.18 44.27 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 173.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -50.49 -45.15 56.17 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.432 1.093 . . . . 0.0 112.665 -172.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -126.56 48.68 2.12 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.061 0.944 . . . . 0.0 109.271 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.0 p -55.16 -40.35 70.53 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.881 0.873 . . . . 0.0 112.229 -176.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.9 t80 65.55 9.78 6.13 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 125.221 1.409 . . . . 0.0 111.638 -174.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -93.16 -14.42 27.21 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.445 1.098 . . . . 0.0 109.592 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.0 t -62.88 108.55 1.22 Allowed 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.007 -178.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.4 t -50.83 -45.95 59.79 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 126.328 1.851 . . . . 0.0 113.255 -168.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.3 t -158.91 39.66 0.22 Allowed 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.074 0.94 . . . . 0.0 109.451 -174.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -150.77 174.51 30.06 Favored Glycine 0 C--N 1.339 0.699 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.48 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 36.9 m -112.74 133.93 54.52 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 174.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.9 m -72.3 84.16 1.06 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.744 0.783 . . . . 0.0 110.553 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.8 mtt180 -100.77 132.71 46.03 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.112 1.365 . . . . 0.0 109.327 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 61.7 25.21 15.15 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.207 1.003 . . . . 0.0 111.534 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.54 2.79 81.9 Favored Glycine 0 CA--C 1.538 1.521 0 CA-C-N 115.565 -0.743 . . . . 0.0 114.685 178.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -139.45 159.71 41.52 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-N 118.154 0.977 . . . . 0.0 109.761 174.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.584 ' SG ' ' HB3' ' A' ' 2' ' ' LYS . 49.5 m . . . . . 0 N--CA 1.478 0.956 0 C-N-CA 123.178 0.591 . . . . 0.0 111.721 176.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.7 p . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' A' ' 7' ' ' SER . 2.3 mptm? -69.51 137.27 52.38 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.248 0.619 . . . . 0.0 111.974 -174.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 71.7 mtp180 -90.12 177.66 6.38 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.742 0.817 . . . . 0.0 110.074 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.0 125.94 16.91 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.371 1.068 . . . . 0.0 111.222 179.087 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.27 -23.07 33.44 Favored Glycine 0 C--N 1.348 1.216 0 O-C-N 123.396 0.435 . . . . 0.0 113.626 178.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.1 t -85.41 165.72 16.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.157 0.583 . . . . 0.0 111.056 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 2' ' ' LYS . 37.3 p -79.34 104.86 10.25 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 123.944 0.898 . . . . 0.0 113.101 -166.504 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.6 p -119.39 153.31 35.39 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.45 0.7 . . . . 0.0 110.617 176.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.1 mmt-85 -74.66 -177.26 3.12 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 122.574 0.35 . . . . 0.0 110.439 -174.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -50.47 -66.88 0.31 Allowed 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.349 1.059 . . . . 0.0 113.077 -173.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.3 p -140.84 24.57 2.19 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.424 0.69 . . . . 0.0 110.481 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.3 p -64.64 -20.98 66.6 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.646 1.178 . . . . 0.0 113.853 -173.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER 65.86 26.05 11.16 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.849 1.26 . . . . 0.0 110.633 -169.093 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.27 -31.73 72.95 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 124.093 0.957 . . . . 0.0 109.666 169.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.564 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 5.4 t -67.62 125.75 27.19 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.967 171.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 t -69.06 -36.48 77.72 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.301 1.041 . . . . 0.0 111.3 -170.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 t -160.65 80.48 0.65 Allowed 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.506 0.722 . . . . 0.0 109.834 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 167.2 158.52 11.6 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.153 -0.931 . . . . 0.0 112.616 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.4 m -86.28 138.95 31.45 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.236 0.614 . . . . 0.0 109.737 175.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.564 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 83.8 m -93.94 132.74 38.09 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 123.238 0.615 . . . . 0.0 111.612 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.4 ttm-85 -141.94 137.48 31.3 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.373 1.069 . . . . 0.0 109.089 174.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.9 t30 58.89 39.43 23.84 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-O 122.582 1.182 . . . . 0.0 110.782 175.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.84 8.25 81.97 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 114.329 -1.305 . . . . 0.0 114.857 175.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -139.03 158.81 43.52 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 118.122 0.961 . . . . 0.0 111.433 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 66.0 m . . . . . 0 N--CA 1.474 0.774 0 C-N-CA 124.256 1.022 . . . . 0.0 110.702 174.142 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.9 p . . . . . 0 N--CA 1.485 1.313 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -119.5 157.64 27.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.048 0.539 . . . . 0.0 110.16 174.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -94.1 155.26 17.18 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.746 0.819 . . . . 0.0 109.656 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.421 ' HB2' HG23 ' A' ' 17' ' ' THR . 0.2 OUTLIER -63.16 111.07 2.06 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 172.751 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 126.89 -27.42 4.88 Favored Glycine 0 C--N 1.342 0.909 0 O-C-N 123.455 0.472 . . . . 0.0 112.642 -176.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 t -74.11 -174.99 2.07 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.63 0.772 . . . . 0.0 111.763 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.46 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 49.2 m -101.93 133.14 47.19 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.099 0.559 . . . . 0.0 109.655 173.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.57 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 27.2 p -155.23 150.37 26.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.44 0.696 . . . . 0.0 110.294 -176.311 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -70.81 140.72 51.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.513 0.325 . . . . 0.0 110.859 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.676 ' HG2' HG23 ' A' ' 11' ' ' THR . 44.3 ttp180 -34.21 -53.23 0.49 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 127.155 2.182 . . . . 0.0 115.939 -169.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.676 HG23 ' HG2' ' A' ' 10' ' ' ARG . 24.6 p -137.74 28.12 2.69 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 120.926 0.393 . . . . 0.0 111.716 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.442 ' OG ' ' HB2' ' A' ' 14' ' ' ASP . 27.4 p -77.39 -6.45 53.42 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.624 0.602 . . . . 0.0 112.624 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 62.44 29.17 17.11 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.983 0.913 . . . . 0.0 110.217 -173.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.57 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 45.4 t0 -69.77 -29.67 67.06 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.634 1.174 . . . . 0.0 111.281 -172.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.567 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 71.7 m -84.78 152.74 23.45 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.516 0.726 . . . . 0.0 111.466 176.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 72.0 m -84.97 -28.36 25.86 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.862 165.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.421 HG23 ' HB2' ' A' ' 4' ' ' LYS . 10.0 t -151.96 152.52 32.6 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.165 0.586 . . . . 0.0 110.158 175.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.66 164.45 36.9 Favored Glycine 0 C--N 1.346 1.118 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.076 -174.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.5 m -107.58 122.55 46.9 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 122.745 0.418 . . . . 0.0 109.9 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.436 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 85.6 m -69.26 87.75 0.43 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.268 0.556 . . . . 0.0 110.532 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -120.01 136.85 54.4 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.965 0.906 . . . . 0.0 109.732 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 59.27 32.01 21.62 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.568 1.147 . . . . 0.0 111.582 -176.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.32 8.57 87.03 Favored Glycine 0 C--N 1.343 0.926 0 CA-C-N 115.064 -0.971 . . . . 0.0 114.707 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.3 mtmp? -136.07 147.0 47.66 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.56 0.695 . . . . 0.0 111.717 178.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.0 t . . . . . 0 CA--C 1.547 0.85 0 C-N-CA 125.014 1.326 . . . . 0.0 110.737 177.707 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.0 p . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -105.57 153.27 22.0 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.5 0.72 . . . . 0.0 110.606 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -70.99 166.97 20.18 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.481 0.713 . . . . 0.0 111.236 178.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -66.28 118.99 10.75 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 174.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.22 -0.52 63.99 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 123.026 0.346 . . . . 0.0 112.832 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.0 t -92.12 152.3 19.98 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.102 0.561 . . . . 0.0 110.097 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.8 m -79.25 120.87 24.34 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.864 0.466 . . . . 0.0 111.108 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.562 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 9.8 p -109.5 -92.39 0.44 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.745 0.818 . . . . 0.0 109.557 178.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 177.09 131.3 0.05 Allowed 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -43.72 -37.56 2.73 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 115.761 1.763 . . . . 0.0 115.761 -165.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.2 p -124.87 6.46 8.05 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.918 0.711 . . . . 0.0 112.918 -176.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.2 m -78.37 -24.09 46.57 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 119.346 -0.359 . . . . 0.0 111.921 174.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.6 t80 53.32 39.04 29.21 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.226 1.01 . . . . 0.0 111.079 -174.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -88.14 36.77 0.79 Allowed 'General case' 0 CA--C 1.554 1.119 0 CA-C-O 122.117 0.961 . . . . 0.0 111.184 -169.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.562 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 61.0 m -107.85 134.41 50.83 Favored 'General case' 0 C--N 1.348 0.507 0 C-N-CA 124.126 0.971 . . . . 0.0 109.127 177.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -37.44 83.12 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.533 0.733 . . . . 0.0 110.591 173.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.7 t -141.9 144.12 33.65 Favored 'General case' 0 C--O 1.243 0.741 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 167.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.54 162.34 30.26 Favored Glycine 0 C--N 1.338 0.689 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.989 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.3 m -94.95 145.43 24.93 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.076 0.95 . . . . 0.0 109.714 177.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 62.7 m -74.11 76.06 1.75 Allowed 'General case' 0 CA--C 1.549 0.92 0 CA-C-O 122.07 0.938 . . . . 0.0 110.957 175.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.1 mtp180 -84.26 112.86 20.68 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 124.627 1.171 . . . . 0.0 109.28 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.7 t30 58.99 40.54 22.22 Favored 'General case' 0 CA--C 1.557 1.23 0 CA-C-O 122.576 1.179 . . . . 0.0 109.894 178.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.83 -13.78 61.96 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 114.658 -1.155 . . . . 0.0 114.397 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -126.79 154.2 44.58 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 117.952 0.876 . . . . 0.0 111.25 -171.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.5 m . . . . . 0 CA--C 1.547 0.863 0 C-N-CA 124.193 0.997 . . . . 0.0 111.098 -175.446 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 14' ' ' ASP . 14.6 p . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.675 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 47.5 mmtm -80.28 126.77 31.56 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 118.272 0.487 . . . . 0.0 110.304 -171.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 172.13 9.27 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 175.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -66.81 118.0 9.71 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.089 0.471 . . . . 0.0 110.329 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 107.62 -14.05 38.76 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 115.279 -0.873 . . . . 0.0 113.016 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.0 t -72.97 152.75 41.24 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.102 0.561 . . . . 0.0 111.106 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.557 ' HA ' ' HG2' ' A' ' 24' ' ' LYS . 31.8 m -80.18 140.41 36.34 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 122.953 0.501 . . . . 0.0 110.12 177.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.462 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 6.3 p -149.2 -177.19 5.69 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.705 0.802 . . . . 0.0 110.124 178.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.499 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 49.0 ttp85 -84.53 173.46 10.8 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 168.233 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.499 ' H ' ' HG2' ' A' ' 9' ' ' ARG . 57.8 ttp180 -49.82 -34.0 18.4 Favored 'General case' 0 N--CA 1.5 2.055 0 C-N-CA 123.999 0.919 . . . . 0.0 112.106 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.4 t -155.14 96.04 1.78 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-O 121.895 0.855 . . . . 0.0 108.866 163.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.6 p -82.66 -12.52 57.57 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.001 -0.999 . . . . 0.0 111.696 176.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 70.9 -22.78 0.18 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 126.038 1.735 . . . . 0.0 114.278 177.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 1' ' ' CYS . 3.7 p-10 -86.83 2.77 47.88 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 118.339 0.518 . . . . 0.0 111.03 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.675 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 42.4 t -64.1 97.32 0.17 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.1 m -60.22 -34.94 74.36 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.078 0.951 . . . . 0.0 112.737 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.4 t -148.58 138.01 21.93 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 120.755 0.312 . . . . 0.0 110.415 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.3 164.42 40.25 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.605 -173.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 60.7 m -104.75 148.04 27.04 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.5 m -75.65 71.51 2.54 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.823 0.82 . . . . 0.0 112.373 -176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -84.06 124.92 31.6 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.965 1.306 . . . . 0.0 109.055 178.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 59.66 32.87 21.75 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.347 1.07 . . . . 0.0 109.335 -173.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.38 36.09 92.6 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 113.816 -1.538 . . . . 0.0 113.308 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.557 ' HG2' ' HA ' ' A' ' 7' ' ' SER . 36.2 mtmm -148.0 140.07 24.13 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.522 0.729 . . . . 0.0 110.19 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 84.6 m . . . . . 0 CA--C 1.546 0.794 0 C-N-CA 123.094 0.558 . . . . 0.0 110.913 -178.377 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 28.5 p . . . . . 0 N--CA 1.484 1.239 0 CA-C-O 120.693 0.282 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.404 ' HG2' ' HB3' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -96.68 129.01 44.16 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.787 0.835 . . . . 0.0 110.671 -176.307 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -82.98 178.68 8.04 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.077 1.351 . . . . 0.0 111.439 177.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -66.19 100.25 0.6 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.799 0.84 . . . . 0.0 110.353 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 113.09 -17.01 22.44 Favored Glycine 0 C--N 1.343 0.946 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.367 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 45.6 t -69.8 143.01 53.07 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.256 0.622 . . . . 0.0 110.558 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.494 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 21.4 p -78.01 117.04 18.94 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.016 0.526 . . . . 0.0 111.347 -173.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.404 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 25.5 p -115.56 -163.86 0.91 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.015 0.926 . . . . 0.0 109.576 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.03 -164.21 1.14 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.298 0.639 . . . . 0.0 109.908 172.046 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -62.02 -62.22 1.94 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.721 0.808 . . . . 0.0 112.329 -175.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.7 p -144.76 22.41 1.61 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.864 0.866 . . . . 0.0 109.824 -175.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.0 m -76.78 13.58 1.0 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -168.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 64.04 18.21 11.09 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.254 1.022 . . . . 0.0 112.893 171.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -60.26 -28.99 68.5 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.383 0.673 . . . . 0.0 111.483 -177.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.6 m -58.62 133.07 55.55 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.773 1.229 . . . . 0.0 113.025 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -72.72 -28.7 62.82 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.421 0.689 . . . . 0.0 109.855 164.282 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.0 t -155.19 145.56 21.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.745 0.818 . . . . 0.0 109.705 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 83.65 -168.99 46.44 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 116.264 -0.425 . . . . 0.0 112.552 -175.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.427 ' HB3' HH12 ' A' ' 21' ' ' ARG . 25.8 t -134.95 152.8 52.06 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.331 0.652 . . . . 0.0 109.816 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.2 m -72.49 114.96 11.18 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.386 0.675 . . . . 0.0 112.675 -173.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.427 HH12 ' HB3' ' A' ' 19' ' ' SER . 63.0 mmt-85 -102.26 105.25 15.86 Favored 'General case' 0 C--O 1.245 0.823 0 C-N-CA 124.459 1.104 . . . . 0.0 109.864 170.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.1 t30 50.55 70.38 0.52 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.783 1.233 . . . . 0.0 112.006 171.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.36 7.78 34.55 Favored Glycine 0 CA--C 1.539 1.576 0 N-CA-C 114.69 0.636 . . . . 0.0 114.69 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 8.5 mtmp? -131.94 161.0 34.14 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.494 1.118 . . . . 0.0 108.37 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 48.5 t . . . . . 0 N--CA 1.476 0.825 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -178.128 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 52.2 t . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.599 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 73.8 mmtt -127.2 141.83 51.64 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.492 0.717 . . . . 0.0 110.095 177.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -120.61 173.51 7.14 Favored 'General case' 0 C--O 1.245 0.836 0 C-N-CA 124.438 1.095 . . . . 0.0 108.755 173.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -64.04 113.52 3.55 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.187 0.595 . . . . 0.0 111.046 -178.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 121.65 -29.23 5.7 Favored Glycine 0 C--N 1.339 0.748 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.737 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.0 t -77.35 137.16 38.58 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.95 0.5 . . . . 0.0 111.002 -175.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.6 p -79.21 126.86 31.31 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.256 0.622 . . . . 0.0 111.387 -175.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 25' ' ' CYS . 8.0 p -152.66 155.3 37.02 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.378 0.671 . . . . 0.0 110.848 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -70.34 144.42 51.67 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.1 ttp180 -43.23 -43.11 4.6 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 125.111 1.364 . . . . 0.0 114.145 -164.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.3 p -133.5 75.14 1.59 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.589 0.709 . . . . 0.0 109.741 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.4 m -88.12 -11.97 45.42 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.709 172.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.3 t80 61.06 19.28 9.79 Favored 'General case' 0 CA--C 1.559 1.296 0 C-N-CA 124.622 1.169 . . . . 0.0 112.244 -174.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -96.98 -15.7 20.97 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.569 -174.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 52.4 m -64.78 110.17 2.3 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.129 0.571 . . . . 0.0 111.278 176.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 79.4 m -74.97 -46.89 32.36 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.351 0.661 . . . . 0.0 110.034 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.2 p -130.6 101.14 5.57 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.842 0.857 . . . . 0.0 108.916 175.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 125.94 -166.27 18.77 Favored Glycine 0 C--N 1.348 1.235 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.869 -177.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 63.1 m -146.88 143.32 28.46 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.176 0.991 . . . . 0.0 108.956 174.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 61.7 m -73.13 99.4 2.8 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.292 0.637 . . . . 0.0 110.446 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -111.98 128.39 56.15 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.914 0.486 . . . . 0.0 110.288 177.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 58.98 26.21 14.76 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 125.652 1.581 . . . . 0.0 112.073 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 100.42 -0.9 55.77 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-N 115.007 -0.997 . . . . 0.0 115.021 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -138.49 144.38 40.0 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 118.901 1.351 . . . . 0.0 110.876 176.059 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 10.8 t . . . . . 0 N--CA 1.475 0.82 0 C-N-CA 124.409 1.084 . . . . 0.0 110.898 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.4 p . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.426 ' HE3' ' N ' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -71.18 139.41 50.16 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 123.314 0.384 . . . . 0.0 111.131 -178.191 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -82.18 173.23 12.31 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.497 0.719 . . . . 0.0 110.394 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.439 ' NZ ' ' HB2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -67.0 124.57 23.4 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-O 120.836 0.351 . . . . 0.0 110.574 -178.365 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.481 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . 96.18 -17.35 59.44 Favored Glycine 0 C--N 1.352 1.451 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.653 -172.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.7 t -79.28 149.2 31.88 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.256 0.622 . . . . 0.0 111.125 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.7 m -79.03 101.1 7.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.51 0.724 . . . . 0.0 111.323 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 20.1 p -107.31 148.22 29.28 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.964 0.905 . . . . 0.0 110.31 177.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.433 ' HB3' ' OG ' ' A' ' 12' ' ' SER . 44.6 ttt180 -59.97 131.29 50.39 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 122.787 0.435 . . . . 0.0 110.086 -179.02 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.405 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 73.9 ttt180 -50.34 -40.85 50.26 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 115.668 1.729 . . . . 0.0 115.668 -153.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.3 p -135.46 14.22 3.47 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.433 ' OG ' ' HB3' ' A' ' 9' ' ' ARG . 81.0 p -83.55 -12.92 55.57 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.134 0.573 . . . . 0.0 110.842 175.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 61.93 40.02 12.91 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 124.793 1.237 . . . . 0.0 110.329 -176.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -70.64 -4.23 22.39 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 113.505 -1.679 . . . . 0.0 112.006 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.509 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 11.5 t -85.47 164.86 17.59 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.788 0.835 . . . . 0.0 110.9 176.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.78 -21.59 16.28 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.462 1.105 . . . . 0.0 110.015 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.0 t -153.92 143.82 21.9 Favored 'General case' 0 C--N 1.353 0.735 0 C-N-CA 123.609 0.764 . . . . 0.0 109.735 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.3 -162.53 49.68 Favored Glycine 0 C--N 1.337 0.628 0 CA-C-N 116.586 -0.279 . . . . 0.0 112.63 -177.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.0 t -119.74 158.29 26.82 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.816 0.846 . . . . 0.0 109.18 176.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 96.7 m -84.42 69.06 10.47 Favored 'General case' 0 CA--C 1.558 1.256 0 CA-C-O 121.678 0.751 . . . . 0.0 111.195 -177.35 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -68.07 115.39 7.51 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.237 1.415 . . . . 0.0 109.654 177.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 60.85 28.09 17.87 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 122.383 1.087 . . . . 0.0 110.218 -178.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.49 28.9 66.76 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 114.523 -1.217 . . . . 0.0 113.643 -176.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -141.15 158.8 43.42 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.809 0.844 . . . . 0.0 110.216 173.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.481 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 76.5 m . . . . . 0 CA--C 1.542 0.668 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.404 -175.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.9 p . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.703 0.287 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.638 ' HG3' ' HA ' ' A' ' 8' ' ' CYS . 74.7 mmtt -93.4 155.5 17.33 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-O 120.683 0.277 . . . . 0.0 110.271 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -107.25 170.67 7.82 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.029 0.532 . . . . 0.0 109.672 -177.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -63.41 128.64 36.77 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.109 0.564 . . . . 0.0 110.747 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.8 -9.32 77.62 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.327 -177.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.1 t -94.3 148.88 21.77 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.333 0.653 . . . . 0.0 110.043 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.9 p -79.35 108.07 12.59 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.322 0.649 . . . . 0.0 110.58 -176.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.638 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 2.9 p -89.39 -97.62 0.1 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.541 0.736 . . . . 0.0 109.869 178.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.6 ttt180 175.46 142.57 0.06 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.674 1.19 . . . . 0.0 108.073 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -29.13 -66.26 0.09 Allowed 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 127.043 2.137 . . . . 0.0 115.697 -162.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.7 p -129.55 18.32 5.79 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.767 0.827 . . . . 0.0 111.405 -174.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.9 m -71.84 -35.31 69.82 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.066 0.546 . . . . 0.0 112.446 -176.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.6 t80 55.7 32.82 20.12 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.8 1.24 . . . . 0.0 112.36 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -70.59 -14.71 62.6 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.723 168.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.6 t -66.71 130.19 42.34 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.673 0.789 . . . . 0.0 109.892 171.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.97 -37.66 85.61 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.543 0.527 . . . . 0.0 111.703 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.4 t -154.39 140.52 18.45 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 122.73 0.412 . . . . 0.0 110.158 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.67 140.26 10.88 Favored Glycine 0 C--N 1.343 0.966 0 C-N-CA 123.247 0.451 . . . . 0.0 112.2 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.2 m -80.12 127.32 32.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 122.98 0.512 . . . . 0.0 109.845 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.1 m -68.69 80.04 0.28 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.902 0.881 . . . . 0.0 112.694 -177.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -84.43 125.27 32.19 Favored 'General case' 0 C--O 1.243 0.752 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.5 t30 59.26 29.92 19.57 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.048 0.939 . . . . 0.0 110.184 -174.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.93 32.69 77.81 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.515 -175.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.45 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -145.78 133.12 20.63 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -176.734 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 CA--C 1.549 0.91 0 C-N-CA 124.175 0.99 . . . . 0.0 111.969 -177.148 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 120.304 0.097 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.408 ' H ' ' HA ' ' A' ' 15' ' ' CYS . 45.9 mmtm -118.45 166.53 12.57 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 121.459 0.647 . . . . 0.0 111.308 -178.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -120.97 169.44 10.47 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.911 174.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.39 139.23 43.88 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 122.68 0.392 . . . . 0.0 110.931 175.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.38 -0.3 89.15 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-N 116.211 -0.45 . . . . 0.0 113.78 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t -88.82 -173.43 4.1 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 117.568 0.684 . . . . 0.0 109.673 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 79.6 p -113.1 118.49 34.89 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.586 0.755 . . . . 0.0 109.034 174.4 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.9 p -124.88 174.88 7.65 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 122.741 0.416 . . . . 0.0 111.511 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.494 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 4.7 mpt_? -76.53 169.79 17.6 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.851 0.861 . . . . 0.0 110.01 176.11 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -55.73 -57.47 11.87 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.84 0.856 . . . . 0.0 113.14 -171.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -157.41 26.68 0.29 Allowed 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.248 0.547 . . . . 0.0 110.15 -178.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -78.0 10.05 3.18 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 124.235 1.014 . . . . 0.0 112.12 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 62.6 30.57 17.02 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.64 1.176 . . . . 0.0 111.011 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -67.79 -21.13 65.26 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.851 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 75.0 m -92.64 146.01 23.99 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 121.904 -0.498 . . . . 0.0 111.036 174.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.8 m -86.19 -50.8 6.71 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 166.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.4 p -127.32 112.11 14.67 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.232 1.013 . . . . 0.0 109.398 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.96 137.64 4.35 Favored Glycine 0 C--N 1.35 1.334 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -177.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.437 ' HB2' ' NH1' ' A' ' 21' ' ' ARG . 25.4 m -89.56 131.5 35.55 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 117.374 0.587 . . . . 0.0 109.511 177.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.1 m -79.31 115.08 18.74 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -173.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.437 ' NH1' ' HB2' ' A' ' 19' ' ' SER . 7.9 mpt_? -103.36 -168.44 1.51 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.223 1.009 . . . . 0.0 109.549 172.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -52.15 99.08 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.743 1.217 . . . . 0.0 112.481 -177.167 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.35 0.62 47.25 Favored Glycine 0 C--N 1.356 1.661 0 CA-C-N 115.161 -0.927 . . . . 0.0 114.581 175.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.9 mtmp? -136.94 155.73 49.37 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-N 117.463 0.632 . . . . 0.0 111.816 -168.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.1 t . . . . . 0 N--CA 1.467 0.396 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 170.762 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.478 0.973 0 CA-C-O 120.704 0.288 . . . . 0.0 110.62 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.471 ' HD3' ' HB3' ' A' ' 14' ' ' ASP . 4.4 mptp? -83.89 129.07 34.94 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.245 0.618 . . . . 0.0 110.384 -177.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.94 177.85 7.81 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.21 0.604 . . . . 0.0 109.506 177.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -59.21 115.77 3.43 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.155 0.582 . . . . 0.0 111.1 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.33 -20.98 36.34 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-O 119.838 -0.423 . . . . 0.0 113.268 -178.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.1 t -76.5 153.18 35.74 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.924 0.49 . . . . 0.0 110.886 178.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 30.5 p -79.13 103.45 9.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.533 0.733 . . . . 0.0 111.678 -174.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.476 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 30.1 p -114.9 131.56 56.83 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.656 0.782 . . . . 0.0 109.857 177.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.671 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 96.5 mtt180 -58.21 139.75 54.38 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.048 0.539 . . . . 0.0 111.784 -174.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.2 ttp-105 -39.43 -46.76 1.71 Allowed 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 126.634 1.974 . . . . 0.0 115.126 -162.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -139.03 7.35 2.44 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.812 0.445 . . . . 0.0 111.377 -176.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.671 ' HB3' ' HB2' ' A' ' 9' ' ' ARG . 47.4 t -80.77 -0.65 39.54 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.49 0.716 . . . . 0.0 111.502 179.139 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.0 t80 59.83 34.37 21.82 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.886 1.274 . . . . 0.0 112.727 170.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.471 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 7.2 m-20 -68.09 -17.1 64.28 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.309 0.644 . . . . 0.0 112.192 176.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.467 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 4.8 t -72.65 150.69 42.79 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 123.351 0.66 . . . . 0.0 110.269 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.6 m -64.88 -42.78 94.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.769 0.828 . . . . 0.0 109.719 176.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.5 t -172.01 148.98 2.33 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.89 1.276 . . . . 0.0 108.716 167.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 125.11 -171.92 17.14 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-N 116.432 -0.349 . . . . 0.0 112.639 -178.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.6 m -101.97 114.63 28.91 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.659 0.783 . . . . 0.0 110.257 -175.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 94.9 m -76.19 74.67 3.02 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.233 0.613 . . . . 0.0 110.53 175.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -89.27 128.33 35.85 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.2 t30 55.29 31.17 16.08 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.508 1.123 . . . . 0.0 110.316 -175.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.13 40.61 92.77 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 114.375 -1.284 . . . . 0.0 113.871 -176.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -151.37 141.17 21.88 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 117.288 0.544 . . . . 0.0 109.661 179.722 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.476 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 88.8 m . . . . . 0 N--CA 1.483 1.218 0 C-N-CA 124.238 1.015 . . . . 0.0 111.696 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.3 p . . . . . 0 N--CA 1.475 0.796 0 CA-C-O 121.49 0.662 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.477 ' HG3' ' HB3' ' A' ' 8' ' ' CYS . 43.7 mmtm -91.85 154.09 19.12 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.457 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -107.01 177.96 4.7 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -67.8 106.89 2.41 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 125.72 -19.26 6.62 Favored Glycine 0 C--N 1.337 0.585 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.13 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.2 t -91.71 152.09 20.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.676 0.79 . . . . 0.0 110.755 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.43 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 72.4 p -77.36 136.64 38.46 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.389 0.676 . . . . 0.0 110.052 -178.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.487 ' SG ' ' HB2' ' A' ' 25' ' ' CYS . 7.5 p -154.48 163.17 40.6 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.932 0.493 . . . . 0.0 112.013 -171.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -64.0 136.26 57.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.824 0.85 . . . . 0.0 109.985 173.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.495 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 30.4 ttp-105 -52.06 -58.34 6.84 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 124.762 1.289 . . . . 0.0 113.378 -166.104 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.4 p -132.46 18.32 4.37 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.567 -0.708 . . . . 0.0 111.827 -178.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.4 t -87.76 11.33 15.66 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.998 0.519 . . . . 0.0 111.419 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 59.01 35.67 24.11 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.24 1.016 . . . . 0.0 112.129 176.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -72.62 -30.86 64.69 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.319 177.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.2 t -80.86 139.74 35.78 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 166.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.64 -48.69 76.23 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.517 0.727 . . . . 0.0 112.471 -172.399 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.0 t -146.62 31.0 0.98 Allowed 'General case' 0 N--CA 1.486 1.333 0 CA-C-O 122.15 0.976 . . . . 0.0 112.017 -171.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.416 ' HA3' ' SG ' ' A' ' 25' ' ' CYS . . . -140.6 150.7 21.85 Favored Glycine 0 N--CA 1.469 0.867 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.656 -179.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.0 m -82.37 124.37 29.95 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.185 0.594 . . . . 0.0 110.963 -179.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 98.6 m -90.25 119.44 30.56 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.658 0.783 . . . . 0.0 110.767 -178.12 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -141.59 155.18 45.76 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 173.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 60.39 22.81 12.37 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.733 0.813 . . . . 0.0 110.574 -170.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.24 32.22 83.11 Favored Glycine 0 C--N 1.342 0.869 0 CA-C-N 115.163 -0.926 . . . . 0.0 114.122 -172.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 1.0 OUTLIER -154.48 139.71 17.55 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 117.655 0.727 . . . . 0.0 110.667 -179.0 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.487 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 43.7 t . . . . . 0 N--CA 1.472 0.664 0 C-N-CA 124.222 1.009 . . . . 0.0 109.742 -179.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.446 ' HG3' ' HA ' ' A' ' 8' ' ' CYS . 75.3 mmtt -130.31 130.61 44.71 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.135 0.974 . . . . 0.0 109.801 -175.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -72.99 172.03 11.74 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.115 0.566 . . . . 0.0 111.498 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -62.01 106.11 0.67 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.779 0.832 . . . . 0.0 111.151 -177.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 116.39 -10.35 17.0 Favored Glycine 0 C--N 1.356 1.639 0 C-N-CA 123.132 0.396 . . . . 0.0 113.484 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.4 t -92.8 150.86 20.35 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 117.492 0.646 . . . . 0.0 110.49 177.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.63 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 38.5 p -78.85 112.4 15.97 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.962 0.505 . . . . 0.0 111.362 -175.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.446 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 27.9 p -100.85 152.36 20.61 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.091 0.556 . . . . 0.0 111.418 -178.3 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -59.03 131.97 52.63 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.689 0.796 . . . . 0.0 110.461 175.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -45.79 -45.61 14.86 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 125.219 1.574 . . . . 0.0 114.46 -161.667 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.4 p -137.23 12.94 3.05 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.873 0.469 . . . . 0.0 111.674 -175.456 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.7 t -93.94 21.9 6.22 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -168.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.8 t80 52.3 40.84 29.96 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 124.515 1.126 . . . . 0.0 111.759 -179.075 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -91.71 7.59 40.97 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.05 -175.162 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.5 m -89.48 122.89 33.1 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.177 0.591 . . . . 0.0 111.27 174.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 83.5 m -69.3 -38.03 78.08 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.812 0.845 . . . . 0.0 109.539 166.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.2 t -158.46 134.42 9.09 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.943 0.897 . . . . 0.0 109.094 176.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.71 -170.83 20.46 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 112.348 -0.301 . . . . 0.0 112.348 -177.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 37.7 m -116.59 146.3 42.76 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.555 0.742 . . . . 0.0 110.248 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.3 m -75.28 82.21 2.41 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 122.139 0.971 . . . . 0.0 111.004 174.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 -92.33 111.39 22.95 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.517 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.7 t30 61.12 30.15 19.25 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 124.666 1.186 . . . . 0.0 110.791 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.4 29.01 68.73 Favored Glycine 0 C--N 1.342 0.909 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.937 -175.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.63 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.4 mtmp? -135.31 136.85 41.9 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.554 0.741 . . . . 0.0 109.685 175.546 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.3 t . . . . . 0 N--CA 1.473 0.694 0 C-N-CA 123.093 0.557 . . . . 0.0 110.475 -173.865 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 120.926 0.393 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -109.17 165.68 11.42 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.539 0.735 . . . . 0.0 109.447 169.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -109.03 -177.88 3.43 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.395 0.678 . . . . 0.0 110.781 177.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -63.5 122.25 15.81 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.82 0.848 . . . . 0.0 110.515 -177.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.4 -9.07 72.03 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 116.076 -0.511 . . . . 0.0 113.105 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.5 t -90.42 152.35 21.01 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 117.328 0.564 . . . . 0.0 110.202 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.1 m -78.71 126.31 30.55 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.378 0.671 . . . . 0.0 111.171 -172.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.603 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 23.9 p -146.45 147.29 31.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.658 0.783 . . . . 0.0 109.364 -176.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.446 ' HB2' ' OG ' ' A' ' 12' ' ' SER . 28.4 mmt180 -60.11 138.47 57.88 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 122.839 0.456 . . . . 0.0 111.402 -173.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -44.53 -44.96 9.07 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 125.694 1.598 . . . . 0.0 115.289 -159.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.6 t -129.0 1.13 5.28 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 122.0 -0.438 . . . . 0.0 112.047 -175.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.446 ' OG ' ' HB2' ' A' ' 9' ' ' ARG . 99.0 p -66.75 -19.22 65.7 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -174.354 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 63.48 39.29 9.23 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 124.655 1.182 . . . . 0.0 109.992 -172.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.603 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 22.0 t0 -68.54 -22.23 64.51 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.155 176.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.414 ' HB2' ' HB2' ' A' ' 25' ' ' CYS . 48.9 t -80.15 145.01 32.56 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.344 0.657 . . . . 0.0 109.549 166.251 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.76 -42.96 99.65 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.205 0.602 . . . . 0.0 111.996 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.5 t -148.25 137.26 21.85 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.191 0.596 . . . . 0.0 110.251 175.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.9 151.96 14.94 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.951 -176.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.4 t -82.97 131.09 35.2 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.445 0.698 . . . . 0.0 110.428 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.2 m -75.23 79.71 2.34 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-O 121.764 0.793 . . . . 0.0 110.984 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -85.71 130.7 34.49 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.776 0.831 . . . . 0.0 109.373 -175.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 61.0 28.99 18.75 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.992 0.917 . . . . 0.0 111.028 -175.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.26 36.1 91.27 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 114.782 -1.099 . . . . 0.0 112.853 -174.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HE3' ' HB3' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -155.29 131.77 10.43 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.237 0.615 . . . . 0.0 109.669 -177.735 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.414 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 46.2 t . . . . . 0 CA--C 1.55 0.972 0 C-N-CA 124.506 1.123 . . . . 0.0 112.888 -174.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.6 p . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.392 0.139 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.77 146.42 35.86 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 176.499 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -87.14 162.34 17.58 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.87 0.468 . . . . 0.0 111.089 -170.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -70.39 117.0 11.38 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 102.03 -18.6 51.74 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.517 -173.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.3 t -83.49 162.97 20.75 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.332 0.653 . . . . 0.0 110.382 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.464 ' HA ' ' HG2' ' A' ' 24' ' ' LYS . 58.2 p -78.65 131.78 36.81 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.19 0.596 . . . . 0.0 110.742 -177.038 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 23.4 p -150.84 170.39 19.39 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.108 0.563 . . . . 0.0 111.435 -176.42 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -76.06 -156.19 0.06 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.215 0.606 . . . . 0.0 111.011 -178.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -74.59 -73.63 0.23 Allowed 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 122.465 0.306 . . . . 0.0 111.716 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.5 p -146.26 18.61 1.38 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.975 0.51 . . . . 0.0 112.337 -167.321 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.6 m -87.88 48.26 1.62 Allowed 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.907 -0.496 . . . . 0.0 111.948 -174.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.3 t80 53.03 38.08 26.38 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.176 1.39 . . . . 0.0 111.772 -178.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.776 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 13.5 m-20 -71.03 -60.14 2.39 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.483 -1.235 . . . . 0.0 112.149 -174.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.8 t -69.4 135.7 50.64 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.6 t -67.58 -37.56 82.8 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.798 0.839 . . . . 0.0 111.2 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.1 t -153.07 83.24 1.2 Allowed 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 122.209 1.004 . . . . 0.0 108.575 173.267 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 161.13 -173.5 37.58 Favored Glycine 0 C--N 1.341 0.825 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.386 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.4 m -109.51 144.14 38.2 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.374 0.67 . . . . 0.0 110.002 176.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 25' ' ' CYS . 52.0 m -87.47 98.86 11.62 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.735 0.814 . . . . 0.0 110.556 177.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -87.56 107.06 18.41 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.395 1.078 . . . . 0.0 109.437 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.8 t30 46.79 69.65 0.47 Allowed 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 125.051 1.34 . . . . 0.0 112.659 173.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.71 -7.41 58.65 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.616 -1.102 . . . . 0.0 115.221 173.314 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HG2' ' HA ' ' A' ' 7' ' ' SER . 10.4 mtmp? -145.12 147.9 33.03 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 118.781 1.29 . . . . 0.0 110.195 176.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 20' ' ' CYS . 41.6 t . . . . . 0 N--CA 1.477 0.923 0 O-C-N 122.114 -0.366 . . . . 0.0 110.329 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 C--O 1.243 0.748 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -74.32 146.58 42.99 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.482 0.713 . . . . 0.0 111.665 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -87.49 165.7 15.33 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.562 0.745 . . . . 0.0 109.196 171.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 25' ' ' CYS . 86.9 tttt -63.67 126.78 28.66 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 123.494 0.496 . . . . 0.0 110.6 -176.068 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 112.19 -40.95 2.36 Favored Glycine 0 C--N 1.342 0.903 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.684 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.9 t -70.42 146.75 50.16 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 122.942 0.497 . . . . 0.0 110.693 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.536 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 34.7 p -76.3 101.92 5.67 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.443 0.64 . . . . 0.0 110.433 -175.338 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 19.1 p -93.53 178.9 5.55 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.814 174.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -73.1 178.96 4.05 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.009 0.524 . . . . 0.0 111.072 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 70.8 mmt-85 -69.28 -67.49 0.47 Allowed 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.908 0.483 . . . . 0.0 111.097 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 71.8 p -131.58 13.11 4.95 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.95 0.5 . . . . 0.0 111.331 -175.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.6 t -82.01 10.52 6.41 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.068 0.547 . . . . 0.0 112.417 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 58.6 34.84 24.16 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.486 1.114 . . . . 0.0 111.644 176.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.53 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 28.2 t70 -74.45 -8.34 55.98 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.224 -177.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 m -64.36 147.31 52.86 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.567 0.747 . . . . 0.0 111.455 166.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 t -90.57 -47.47 7.67 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.2 t -155.04 80.6 1.07 Allowed 'General case' 0 CA--C 1.556 1.186 0 CA-C-O 122.483 1.135 . . . . 0.0 108.465 172.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -174.61 -165.22 30.72 Favored Glycine 0 C--N 1.342 0.895 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.951 -175.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.3 m -126.08 104.9 8.51 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 122.98 0.512 . . . . 0.0 110.479 -177.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.0 m -59.61 115.44 3.32 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 121.122 0.487 . . . . 0.0 110.483 172.151 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -169.19 137.25 1.91 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.803 1.241 . . . . 0.0 108.414 -167.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 60.97 26.17 16.14 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.359 1.064 . . . . 0.0 111.75 178.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.96 4.13 90.54 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 114.966 -1.016 . . . . 0.0 114.799 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.2 mtmp? -133.67 161.63 34.13 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.421 0.688 . . . . 0.0 110.416 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 4' ' ' LYS . 34.5 t . . . . . 0 CA--C 1.537 0.462 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.336 0.112 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.447 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.4 OUTLIER -97.3 155.88 16.68 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.464 0.706 . . . . 0.0 110.746 179.095 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -117.63 -178.68 3.53 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.46 1.104 . . . . 0.0 109.461 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.472 ' HE3' ' HB ' ' A' ' 17' ' ' THR . 34.3 mmtp -54.01 114.96 1.78 Allowed 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.06 0.944 . . . . 0.0 112.954 -172.59 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.21 -23.44 24.28 Favored Glycine 0 C--N 1.349 1.304 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.233 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.4 t -65.24 137.59 57.68 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 123.156 0.582 . . . . 0.0 109.942 178.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 24.3 m -78.94 104.85 9.87 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.989 -167.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.6 p -91.63 -160.62 0.74 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.354 1.061 . . . . 0.0 110.155 175.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -95.33 -164.89 1.21 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.524 0.73 . . . . 0.0 110.851 178.036 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -69.05 -63.27 1.09 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.007 0.523 . . . . 0.0 110.923 177.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.5 t -148.46 21.44 1.05 Allowed 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 122.866 0.466 . . . . 0.0 111.639 -172.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.4 m -68.21 -16.15 63.86 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.068 0.547 . . . . 0.0 111.756 177.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.0 t80 58.43 31.86 21.44 Favored 'General case' 0 C--N 1.358 0.967 0 C-N-CA 125.152 1.381 . . . . 0.0 111.243 -176.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -78.22 0.81 23.69 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.622 175.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 50.3 t -90.98 134.55 34.39 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.234 1.013 . . . . 0.0 109.369 168.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.2 m -77.19 -65.6 0.93 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.006 0.522 . . . . 0.0 110.754 174.531 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.472 ' HB ' ' HE3' ' A' ' 4' ' ' LYS . 33.3 p -97.45 111.91 23.97 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.69 -0.687 . . . . 0.0 111.443 -170.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.73 -173.31 35.01 Favored Glycine 0 C--N 1.35 1.311 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.226 -177.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 57.2 m -113.02 163.84 14.2 Favored 'General case' 0 C--O 1.243 0.743 0 C-N-CA 123.328 0.651 . . . . 0.0 110.3 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 96.8 m -84.39 101.95 12.39 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.27 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -108.46 125.37 51.7 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 169.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.4 t30 56.98 37.68 28.93 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.181 0.992 . . . . 0.0 110.505 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.26 31.27 78.58 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 114.304 -1.316 . . . . 0.0 113.377 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.452 ' NZ ' ' HB2' ' A' ' 24' ' ' LYS . 9.2 mtmp? -139.09 159.01 43.17 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.174 0.99 . . . . 0.0 109.52 177.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.447 ' SG ' ' HB3' ' A' ' 2' ' ' LYS . 86.0 m . . . . . 0 N--CA 1.477 0.878 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.5 p . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.492 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 73.8 mmtt -56.02 122.94 12.77 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.775 0.83 . . . . 0.0 111.871 -176.747 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -69.05 177.58 2.61 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.983 0.913 . . . . 0.0 111.692 -179.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -70.31 104.08 2.58 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 122.845 0.458 . . . . 0.0 109.998 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.77 10.43 58.93 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.986 -178.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 40.2 t -75.5 149.14 38.49 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 117.135 0.467 . . . . 0.0 110.248 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.1 p -76.89 100.39 5.53 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.363 0.665 . . . . 0.0 111.148 -169.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.0 p -108.46 178.13 4.58 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.556 0.743 . . . . 0.0 110.796 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -77.05 -158.46 0.11 Allowed 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.839 0.856 . . . . 0.0 111.826 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -62.93 -45.26 93.32 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.189 0.595 . . . . 0.0 111.436 177.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 t -158.39 76.53 0.76 Allowed 'General case' 0 CA--C 1.548 0.899 0 CA-C-O 122.376 1.084 . . . . 0.0 108.076 175.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 89.9 p -71.37 -41.0 70.25 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.222 -170.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 66.25 8.72 5.8 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.122 1.369 . . . . 0.0 112.213 -167.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -80.47 -18.09 49.71 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.569 0.748 . . . . 0.0 109.356 176.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.492 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 61.7 m -50.65 111.31 0.52 Allowed 'General case' 0 C--N 1.355 0.83 0 C-N-CA 124.539 1.136 . . . . 0.0 111.102 174.171 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.64 -39.01 61.33 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.966 1.306 . . . . 0.0 110.784 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.4 t -155.89 116.03 3.7 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 114.633 -1.167 . . . . 0.0 107.927 166.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.77 -173.74 22.2 Favored Glycine 0 C--N 1.352 1.445 0 N-CA-C 114.003 0.361 . . . . 0.0 114.003 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.4 m -134.49 150.03 50.76 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.061 0.944 . . . . 0.0 110.481 -178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 95.5 m -74.7 85.69 2.14 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.395 0.678 . . . . 0.0 112.021 -177.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -111.73 129.78 56.0 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 124.804 1.242 . . . . 0.0 108.68 174.632 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 60.0 t30 62.5 30.91 17.23 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 122.466 1.127 . . . . 0.0 110.351 -176.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.43 20.24 69.47 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-N 114.328 -1.306 . . . . 0.0 114.465 -178.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -138.42 158.96 43.27 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.716 0.806 . . . . 0.0 109.551 178.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 82.8 m . . . . . 0 N--CA 1.477 0.887 0 CA-C-O 121.62 0.724 . . . . 0.0 110.044 179.13 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.1 p . . . . . 0 N--CA 1.475 0.814 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 6' ' ' SER . 13.0 mptt -76.11 142.89 41.55 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.237 0.615 . . . . 0.0 111.656 -174.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -89.43 176.85 6.75 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.33 0.652 . . . . 0.0 110.552 177.032 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.97 118.65 10.07 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.422 0.689 . . . . 0.0 110.867 -174.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.89 -3.58 55.86 Favored Glycine 0 C--N 1.338 0.642 0 CA-C-N 115.545 -0.752 . . . . 0.0 113.41 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.459 ' HB3' ' HB3' ' A' ' 2' ' ' LYS . 34.9 t -82.44 176.19 9.61 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.008 0.523 . . . . 0.0 110.449 174.512 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.2 m -108.39 138.9 43.9 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.297 0.639 . . . . 0.0 111.411 -173.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.6 p -135.9 -156.38 0.71 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -110.43 -175.62 2.77 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 166.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -54.6 -47.56 73.24 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.337 0.655 . . . . 0.0 112.332 -170.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 p -141.56 66.12 1.36 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.832 0.853 . . . . 0.0 109.897 177.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.1 m -79.1 -29.24 43.17 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.907 171.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 60.9 16.3 6.78 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 125.009 1.324 . . . . 0.0 111.47 -174.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -92.63 -5.58 51.19 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 122.843 0.457 . . . . 0.0 111.218 -173.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 73.9 m -64.27 106.86 1.18 Allowed 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 169.121 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -51.69 -61.68 2.1 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.181 1.392 . . . . 0.0 111.753 -171.386 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.8 p -123.28 89.07 3.03 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 170.479 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.51 174.55 28.36 Favored Glycine 0 C--N 1.337 0.636 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.697 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.0 m -110.0 153.42 24.61 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.42 0.688 . . . . 0.0 109.39 176.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.0 m -74.63 79.25 2.0 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.43 0.633 . . . . 0.0 109.538 172.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -73.49 101.42 3.53 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.229 1.412 . . . . 0.0 108.716 -176.137 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.1 t30 55.76 36.04 26.49 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.59 1.156 . . . . 0.0 111.55 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.07 5.85 65.56 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 115.244 -0.889 . . . . 0.0 114.629 175.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.7 mtmp? -138.44 145.29 40.74 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 117.895 0.848 . . . . 0.0 110.111 172.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.9 m . . . . . 0 CA--C 1.547 0.83 0 C-N-CA 123.686 0.794 . . . . 0.0 111.512 -179.404 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.7 p . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.698 0.285 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.522 ' HD3' ' HB3' ' A' ' 14' ' ' ASP . 13.5 mptt -98.9 152.7 19.47 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.044 0.537 . . . . 0.0 109.894 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -97.13 152.64 18.59 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.358 177.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HB2' HG23 ' A' ' 17' ' ' THR . 0.4 OUTLIER -63.82 126.64 28.29 Favored 'General case' 0 C--O 1.244 0.772 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 171.839 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.02 -22.48 33.25 Favored Glycine 0 C--N 1.337 0.637 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.903 -176.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 t -78.84 178.62 7.8 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.243 0.617 . . . . 0.0 109.454 173.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 22.0 p -97.26 136.1 38.23 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.956 0.502 . . . . 0.0 110.717 176.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.669 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 30.7 p -147.95 148.43 30.77 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.853 0.461 . . . . 0.0 110.126 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -73.75 146.15 44.57 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.504 0.722 . . . . 0.0 111.196 -173.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.616 ' HG2' HG23 ' A' ' 11' ' ' THR . 54.5 ttp180 -35.46 -61.25 0.46 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 126.91 2.084 . . . . 0.0 115.521 -166.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.616 HG23 ' HG2' ' A' ' 10' ' ' ARG . 19.4 p -133.73 28.68 3.9 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 120.892 0.377 . . . . 0.0 110.996 -175.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.7 m -86.61 4.05 41.91 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.394 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 60.15 23.32 12.61 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 124.857 1.263 . . . . 0.0 112.49 176.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.639 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 83.6 m-20 -61.35 -36.26 79.71 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -169.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.669 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 99.6 m -75.86 152.49 37.19 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.6 m -89.33 -23.63 22.2 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.248 165.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.435 HG23 ' HB2' ' A' ' 4' ' ' LYS . 11.5 t -156.4 147.05 21.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.891 0.876 . . . . 0.0 108.79 172.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.16 141.22 11.9 Favored Glycine 0 C--N 1.343 0.952 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -176.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.6 m -83.6 126.36 32.75 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 94.0 m -71.58 76.88 0.81 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 121.844 0.83 . . . . 0.0 110.749 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.2 ttt180 -117.19 133.4 56.03 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 124.56 1.144 . . . . 0.0 108.382 -174.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 64.9 t30 62.18 35.91 15.28 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 124.538 1.135 . . . . 0.0 110.152 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.15 13.11 64.13 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 114.455 -1.248 . . . . 0.0 114.196 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.5 mtmp? -136.86 160.41 38.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.683 0.793 . . . . 0.0 111.182 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -88.65 76.76 8.05 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.121 0.969 . . . . 0.0 110.055 -173.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 0.484 0 CA-C-N 115.525 -0.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.0 p . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.627 ' HG2' ' HB3' ' A' ' 8' ' ' CYS . 5.6 mptp? -65.21 119.34 10.7 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.528 0.731 . . . . 0.0 112.923 -173.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -78.78 159.68 27.77 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.726 0.81 . . . . 0.0 109.995 171.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -62.67 123.79 19.32 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.692 0.397 . . . . 0.0 110.699 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.89 -27.56 10.22 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.595 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.4 t -75.69 148.84 38.32 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.116 0.566 . . . . 0.0 110.241 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 62.3 p -77.94 134.94 37.79 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 120.897 0.379 . . . . 0.0 110.249 -176.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.627 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 14.8 p -145.69 165.25 29.3 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.786 0.834 . . . . 0.0 109.893 -179.076 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.75 153.18 44.27 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 173.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -50.49 -45.15 56.17 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.432 1.093 . . . . 0.0 112.665 -172.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -126.56 48.68 2.12 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.061 0.944 . . . . 0.0 109.271 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.0 p -55.16 -40.35 70.53 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.881 0.873 . . . . 0.0 112.229 -176.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.9 t80 65.55 9.78 6.13 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 125.221 1.409 . . . . 0.0 111.638 -174.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -93.16 -14.42 27.21 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.445 1.098 . . . . 0.0 109.592 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.0 t -62.88 108.55 1.22 Allowed 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.007 -178.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.4 t -50.83 -45.95 59.79 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 126.328 1.851 . . . . 0.0 113.255 -168.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.3 t -158.91 39.66 0.22 Allowed 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.074 0.94 . . . . 0.0 109.451 -174.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -150.77 174.51 30.06 Favored Glycine 0 C--N 1.339 0.699 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.48 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 36.9 m -112.74 133.93 54.52 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 174.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.9 m -72.3 84.16 1.06 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.744 0.783 . . . . 0.0 110.553 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.8 mtt180 -100.77 132.71 46.03 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.112 1.365 . . . . 0.0 109.327 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 61.7 25.21 15.15 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.207 1.003 . . . . 0.0 111.534 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.54 2.79 81.9 Favored Glycine 0 CA--C 1.538 1.521 0 CA-C-N 115.565 -0.743 . . . . 0.0 114.685 178.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -139.45 159.71 41.52 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-N 118.154 0.977 . . . . 0.0 109.761 174.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.584 ' SG ' ' HB3' ' A' ' 2' ' ' LYS . 49.5 m -60.32 143.61 52.54 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.178 0.591 . . . . 0.0 111.721 176.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 0.408 0 O-C-N 123.542 0.526 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.7 p . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' A' ' 7' ' ' SER . 2.3 mptm? -69.51 137.27 52.38 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.248 0.619 . . . . 0.0 111.974 -174.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 71.7 mtp180 -90.12 177.66 6.38 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.742 0.817 . . . . 0.0 110.074 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.0 125.94 16.91 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.371 1.068 . . . . 0.0 111.222 179.087 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.27 -23.07 33.44 Favored Glycine 0 C--N 1.348 1.216 0 O-C-N 123.396 0.435 . . . . 0.0 113.626 178.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.1 t -85.41 165.72 16.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.157 0.583 . . . . 0.0 111.056 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 2' ' ' LYS . 37.3 p -79.34 104.86 10.25 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 123.944 0.898 . . . . 0.0 113.101 -166.504 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.6 p -119.39 153.31 35.39 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.45 0.7 . . . . 0.0 110.617 176.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.1 mmt-85 -74.66 -177.26 3.12 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 122.574 0.35 . . . . 0.0 110.439 -174.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -50.47 -66.88 0.31 Allowed 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.349 1.059 . . . . 0.0 113.077 -173.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.3 p -140.84 24.57 2.19 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.424 0.69 . . . . 0.0 110.481 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.3 p -64.64 -20.98 66.6 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.646 1.178 . . . . 0.0 113.853 -173.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER 65.86 26.05 11.16 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.849 1.26 . . . . 0.0 110.633 -169.093 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.27 -31.73 72.95 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 124.093 0.957 . . . . 0.0 109.666 169.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.564 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 5.4 t -67.62 125.75 27.19 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.967 171.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 t -69.06 -36.48 77.72 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.301 1.041 . . . . 0.0 111.3 -170.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 t -160.65 80.48 0.65 Allowed 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.506 0.722 . . . . 0.0 109.834 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 167.2 158.52 11.6 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.153 -0.931 . . . . 0.0 112.616 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.4 m -86.28 138.95 31.45 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.236 0.614 . . . . 0.0 109.737 175.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.564 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 83.8 m -93.94 132.74 38.09 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 123.238 0.615 . . . . 0.0 111.612 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.4 ttm-85 -141.94 137.48 31.3 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.373 1.069 . . . . 0.0 109.089 174.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.9 t30 58.89 39.43 23.84 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-O 122.582 1.182 . . . . 0.0 110.782 175.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.84 8.25 81.97 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 114.329 -1.305 . . . . 0.0 114.857 175.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -139.03 158.81 43.52 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 118.122 0.961 . . . . 0.0 111.433 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 66.0 m -68.36 129.59 40.39 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.256 1.022 . . . . 0.0 110.702 174.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.284 0 O-C-N 123.606 0.566 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.9 p . . . . . 0 N--CA 1.485 1.313 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -119.5 157.64 27.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.048 0.539 . . . . 0.0 110.16 174.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -94.1 155.26 17.18 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.746 0.819 . . . . 0.0 109.656 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.421 ' HB2' HG23 ' A' ' 17' ' ' THR . 0.2 OUTLIER -63.16 111.07 2.06 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 172.751 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 126.89 -27.42 4.88 Favored Glycine 0 C--N 1.342 0.909 0 O-C-N 123.455 0.472 . . . . 0.0 112.642 -176.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 t -74.11 -174.99 2.07 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.63 0.772 . . . . 0.0 111.763 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.46 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 49.2 m -101.93 133.14 47.19 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.099 0.559 . . . . 0.0 109.655 173.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.57 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 27.2 p -155.23 150.37 26.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.44 0.696 . . . . 0.0 110.294 -176.311 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -70.81 140.72 51.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.513 0.325 . . . . 0.0 110.859 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.676 ' HG2' HG23 ' A' ' 11' ' ' THR . 44.3 ttp180 -34.21 -53.23 0.49 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 127.155 2.182 . . . . 0.0 115.939 -169.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.676 HG23 ' HG2' ' A' ' 10' ' ' ARG . 24.6 p -137.74 28.12 2.69 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 120.926 0.393 . . . . 0.0 111.716 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.442 ' OG ' ' HB2' ' A' ' 14' ' ' ASP . 27.4 p -77.39 -6.45 53.42 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.624 0.602 . . . . 0.0 112.624 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 62.44 29.17 17.11 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.983 0.913 . . . . 0.0 110.217 -173.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.57 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 45.4 t0 -69.77 -29.67 67.06 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.634 1.174 . . . . 0.0 111.281 -172.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.567 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 71.7 m -84.78 152.74 23.45 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.516 0.726 . . . . 0.0 111.466 176.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 72.0 m -84.97 -28.36 25.86 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.862 165.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.421 HG23 ' HB2' ' A' ' 4' ' ' LYS . 10.0 t -151.96 152.52 32.6 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.165 0.586 . . . . 0.0 110.158 175.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.66 164.45 36.9 Favored Glycine 0 C--N 1.346 1.118 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.076 -174.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.5 m -107.58 122.55 46.9 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 122.745 0.418 . . . . 0.0 109.9 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.436 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 85.6 m -69.26 87.75 0.43 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.268 0.556 . . . . 0.0 110.532 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -120.01 136.85 54.4 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.965 0.906 . . . . 0.0 109.732 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 59.27 32.01 21.62 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.568 1.147 . . . . 0.0 111.582 -176.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.32 8.57 87.03 Favored Glycine 0 C--N 1.343 0.926 0 CA-C-N 115.064 -0.971 . . . . 0.0 114.707 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.3 mtmp? -136.07 147.0 47.66 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.56 0.695 . . . . 0.0 111.717 178.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.0 t -72.45 124.87 26.06 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.014 1.326 . . . . 0.0 110.737 177.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.237 0 CA-C-N 117.683 0.22 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.0 p . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -105.57 153.27 22.0 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.5 0.72 . . . . 0.0 110.606 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -70.99 166.97 20.18 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.481 0.713 . . . . 0.0 111.236 178.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -66.28 118.99 10.75 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 174.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.22 -0.52 63.99 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 123.026 0.346 . . . . 0.0 112.832 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.0 t -92.12 152.3 19.98 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.102 0.561 . . . . 0.0 110.097 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.8 m -79.25 120.87 24.34 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.864 0.466 . . . . 0.0 111.108 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.562 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 9.8 p -109.5 -92.39 0.44 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.745 0.818 . . . . 0.0 109.557 178.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 177.09 131.3 0.05 Allowed 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -43.72 -37.56 2.73 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 115.761 1.763 . . . . 0.0 115.761 -165.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.2 p -124.87 6.46 8.05 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.918 0.711 . . . . 0.0 112.918 -176.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.2 m -78.37 -24.09 46.57 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 119.346 -0.359 . . . . 0.0 111.921 174.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.6 t80 53.32 39.04 29.21 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.226 1.01 . . . . 0.0 111.079 -174.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -88.14 36.77 0.79 Allowed 'General case' 0 CA--C 1.554 1.119 0 CA-C-O 122.117 0.961 . . . . 0.0 111.184 -169.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.562 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 61.0 m -107.85 134.41 50.83 Favored 'General case' 0 C--N 1.348 0.507 0 C-N-CA 124.126 0.971 . . . . 0.0 109.127 177.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -37.44 83.12 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.533 0.733 . . . . 0.0 110.591 173.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.7 t -141.9 144.12 33.65 Favored 'General case' 0 C--O 1.243 0.741 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 167.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.54 162.34 30.26 Favored Glycine 0 C--N 1.338 0.689 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.989 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.3 m -94.95 145.43 24.93 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.076 0.95 . . . . 0.0 109.714 177.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 62.7 m -74.11 76.06 1.75 Allowed 'General case' 0 CA--C 1.549 0.92 0 CA-C-O 122.07 0.938 . . . . 0.0 110.957 175.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.1 mtp180 -84.26 112.86 20.68 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 124.627 1.171 . . . . 0.0 109.28 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.7 t30 58.99 40.54 22.22 Favored 'General case' 0 CA--C 1.557 1.23 0 CA-C-O 122.576 1.179 . . . . 0.0 109.894 178.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.83 -13.78 61.96 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 114.658 -1.155 . . . . 0.0 114.397 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -126.79 154.2 44.58 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 117.952 0.876 . . . . 0.0 111.25 -171.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.5 m -72.48 95.8 1.84 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.193 0.997 . . . . 0.0 111.098 -175.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.204 0 CA-C-N 116.517 -0.311 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 14' ' ' ASP . 14.6 p . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.675 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 47.5 mmtm -80.28 126.77 31.56 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 118.272 0.487 . . . . 0.0 110.304 -171.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 172.13 9.27 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 175.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -66.81 118.0 9.71 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.089 0.471 . . . . 0.0 110.329 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 107.62 -14.05 38.76 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 115.279 -0.873 . . . . 0.0 113.016 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.0 t -72.97 152.75 41.24 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.102 0.561 . . . . 0.0 111.106 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.557 ' HA ' ' HG2' ' A' ' 24' ' ' LYS . 31.8 m -80.18 140.41 36.34 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 122.953 0.501 . . . . 0.0 110.12 177.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.462 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 6.3 p -149.2 -177.19 5.69 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.705 0.802 . . . . 0.0 110.124 178.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.499 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 49.0 ttp85 -84.53 173.46 10.8 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 168.233 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.499 ' H ' ' HG2' ' A' ' 9' ' ' ARG . 57.8 ttp180 -49.82 -34.0 18.4 Favored 'General case' 0 N--CA 1.5 2.055 0 C-N-CA 123.999 0.919 . . . . 0.0 112.106 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.4 t -155.14 96.04 1.78 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-O 121.895 0.855 . . . . 0.0 108.866 163.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.6 p -82.66 -12.52 57.57 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.001 -0.999 . . . . 0.0 111.696 176.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 70.9 -22.78 0.18 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 126.038 1.735 . . . . 0.0 114.278 177.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 1' ' ' CYS . 3.7 p-10 -86.83 2.77 47.88 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 118.339 0.518 . . . . 0.0 111.03 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.675 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 42.4 t -64.1 97.32 0.17 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.1 m -60.22 -34.94 74.36 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.078 0.951 . . . . 0.0 112.737 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.4 t -148.58 138.01 21.93 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 120.755 0.312 . . . . 0.0 110.415 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.3 164.42 40.25 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.605 -173.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 60.7 m -104.75 148.04 27.04 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.5 m -75.65 71.51 2.54 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.823 0.82 . . . . 0.0 112.373 -176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -84.06 124.92 31.6 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.965 1.306 . . . . 0.0 109.055 178.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 59.66 32.87 21.75 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.347 1.07 . . . . 0.0 109.335 -173.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.38 36.09 92.6 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 113.816 -1.538 . . . . 0.0 113.308 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.557 ' HG2' ' HA ' ' A' ' 7' ' ' SER . 36.2 mtmm -148.0 140.07 24.13 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.522 0.729 . . . . 0.0 110.19 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 84.6 m -66.06 132.98 49.8 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.094 0.558 . . . . 0.0 110.913 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.32 0 O-C-N 122.998 0.186 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 28.5 p . . . . . 0 N--CA 1.484 1.239 0 CA-C-O 120.693 0.282 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.404 ' HG2' ' HB3' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -96.68 129.01 44.16 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.787 0.835 . . . . 0.0 110.671 -176.307 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -82.98 178.68 8.04 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.077 1.351 . . . . 0.0 111.439 177.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -66.19 100.25 0.6 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.799 0.84 . . . . 0.0 110.353 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 113.09 -17.01 22.44 Favored Glycine 0 C--N 1.343 0.946 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.367 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 45.6 t -69.8 143.01 53.07 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.256 0.622 . . . . 0.0 110.558 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.494 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 21.4 p -78.01 117.04 18.94 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.016 0.526 . . . . 0.0 111.347 -173.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.404 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 25.5 p -115.56 -163.86 0.91 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.015 0.926 . . . . 0.0 109.576 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.03 -164.21 1.14 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.298 0.639 . . . . 0.0 109.908 172.046 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -62.02 -62.22 1.94 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.721 0.808 . . . . 0.0 112.329 -175.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.7 p -144.76 22.41 1.61 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.864 0.866 . . . . 0.0 109.824 -175.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.0 m -76.78 13.58 1.0 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -168.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 64.04 18.21 11.09 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.254 1.022 . . . . 0.0 112.893 171.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -60.26 -28.99 68.5 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.383 0.673 . . . . 0.0 111.483 -177.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.6 m -58.62 133.07 55.55 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.773 1.229 . . . . 0.0 113.025 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -72.72 -28.7 62.82 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.421 0.689 . . . . 0.0 109.855 164.282 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.0 t -155.19 145.56 21.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.745 0.818 . . . . 0.0 109.705 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 83.65 -168.99 46.44 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 116.264 -0.425 . . . . 0.0 112.552 -175.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.427 ' HB3' HH12 ' A' ' 21' ' ' ARG . 25.8 t -134.95 152.8 52.06 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.331 0.652 . . . . 0.0 109.816 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.2 m -72.49 114.96 11.18 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.386 0.675 . . . . 0.0 112.675 -173.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.427 HH12 ' HB3' ' A' ' 19' ' ' SER . 63.0 mmt-85 -102.26 105.25 15.86 Favored 'General case' 0 C--O 1.245 0.823 0 C-N-CA 124.459 1.104 . . . . 0.0 109.864 170.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.1 t30 50.55 70.38 0.52 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.783 1.233 . . . . 0.0 112.006 171.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.36 7.78 34.55 Favored Glycine 0 CA--C 1.539 1.576 0 N-CA-C 114.69 0.636 . . . . 0.0 114.69 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 8.5 mtmp? -131.94 161.0 34.14 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.494 1.118 . . . . 0.0 108.37 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 48.5 t -104.99 136.22 44.86 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -178.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.282 0 O-C-N 122.913 0.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 52.2 t . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.599 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 73.8 mmtt -127.2 141.83 51.64 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.492 0.717 . . . . 0.0 110.095 177.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -120.61 173.51 7.14 Favored 'General case' 0 C--O 1.245 0.836 0 C-N-CA 124.438 1.095 . . . . 0.0 108.755 173.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -64.04 113.52 3.55 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.187 0.595 . . . . 0.0 111.046 -178.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 121.65 -29.23 5.7 Favored Glycine 0 C--N 1.339 0.748 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.737 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.0 t -77.35 137.16 38.58 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.95 0.5 . . . . 0.0 111.002 -175.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.6 p -79.21 126.86 31.31 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.256 0.622 . . . . 0.0 111.387 -175.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 25' ' ' CYS . 8.0 p -152.66 155.3 37.02 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.378 0.671 . . . . 0.0 110.848 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -70.34 144.42 51.67 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.1 ttp180 -43.23 -43.11 4.6 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 125.111 1.364 . . . . 0.0 114.145 -164.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.3 p -133.5 75.14 1.59 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.589 0.709 . . . . 0.0 109.741 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.4 m -88.12 -11.97 45.42 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.709 172.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.3 t80 61.06 19.28 9.79 Favored 'General case' 0 CA--C 1.559 1.296 0 C-N-CA 124.622 1.169 . . . . 0.0 112.244 -174.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -96.98 -15.7 20.97 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.569 -174.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 52.4 m -64.78 110.17 2.3 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.129 0.571 . . . . 0.0 111.278 176.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 79.4 m -74.97 -46.89 32.36 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.351 0.661 . . . . 0.0 110.034 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.2 p -130.6 101.14 5.57 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.842 0.857 . . . . 0.0 108.916 175.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 125.94 -166.27 18.77 Favored Glycine 0 C--N 1.348 1.235 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.869 -177.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 63.1 m -146.88 143.32 28.46 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.176 0.991 . . . . 0.0 108.956 174.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 61.7 m -73.13 99.4 2.8 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.292 0.637 . . . . 0.0 110.446 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -111.98 128.39 56.15 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.914 0.486 . . . . 0.0 110.288 177.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 58.98 26.21 14.76 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 125.652 1.581 . . . . 0.0 112.073 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 100.42 -0.9 55.77 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-N 115.007 -0.997 . . . . 0.0 115.021 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -138.49 144.38 40.0 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 118.901 1.351 . . . . 0.0 110.876 176.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 10.8 t -76.7 143.51 39.97 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.409 1.084 . . . . 0.0 110.898 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.199 0 CA-C-N 117.0 -0.091 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.4 p . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.426 ' HE3' ' N ' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -71.18 139.41 50.16 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 123.314 0.384 . . . . 0.0 111.131 -178.191 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -82.18 173.23 12.31 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.497 0.719 . . . . 0.0 110.394 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.439 ' NZ ' ' HB2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -67.0 124.57 23.4 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-O 120.836 0.351 . . . . 0.0 110.574 -178.365 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.481 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . 96.18 -17.35 59.44 Favored Glycine 0 C--N 1.352 1.451 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.653 -172.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.7 t -79.28 149.2 31.88 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.256 0.622 . . . . 0.0 111.125 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.7 m -79.03 101.1 7.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.51 0.724 . . . . 0.0 111.323 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 20.1 p -107.31 148.22 29.28 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.964 0.905 . . . . 0.0 110.31 177.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.433 ' HB3' ' OG ' ' A' ' 12' ' ' SER . 44.6 ttt180 -59.97 131.29 50.39 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 122.787 0.435 . . . . 0.0 110.086 -179.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.405 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 73.9 ttt180 -50.34 -40.85 50.26 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 115.668 1.729 . . . . 0.0 115.668 -153.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.3 p -135.46 14.22 3.47 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.433 ' OG ' ' HB3' ' A' ' 9' ' ' ARG . 81.0 p -83.55 -12.92 55.57 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.134 0.573 . . . . 0.0 110.842 175.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 61.93 40.02 12.91 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 124.793 1.237 . . . . 0.0 110.329 -176.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -70.64 -4.23 22.39 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 113.505 -1.679 . . . . 0.0 112.006 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.509 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 11.5 t -85.47 164.86 17.59 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.788 0.835 . . . . 0.0 110.9 176.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.78 -21.59 16.28 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.462 1.105 . . . . 0.0 110.015 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.0 t -153.92 143.82 21.9 Favored 'General case' 0 C--N 1.353 0.735 0 C-N-CA 123.609 0.764 . . . . 0.0 109.735 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.3 -162.53 49.68 Favored Glycine 0 C--N 1.337 0.628 0 CA-C-N 116.586 -0.279 . . . . 0.0 112.63 -177.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.0 t -119.74 158.29 26.82 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.816 0.846 . . . . 0.0 109.18 176.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 96.7 m -84.42 69.06 10.47 Favored 'General case' 0 CA--C 1.558 1.256 0 CA-C-O 121.678 0.751 . . . . 0.0 111.195 -177.35 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -68.07 115.39 7.51 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.237 1.415 . . . . 0.0 109.654 177.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 60.85 28.09 17.87 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 122.383 1.087 . . . . 0.0 110.218 -178.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.49 28.9 66.76 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 114.523 -1.217 . . . . 0.0 113.643 -176.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -141.15 158.8 43.42 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.809 0.844 . . . . 0.0 110.216 173.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.481 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 76.5 m -77.73 123.41 26.66 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.404 -175.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.288 0 O-C-N 123.284 0.365 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.9 p . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.703 0.287 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.638 ' HG3' ' HA ' ' A' ' 8' ' ' CYS . 74.7 mmtt -93.4 155.5 17.33 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-O 120.683 0.277 . . . . 0.0 110.271 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -107.25 170.67 7.82 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.029 0.532 . . . . 0.0 109.672 -177.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -63.41 128.64 36.77 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.109 0.564 . . . . 0.0 110.747 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.8 -9.32 77.62 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.327 -177.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.1 t -94.3 148.88 21.77 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.333 0.653 . . . . 0.0 110.043 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.9 p -79.35 108.07 12.59 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.322 0.649 . . . . 0.0 110.58 -176.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.638 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 2.9 p -89.39 -97.62 0.1 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.541 0.736 . . . . 0.0 109.869 178.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.6 ttt180 175.46 142.57 0.06 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.674 1.19 . . . . 0.0 108.073 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -29.13 -66.26 0.09 Allowed 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 127.043 2.137 . . . . 0.0 115.697 -162.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.7 p -129.55 18.32 5.79 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.767 0.827 . . . . 0.0 111.405 -174.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.9 m -71.84 -35.31 69.82 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.066 0.546 . . . . 0.0 112.446 -176.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.6 t80 55.7 32.82 20.12 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.8 1.24 . . . . 0.0 112.36 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -70.59 -14.71 62.6 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.723 168.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.6 t -66.71 130.19 42.34 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.673 0.789 . . . . 0.0 109.892 171.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.97 -37.66 85.61 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.543 0.527 . . . . 0.0 111.703 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.4 t -154.39 140.52 18.45 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 122.73 0.412 . . . . 0.0 110.158 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.67 140.26 10.88 Favored Glycine 0 C--N 1.343 0.966 0 C-N-CA 123.247 0.451 . . . . 0.0 112.2 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.2 m -80.12 127.32 32.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 122.98 0.512 . . . . 0.0 109.845 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.1 m -68.69 80.04 0.28 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.902 0.881 . . . . 0.0 112.694 -177.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -84.43 125.27 32.19 Favored 'General case' 0 C--O 1.243 0.752 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.5 t30 59.26 29.92 19.57 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.048 0.939 . . . . 0.0 110.184 -174.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.93 32.69 77.81 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.515 -175.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.45 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -145.78 133.12 20.63 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -176.734 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.5 m -58.75 109.02 0.73 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.175 0.99 . . . . 0.0 111.969 -177.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.05 0 CA-C-N 116.306 -0.406 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 120.304 0.097 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.408 ' H ' ' HA ' ' A' ' 15' ' ' CYS . 45.9 mmtm -118.45 166.53 12.57 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 121.459 0.647 . . . . 0.0 111.308 -178.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -120.97 169.44 10.47 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.911 174.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.39 139.23 43.88 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 122.68 0.392 . . . . 0.0 110.931 175.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.38 -0.3 89.15 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-N 116.211 -0.45 . . . . 0.0 113.78 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t -88.82 -173.43 4.1 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 117.568 0.684 . . . . 0.0 109.673 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 79.6 p -113.1 118.49 34.89 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.586 0.755 . . . . 0.0 109.034 174.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.9 p -124.88 174.88 7.65 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 122.741 0.416 . . . . 0.0 111.511 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.494 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 4.7 mpt_? -76.53 169.79 17.6 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.851 0.861 . . . . 0.0 110.01 176.11 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -55.73 -57.47 11.87 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.84 0.856 . . . . 0.0 113.14 -171.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -157.41 26.68 0.29 Allowed 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.248 0.547 . . . . 0.0 110.15 -178.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -78.0 10.05 3.18 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 124.235 1.014 . . . . 0.0 112.12 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 62.6 30.57 17.02 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.64 1.176 . . . . 0.0 111.011 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -67.79 -21.13 65.26 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.851 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 75.0 m -92.64 146.01 23.99 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 121.904 -0.498 . . . . 0.0 111.036 174.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.8 m -86.19 -50.8 6.71 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 166.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.4 p -127.32 112.11 14.67 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.232 1.013 . . . . 0.0 109.398 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.96 137.64 4.35 Favored Glycine 0 C--N 1.35 1.334 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -177.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.437 ' HB2' ' NH1' ' A' ' 21' ' ' ARG . 25.4 m -89.56 131.5 35.55 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 117.374 0.587 . . . . 0.0 109.511 177.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.1 m -79.31 115.08 18.74 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -173.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.437 ' NH1' ' HB2' ' A' ' 19' ' ' SER . 7.9 mpt_? -103.36 -168.44 1.51 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.223 1.009 . . . . 0.0 109.549 172.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -52.15 99.08 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.743 1.217 . . . . 0.0 112.481 -177.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.35 0.62 47.25 Favored Glycine 0 C--N 1.356 1.661 0 CA-C-N 115.161 -0.927 . . . . 0.0 114.581 175.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.9 mtmp? -136.94 155.73 49.37 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-N 117.463 0.632 . . . . 0.0 111.816 -168.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.1 t -91.98 86.89 5.99 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 170.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.175 0 CA-C-N 115.913 -0.585 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.478 0.973 0 CA-C-O 120.704 0.288 . . . . 0.0 110.62 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.471 ' HD3' ' HB3' ' A' ' 14' ' ' ASP . 4.4 mptp? -83.89 129.07 34.94 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.245 0.618 . . . . 0.0 110.384 -177.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.94 177.85 7.81 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.21 0.604 . . . . 0.0 109.506 177.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -59.21 115.77 3.43 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.155 0.582 . . . . 0.0 111.1 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.33 -20.98 36.34 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-O 119.838 -0.423 . . . . 0.0 113.268 -178.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.1 t -76.5 153.18 35.74 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.924 0.49 . . . . 0.0 110.886 178.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 30.5 p -79.13 103.45 9.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.533 0.733 . . . . 0.0 111.678 -174.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.476 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 30.1 p -114.9 131.56 56.83 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.656 0.782 . . . . 0.0 109.857 177.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.671 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 96.5 mtt180 -58.21 139.75 54.38 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.048 0.539 . . . . 0.0 111.784 -174.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.2 ttp-105 -39.43 -46.76 1.71 Allowed 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 126.634 1.974 . . . . 0.0 115.126 -162.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -139.03 7.35 2.44 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.812 0.445 . . . . 0.0 111.377 -176.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.671 ' HB3' ' HB2' ' A' ' 9' ' ' ARG . 47.4 t -80.77 -0.65 39.54 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.49 0.716 . . . . 0.0 111.502 179.139 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.0 t80 59.83 34.37 21.82 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.886 1.274 . . . . 0.0 112.727 170.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.471 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 7.2 m-20 -68.09 -17.1 64.28 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.309 0.644 . . . . 0.0 112.192 176.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.467 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 4.8 t -72.65 150.69 42.79 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 123.351 0.66 . . . . 0.0 110.269 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.6 m -64.88 -42.78 94.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.769 0.828 . . . . 0.0 109.719 176.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.5 t -172.01 148.98 2.33 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.89 1.276 . . . . 0.0 108.716 167.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 125.11 -171.92 17.14 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-N 116.432 -0.349 . . . . 0.0 112.639 -178.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.6 m -101.97 114.63 28.91 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.659 0.783 . . . . 0.0 110.257 -175.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 94.9 m -76.19 74.67 3.02 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.233 0.613 . . . . 0.0 110.53 175.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -89.27 128.33 35.85 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.2 t30 55.29 31.17 16.08 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.508 1.123 . . . . 0.0 110.316 -175.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.13 40.61 92.77 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 114.375 -1.284 . . . . 0.0 113.871 -176.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -151.37 141.17 21.88 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 117.288 0.544 . . . . 0.0 109.661 179.722 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.476 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 88.8 m -67.2 104.23 1.41 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.238 1.015 . . . . 0.0 111.696 179.54 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.133 0 CA-C-N 115.447 -0.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.3 p . . . . . 0 N--CA 1.475 0.796 0 CA-C-O 121.49 0.662 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.477 ' HG3' ' HB3' ' A' ' 8' ' ' CYS . 43.7 mmtm -91.85 154.09 19.12 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.457 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -107.01 177.96 4.7 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -67.8 106.89 2.41 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 125.72 -19.26 6.62 Favored Glycine 0 C--N 1.337 0.585 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.13 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.2 t -91.71 152.09 20.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.676 0.79 . . . . 0.0 110.755 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.43 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 72.4 p -77.36 136.64 38.46 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.389 0.676 . . . . 0.0 110.052 -178.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.487 ' SG ' ' HB2' ' A' ' 25' ' ' CYS . 7.5 p -154.48 163.17 40.6 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.932 0.493 . . . . 0.0 112.013 -171.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -64.0 136.26 57.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.824 0.85 . . . . 0.0 109.985 173.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.495 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 30.4 ttp-105 -52.06 -58.34 6.84 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 124.762 1.289 . . . . 0.0 113.378 -166.104 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.4 p -132.46 18.32 4.37 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.567 -0.708 . . . . 0.0 111.827 -178.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.4 t -87.76 11.33 15.66 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.998 0.519 . . . . 0.0 111.419 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 59.01 35.67 24.11 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.24 1.016 . . . . 0.0 112.129 176.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -72.62 -30.86 64.69 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.319 177.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.2 t -80.86 139.74 35.78 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 166.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.64 -48.69 76.23 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.517 0.727 . . . . 0.0 112.471 -172.399 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.0 t -146.62 31.0 0.98 Allowed 'General case' 0 N--CA 1.486 1.333 0 CA-C-O 122.15 0.976 . . . . 0.0 112.017 -171.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.416 ' HA3' ' SG ' ' A' ' 25' ' ' CYS . . . -140.6 150.7 21.85 Favored Glycine 0 N--CA 1.469 0.867 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.656 -179.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.0 m -82.37 124.37 29.95 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.185 0.594 . . . . 0.0 110.963 -179.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 98.6 m -90.25 119.44 30.56 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.658 0.783 . . . . 0.0 110.767 -178.12 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -141.59 155.18 45.76 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 173.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 60.39 22.81 12.37 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.733 0.813 . . . . 0.0 110.574 -170.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.24 32.22 83.11 Favored Glycine 0 C--N 1.342 0.869 0 CA-C-N 115.163 -0.926 . . . . 0.0 114.122 -172.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 1.0 OUTLIER -154.48 139.71 17.55 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 117.655 0.727 . . . . 0.0 110.667 -179.0 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.487 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 43.7 t -70.24 100.78 1.75 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.222 1.009 . . . . 0.0 109.742 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.098 0 CA-C-N 116.368 -0.378 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.446 ' HG3' ' HA ' ' A' ' 8' ' ' CYS . 75.3 mmtt -130.31 130.61 44.71 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.135 0.974 . . . . 0.0 109.801 -175.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -72.99 172.03 11.74 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.115 0.566 . . . . 0.0 111.498 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -62.01 106.11 0.67 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.779 0.832 . . . . 0.0 111.151 -177.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 116.39 -10.35 17.0 Favored Glycine 0 C--N 1.356 1.639 0 C-N-CA 123.132 0.396 . . . . 0.0 113.484 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.4 t -92.8 150.86 20.35 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 117.492 0.646 . . . . 0.0 110.49 177.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.63 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 38.5 p -78.85 112.4 15.97 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.962 0.505 . . . . 0.0 111.362 -175.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.446 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 27.9 p -100.85 152.36 20.61 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.091 0.556 . . . . 0.0 111.418 -178.3 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -59.03 131.97 52.63 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.689 0.796 . . . . 0.0 110.461 175.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -45.79 -45.61 14.86 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 125.219 1.574 . . . . 0.0 114.46 -161.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.4 p -137.23 12.94 3.05 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.873 0.469 . . . . 0.0 111.674 -175.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.7 t -93.94 21.9 6.22 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -168.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.8 t80 52.3 40.84 29.96 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 124.515 1.126 . . . . 0.0 111.759 -179.075 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -91.71 7.59 40.97 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.05 -175.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.5 m -89.48 122.89 33.1 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.177 0.591 . . . . 0.0 111.27 174.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 83.5 m -69.3 -38.03 78.08 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.812 0.845 . . . . 0.0 109.539 166.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.2 t -158.46 134.42 9.09 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.943 0.897 . . . . 0.0 109.094 176.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.71 -170.83 20.46 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 112.348 -0.301 . . . . 0.0 112.348 -177.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 37.7 m -116.59 146.3 42.76 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.555 0.742 . . . . 0.0 110.248 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.3 m -75.28 82.21 2.41 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 122.139 0.971 . . . . 0.0 111.004 174.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 -92.33 111.39 22.95 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.517 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.7 t30 61.12 30.15 19.25 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 124.666 1.186 . . . . 0.0 110.791 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.4 29.01 68.73 Favored Glycine 0 C--N 1.342 0.909 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.937 -175.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.63 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.4 mtmp? -135.31 136.85 41.9 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.554 0.741 . . . . 0.0 109.685 175.546 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.3 t -82.49 113.12 20.01 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.093 0.557 . . . . 0.0 110.475 -173.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.183 0 CA-C-N 116.027 -0.533 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 120.926 0.393 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -109.17 165.68 11.42 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.539 0.735 . . . . 0.0 109.447 169.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -109.03 -177.88 3.43 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.395 0.678 . . . . 0.0 110.781 177.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -63.5 122.25 15.81 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.82 0.848 . . . . 0.0 110.515 -177.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.4 -9.07 72.03 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 116.076 -0.511 . . . . 0.0 113.105 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.5 t -90.42 152.35 21.01 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 117.328 0.564 . . . . 0.0 110.202 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.1 m -78.71 126.31 30.55 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.378 0.671 . . . . 0.0 111.171 -172.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.603 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 23.9 p -146.45 147.29 31.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.658 0.783 . . . . 0.0 109.364 -176.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.446 ' HB2' ' OG ' ' A' ' 12' ' ' SER . 28.4 mmt180 -60.11 138.47 57.88 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 122.839 0.456 . . . . 0.0 111.402 -173.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -44.53 -44.96 9.07 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 125.694 1.598 . . . . 0.0 115.289 -159.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.6 t -129.0 1.13 5.28 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 122.0 -0.438 . . . . 0.0 112.047 -175.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.446 ' OG ' ' HB2' ' A' ' 9' ' ' ARG . 99.0 p -66.75 -19.22 65.7 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -174.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 63.48 39.29 9.23 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 124.655 1.182 . . . . 0.0 109.992 -172.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.603 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 22.0 t0 -68.54 -22.23 64.51 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.155 176.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.414 ' HB2' ' HB2' ' A' ' 25' ' ' CYS . 48.9 t -80.15 145.01 32.56 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.344 0.657 . . . . 0.0 109.549 166.251 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.76 -42.96 99.65 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.205 0.602 . . . . 0.0 111.996 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.5 t -148.25 137.26 21.85 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.191 0.596 . . . . 0.0 110.251 175.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.9 151.96 14.94 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.951 -176.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.4 t -82.97 131.09 35.2 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.445 0.698 . . . . 0.0 110.428 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.2 m -75.23 79.71 2.34 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-O 121.764 0.793 . . . . 0.0 110.984 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -85.71 130.7 34.49 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.776 0.831 . . . . 0.0 109.373 -175.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 61.0 28.99 18.75 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.992 0.917 . . . . 0.0 111.028 -175.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.26 36.1 91.27 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 114.782 -1.099 . . . . 0.0 112.853 -174.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HE3' ' HB3' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -155.29 131.77 10.43 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.237 0.615 . . . . 0.0 109.669 -177.735 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.414 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 46.2 t -58.92 96.65 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.506 1.123 . . . . 0.0 112.888 -174.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.047 0 CA-C-N 115.571 -0.741 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.6 p . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.392 0.139 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.77 146.42 35.86 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 176.499 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -87.14 162.34 17.58 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.87 0.468 . . . . 0.0 111.089 -170.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -70.39 117.0 11.38 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 102.03 -18.6 51.74 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.517 -173.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.3 t -83.49 162.97 20.75 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.332 0.653 . . . . 0.0 110.382 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.464 ' HA ' ' HG2' ' A' ' 24' ' ' LYS . 58.2 p -78.65 131.78 36.81 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.19 0.596 . . . . 0.0 110.742 -177.038 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 23.4 p -150.84 170.39 19.39 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.108 0.563 . . . . 0.0 111.435 -176.42 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -76.06 -156.19 0.06 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.215 0.606 . . . . 0.0 111.011 -178.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -74.59 -73.63 0.23 Allowed 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 122.465 0.306 . . . . 0.0 111.716 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.5 p -146.26 18.61 1.38 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.975 0.51 . . . . 0.0 112.337 -167.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.6 m -87.88 48.26 1.62 Allowed 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.907 -0.496 . . . . 0.0 111.948 -174.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.3 t80 53.03 38.08 26.38 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.176 1.39 . . . . 0.0 111.772 -178.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.776 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 13.5 m-20 -71.03 -60.14 2.39 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.483 -1.235 . . . . 0.0 112.149 -174.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.8 t -69.4 135.7 50.64 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.6 t -67.58 -37.56 82.8 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.798 0.839 . . . . 0.0 111.2 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.1 t -153.07 83.24 1.2 Allowed 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 122.209 1.004 . . . . 0.0 108.575 173.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 161.13 -173.5 37.58 Favored Glycine 0 C--N 1.341 0.825 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.386 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.4 m -109.51 144.14 38.2 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.374 0.67 . . . . 0.0 110.002 176.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 25' ' ' CYS . 52.0 m -87.47 98.86 11.62 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.735 0.814 . . . . 0.0 110.556 177.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -87.56 107.06 18.41 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.395 1.078 . . . . 0.0 109.437 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.8 t30 46.79 69.65 0.47 Allowed 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 125.051 1.34 . . . . 0.0 112.659 173.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.71 -7.41 58.65 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.616 -1.102 . . . . 0.0 115.221 173.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HG2' ' HA ' ' A' ' 7' ' ' SER . 10.4 mtmp? -145.12 147.9 33.03 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 118.781 1.29 . . . . 0.0 110.195 176.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 20' ' ' CYS . 41.6 t -71.06 108.91 4.83 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 122.114 -0.366 . . . . 0.0 110.329 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 0.473 0 CA-C-N 115.959 -0.564 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 C--O 1.243 0.748 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -74.32 146.58 42.99 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.482 0.713 . . . . 0.0 111.665 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -87.49 165.7 15.33 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.562 0.745 . . . . 0.0 109.196 171.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 25' ' ' CYS . 86.9 tttt -63.67 126.78 28.66 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 123.494 0.496 . . . . 0.0 110.6 -176.068 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 112.19 -40.95 2.36 Favored Glycine 0 C--N 1.342 0.903 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.684 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.9 t -70.42 146.75 50.16 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 122.942 0.497 . . . . 0.0 110.693 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.536 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 34.7 p -76.3 101.92 5.67 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.443 0.64 . . . . 0.0 110.433 -175.338 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 19.1 p -93.53 178.9 5.55 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.814 174.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -73.1 178.96 4.05 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.009 0.524 . . . . 0.0 111.072 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 70.8 mmt-85 -69.28 -67.49 0.47 Allowed 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.908 0.483 . . . . 0.0 111.097 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 71.8 p -131.58 13.11 4.95 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.95 0.5 . . . . 0.0 111.331 -175.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.6 t -82.01 10.52 6.41 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.068 0.547 . . . . 0.0 112.417 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 58.6 34.84 24.16 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.486 1.114 . . . . 0.0 111.644 176.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.53 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 28.2 t70 -74.45 -8.34 55.98 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.224 -177.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 m -64.36 147.31 52.86 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.567 0.747 . . . . 0.0 111.455 166.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 t -90.57 -47.47 7.67 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.2 t -155.04 80.6 1.07 Allowed 'General case' 0 CA--C 1.556 1.186 0 CA-C-O 122.483 1.135 . . . . 0.0 108.465 172.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -174.61 -165.22 30.72 Favored Glycine 0 C--N 1.342 0.895 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.951 -175.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.3 m -126.08 104.9 8.51 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 122.98 0.512 . . . . 0.0 110.479 -177.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.0 m -59.61 115.44 3.32 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 121.122 0.487 . . . . 0.0 110.483 172.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -169.19 137.25 1.91 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.803 1.241 . . . . 0.0 108.414 -167.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 60.97 26.17 16.14 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.359 1.064 . . . . 0.0 111.75 178.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.96 4.13 90.54 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 114.966 -1.016 . . . . 0.0 114.799 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.2 mtmp? -133.67 161.63 34.13 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.421 0.688 . . . . 0.0 110.416 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 4' ' ' LYS . 34.5 t -81.24 82.31 7.16 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.294 0 CA-C-N 116.322 -0.399 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.336 0.112 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.447 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.4 OUTLIER -97.3 155.88 16.68 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.464 0.706 . . . . 0.0 110.746 179.095 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -117.63 -178.68 3.53 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.46 1.104 . . . . 0.0 109.461 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.472 ' HE3' ' HB ' ' A' ' 17' ' ' THR . 34.3 mmtp -54.01 114.96 1.78 Allowed 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.06 0.944 . . . . 0.0 112.954 -172.59 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.21 -23.44 24.28 Favored Glycine 0 C--N 1.349 1.304 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.233 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.4 t -65.24 137.59 57.68 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 123.156 0.582 . . . . 0.0 109.942 178.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 24.3 m -78.94 104.85 9.87 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.989 -167.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.6 p -91.63 -160.62 0.74 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.354 1.061 . . . . 0.0 110.155 175.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -95.33 -164.89 1.21 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.524 0.73 . . . . 0.0 110.851 178.036 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -69.05 -63.27 1.09 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.007 0.523 . . . . 0.0 110.923 177.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.5 t -148.46 21.44 1.05 Allowed 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 122.866 0.466 . . . . 0.0 111.639 -172.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.4 m -68.21 -16.15 63.86 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.068 0.547 . . . . 0.0 111.756 177.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.0 t80 58.43 31.86 21.44 Favored 'General case' 0 C--N 1.358 0.967 0 C-N-CA 125.152 1.381 . . . . 0.0 111.243 -176.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -78.22 0.81 23.69 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.622 175.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 50.3 t -90.98 134.55 34.39 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.234 1.013 . . . . 0.0 109.369 168.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.2 m -77.19 -65.6 0.93 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.006 0.522 . . . . 0.0 110.754 174.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.472 ' HB ' ' HE3' ' A' ' 4' ' ' LYS . 33.3 p -97.45 111.91 23.97 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.69 -0.687 . . . . 0.0 111.443 -170.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.73 -173.31 35.01 Favored Glycine 0 C--N 1.35 1.311 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.226 -177.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 57.2 m -113.02 163.84 14.2 Favored 'General case' 0 C--O 1.243 0.743 0 C-N-CA 123.328 0.651 . . . . 0.0 110.3 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 96.8 m -84.39 101.95 12.39 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.27 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -108.46 125.37 51.7 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 169.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.4 t30 56.98 37.68 28.93 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.181 0.992 . . . . 0.0 110.505 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.26 31.27 78.58 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 114.304 -1.316 . . . . 0.0 113.377 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.452 ' NZ ' ' HB2' ' A' ' 24' ' ' LYS . 9.2 mtmp? -139.09 159.01 43.17 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.174 0.99 . . . . 0.0 109.52 177.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.447 ' SG ' ' HB3' ' A' ' 2' ' ' LYS . 86.0 m -75.27 81.18 2.38 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.313 0 CA-C-N 115.3 -0.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.5 p . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.492 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 73.8 mmtt -56.02 122.94 12.77 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.775 0.83 . . . . 0.0 111.871 -176.747 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -69.05 177.58 2.61 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.983 0.913 . . . . 0.0 111.692 -179.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -70.31 104.08 2.58 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 122.845 0.458 . . . . 0.0 109.998 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.77 10.43 58.93 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.986 -178.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 40.2 t -75.5 149.14 38.49 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 117.135 0.467 . . . . 0.0 110.248 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.1 p -76.89 100.39 5.53 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.363 0.665 . . . . 0.0 111.148 -169.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.0 p -108.46 178.13 4.58 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.556 0.743 . . . . 0.0 110.796 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -77.05 -158.46 0.11 Allowed 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.839 0.856 . . . . 0.0 111.826 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -62.93 -45.26 93.32 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.189 0.595 . . . . 0.0 111.436 177.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 t -158.39 76.53 0.76 Allowed 'General case' 0 CA--C 1.548 0.899 0 CA-C-O 122.376 1.084 . . . . 0.0 108.076 175.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 89.9 p -71.37 -41.0 70.25 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.222 -170.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 66.25 8.72 5.8 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.122 1.369 . . . . 0.0 112.213 -167.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -80.47 -18.09 49.71 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.569 0.748 . . . . 0.0 109.356 176.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.492 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 61.7 m -50.65 111.31 0.52 Allowed 'General case' 0 C--N 1.355 0.83 0 C-N-CA 124.539 1.136 . . . . 0.0 111.102 174.171 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.64 -39.01 61.33 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.966 1.306 . . . . 0.0 110.784 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.4 t -155.89 116.03 3.7 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 114.633 -1.167 . . . . 0.0 107.927 166.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.77 -173.74 22.2 Favored Glycine 0 C--N 1.352 1.445 0 N-CA-C 114.003 0.361 . . . . 0.0 114.003 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.4 m -134.49 150.03 50.76 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.061 0.944 . . . . 0.0 110.481 -178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 95.5 m -74.7 85.69 2.14 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.395 0.678 . . . . 0.0 112.021 -177.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -111.73 129.78 56.0 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 124.804 1.242 . . . . 0.0 108.68 174.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 60.0 t30 62.5 30.91 17.23 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 122.466 1.127 . . . . 0.0 110.351 -176.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.43 20.24 69.47 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-N 114.328 -1.306 . . . . 0.0 114.465 -178.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -138.42 158.96 43.27 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.716 0.806 . . . . 0.0 109.551 178.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 82.8 m -77.65 71.04 4.11 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 121.62 0.724 . . . . 0.0 110.044 179.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.51 0 CA-C-N 115.404 -0.816 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.1 p . . . . . 0 N--CA 1.475 0.814 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 6' ' ' SER . 13.0 mptt -76.11 142.89 41.55 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.237 0.615 . . . . 0.0 111.656 -174.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -89.43 176.85 6.75 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.33 0.652 . . . . 0.0 110.552 177.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.97 118.65 10.07 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.422 0.689 . . . . 0.0 110.867 -174.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.89 -3.58 55.86 Favored Glycine 0 C--N 1.338 0.642 0 CA-C-N 115.545 -0.752 . . . . 0.0 113.41 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.459 ' HB3' ' HB3' ' A' ' 2' ' ' LYS . 34.9 t -82.44 176.19 9.61 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.008 0.523 . . . . 0.0 110.449 174.512 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.2 m -108.39 138.9 43.9 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.297 0.639 . . . . 0.0 111.411 -173.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.6 p -135.9 -156.38 0.71 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -110.43 -175.62 2.77 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 166.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -54.6 -47.56 73.24 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.337 0.655 . . . . 0.0 112.332 -170.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 p -141.56 66.12 1.36 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.832 0.853 . . . . 0.0 109.897 177.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.1 m -79.1 -29.24 43.17 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.907 171.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 60.9 16.3 6.78 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 125.009 1.324 . . . . 0.0 111.47 -174.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -92.63 -5.58 51.19 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 122.843 0.457 . . . . 0.0 111.218 -173.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 73.9 m -64.27 106.86 1.18 Allowed 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 169.121 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -51.69 -61.68 2.1 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.181 1.392 . . . . 0.0 111.753 -171.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.8 p -123.28 89.07 3.03 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 170.479 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.51 174.55 28.36 Favored Glycine 0 C--N 1.337 0.636 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.697 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.0 m -110.0 153.42 24.61 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.42 0.688 . . . . 0.0 109.39 176.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.0 m -74.63 79.25 2.0 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.43 0.633 . . . . 0.0 109.538 172.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -73.49 101.42 3.53 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.229 1.412 . . . . 0.0 108.716 -176.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.1 t30 55.76 36.04 26.49 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.59 1.156 . . . . 0.0 111.55 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.07 5.85 65.56 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 115.244 -0.889 . . . . 0.0 114.629 175.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.7 mtmp? -138.44 145.29 40.74 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 117.895 0.848 . . . . 0.0 110.111 172.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.9 m -59.3 108.94 0.77 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.686 0.794 . . . . 0.0 111.512 -179.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.234 0 CA-C-N 116.048 -0.524 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.7 p . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.698 0.285 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.522 ' HD3' ' HB3' ' A' ' 14' ' ' ASP . 13.5 mptt -98.9 152.7 19.47 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.044 0.537 . . . . 0.0 109.894 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -97.13 152.64 18.59 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.358 177.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HB2' HG23 ' A' ' 17' ' ' THR . 0.4 OUTLIER -63.82 126.64 28.29 Favored 'General case' 0 C--O 1.244 0.772 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 171.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.02 -22.48 33.25 Favored Glycine 0 C--N 1.337 0.637 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.903 -176.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 t -78.84 178.62 7.8 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.243 0.617 . . . . 0.0 109.454 173.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 22.0 p -97.26 136.1 38.23 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.956 0.502 . . . . 0.0 110.717 176.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.669 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 30.7 p -147.95 148.43 30.77 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.853 0.461 . . . . 0.0 110.126 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -73.75 146.15 44.57 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.504 0.722 . . . . 0.0 111.196 -173.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.616 ' HG2' HG23 ' A' ' 11' ' ' THR . 54.5 ttp180 -35.46 -61.25 0.46 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 126.91 2.084 . . . . 0.0 115.521 -166.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.616 HG23 ' HG2' ' A' ' 10' ' ' ARG . 19.4 p -133.73 28.68 3.9 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 120.892 0.377 . . . . 0.0 110.996 -175.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.7 m -86.61 4.05 41.91 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.394 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 60.15 23.32 12.61 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 124.857 1.263 . . . . 0.0 112.49 176.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.639 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 83.6 m-20 -61.35 -36.26 79.71 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -169.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.669 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 99.6 m -75.86 152.49 37.19 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.6 m -89.33 -23.63 22.2 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.248 165.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.435 HG23 ' HB2' ' A' ' 4' ' ' LYS . 11.5 t -156.4 147.05 21.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.891 0.876 . . . . 0.0 108.79 172.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.16 141.22 11.9 Favored Glycine 0 C--N 1.343 0.952 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -176.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.6 m -83.6 126.36 32.75 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 94.0 m -71.58 76.88 0.81 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 121.844 0.83 . . . . 0.0 110.749 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.2 ttt180 -117.19 133.4 56.03 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 124.56 1.144 . . . . 0.0 108.382 -174.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 64.9 t30 62.18 35.91 15.28 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 124.538 1.135 . . . . 0.0 110.152 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.15 13.11 64.13 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 114.455 -1.248 . . . . 0.0 114.196 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.5 mtmp? -136.86 160.41 38.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.683 0.793 . . . . 0.0 111.182 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t . . . . . 0 CA--C 1.547 0.857 0 C-N-CA 124.121 0.969 . . . . 0.0 110.055 -173.971 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.0 p . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.627 ' HG2' ' HB3' ' A' ' 8' ' ' CYS . 5.6 mptp? -65.21 119.34 10.7 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.528 0.731 . . . . 0.0 112.923 -173.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -78.78 159.68 27.77 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.726 0.81 . . . . 0.0 109.995 171.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -62.67 123.79 19.32 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.692 0.397 . . . . 0.0 110.699 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.89 -27.56 10.22 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.595 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.4 t -75.69 148.84 38.32 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.116 0.566 . . . . 0.0 110.241 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 62.3 p -77.94 134.94 37.79 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 120.897 0.379 . . . . 0.0 110.249 -176.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.627 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 14.8 p -145.69 165.25 29.3 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.786 0.834 . . . . 0.0 109.893 -179.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.75 153.18 44.27 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 173.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -50.49 -45.15 56.17 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.432 1.093 . . . . 0.0 112.665 -172.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -126.56 48.68 2.12 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.061 0.944 . . . . 0.0 109.271 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.0 p -55.16 -40.35 70.53 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.881 0.873 . . . . 0.0 112.229 -176.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.9 t80 65.55 9.78 6.13 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 125.221 1.409 . . . . 0.0 111.638 -174.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -93.16 -14.42 27.21 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.445 1.098 . . . . 0.0 109.592 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.0 t -62.88 108.55 1.22 Allowed 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.007 -178.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.4 t -50.83 -45.95 59.79 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 126.328 1.851 . . . . 0.0 113.255 -168.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.3 t -158.91 39.66 0.22 Allowed 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.074 0.94 . . . . 0.0 109.451 -174.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -150.77 174.51 30.06 Favored Glycine 0 C--N 1.339 0.699 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.48 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 36.9 m -112.74 133.93 54.52 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 174.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.9 m -72.3 84.16 1.06 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.744 0.783 . . . . 0.0 110.553 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.8 mtt180 -100.77 132.71 46.03 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.112 1.365 . . . . 0.0 109.327 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 61.7 25.21 15.15 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.207 1.003 . . . . 0.0 111.534 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.54 2.79 81.9 Favored Glycine 0 CA--C 1.538 1.521 0 CA-C-N 115.565 -0.743 . . . . 0.0 114.685 178.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -139.45 159.71 41.52 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-N 118.154 0.977 . . . . 0.0 109.761 174.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.584 ' SG ' ' HB3' ' A' ' 2' ' ' LYS . 49.5 m . . . . . 0 N--CA 1.478 0.956 0 C-N-CA 123.178 0.591 . . . . 0.0 111.721 176.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.7 p . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' A' ' 7' ' ' SER . 2.3 mptm? -69.51 137.27 52.38 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.248 0.619 . . . . 0.0 111.974 -174.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 71.7 mtp180 -90.12 177.66 6.38 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.742 0.817 . . . . 0.0 110.074 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.0 125.94 16.91 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.371 1.068 . . . . 0.0 111.222 179.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.27 -23.07 33.44 Favored Glycine 0 C--N 1.348 1.216 0 O-C-N 123.396 0.435 . . . . 0.0 113.626 178.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.1 t -85.41 165.72 16.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.157 0.583 . . . . 0.0 111.056 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 2' ' ' LYS . 37.3 p -79.34 104.86 10.25 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 123.944 0.898 . . . . 0.0 113.101 -166.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.6 p -119.39 153.31 35.39 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.45 0.7 . . . . 0.0 110.617 176.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.1 mmt-85 -74.66 -177.26 3.12 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 122.574 0.35 . . . . 0.0 110.439 -174.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -50.47 -66.88 0.31 Allowed 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.349 1.059 . . . . 0.0 113.077 -173.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.3 p -140.84 24.57 2.19 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.424 0.69 . . . . 0.0 110.481 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.3 p -64.64 -20.98 66.6 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.646 1.178 . . . . 0.0 113.853 -173.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER 65.86 26.05 11.16 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.849 1.26 . . . . 0.0 110.633 -169.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.27 -31.73 72.95 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 124.093 0.957 . . . . 0.0 109.666 169.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.564 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 5.4 t -67.62 125.75 27.19 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.967 171.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 t -69.06 -36.48 77.72 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.301 1.041 . . . . 0.0 111.3 -170.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 t -160.65 80.48 0.65 Allowed 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.506 0.722 . . . . 0.0 109.834 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 167.2 158.52 11.6 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.153 -0.931 . . . . 0.0 112.616 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.4 m -86.28 138.95 31.45 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.236 0.614 . . . . 0.0 109.737 175.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.564 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 83.8 m -93.94 132.74 38.09 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 123.238 0.615 . . . . 0.0 111.612 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.4 ttm-85 -141.94 137.48 31.3 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.373 1.069 . . . . 0.0 109.089 174.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.9 t30 58.89 39.43 23.84 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-O 122.582 1.182 . . . . 0.0 110.782 175.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.84 8.25 81.97 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 114.329 -1.305 . . . . 0.0 114.857 175.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -139.03 158.81 43.52 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 118.122 0.961 . . . . 0.0 111.433 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 66.0 m . . . . . 0 N--CA 1.474 0.774 0 C-N-CA 124.256 1.022 . . . . 0.0 110.702 174.142 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.9 p . . . . . 0 N--CA 1.485 1.313 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -119.5 157.64 27.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.048 0.539 . . . . 0.0 110.16 174.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -94.1 155.26 17.18 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.746 0.819 . . . . 0.0 109.656 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.421 ' HB2' HG23 ' A' ' 17' ' ' THR . 0.2 OUTLIER -63.16 111.07 2.06 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 172.751 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 126.89 -27.42 4.88 Favored Glycine 0 C--N 1.342 0.909 0 O-C-N 123.455 0.472 . . . . 0.0 112.642 -176.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 t -74.11 -174.99 2.07 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.63 0.772 . . . . 0.0 111.763 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.46 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 49.2 m -101.93 133.14 47.19 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.099 0.559 . . . . 0.0 109.655 173.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.57 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 27.2 p -155.23 150.37 26.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.44 0.696 . . . . 0.0 110.294 -176.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -70.81 140.72 51.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.513 0.325 . . . . 0.0 110.859 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.676 ' HG2' HG23 ' A' ' 11' ' ' THR . 44.3 ttp180 -34.21 -53.23 0.49 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 127.155 2.182 . . . . 0.0 115.939 -169.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.676 HG23 ' HG2' ' A' ' 10' ' ' ARG . 24.6 p -137.74 28.12 2.69 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 120.926 0.393 . . . . 0.0 111.716 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.442 ' OG ' ' HB2' ' A' ' 14' ' ' ASP . 27.4 p -77.39 -6.45 53.42 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.624 0.602 . . . . 0.0 112.624 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 62.44 29.17 17.11 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.983 0.913 . . . . 0.0 110.217 -173.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.57 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 45.4 t0 -69.77 -29.67 67.06 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.634 1.174 . . . . 0.0 111.281 -172.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.567 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 71.7 m -84.78 152.74 23.45 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.516 0.726 . . . . 0.0 111.466 176.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 72.0 m -84.97 -28.36 25.86 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.862 165.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.421 HG23 ' HB2' ' A' ' 4' ' ' LYS . 10.0 t -151.96 152.52 32.6 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.165 0.586 . . . . 0.0 110.158 175.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.66 164.45 36.9 Favored Glycine 0 C--N 1.346 1.118 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.076 -174.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.5 m -107.58 122.55 46.9 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 122.745 0.418 . . . . 0.0 109.9 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.436 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 85.6 m -69.26 87.75 0.43 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.268 0.556 . . . . 0.0 110.532 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -120.01 136.85 54.4 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.965 0.906 . . . . 0.0 109.732 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 59.27 32.01 21.62 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.568 1.147 . . . . 0.0 111.582 -176.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.32 8.57 87.03 Favored Glycine 0 C--N 1.343 0.926 0 CA-C-N 115.064 -0.971 . . . . 0.0 114.707 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.3 mtmp? -136.07 147.0 47.66 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.56 0.695 . . . . 0.0 111.717 178.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.0 t . . . . . 0 CA--C 1.547 0.85 0 C-N-CA 125.014 1.326 . . . . 0.0 110.737 177.707 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.0 p . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -105.57 153.27 22.0 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.5 0.72 . . . . 0.0 110.606 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -70.99 166.97 20.18 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.481 0.713 . . . . 0.0 111.236 178.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -66.28 118.99 10.75 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 174.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.22 -0.52 63.99 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 123.026 0.346 . . . . 0.0 112.832 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.0 t -92.12 152.3 19.98 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.102 0.561 . . . . 0.0 110.097 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.8 m -79.25 120.87 24.34 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.864 0.466 . . . . 0.0 111.108 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.562 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 9.8 p -109.5 -92.39 0.44 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.745 0.818 . . . . 0.0 109.557 178.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 177.09 131.3 0.05 Allowed 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -43.72 -37.56 2.73 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 115.761 1.763 . . . . 0.0 115.761 -165.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.2 p -124.87 6.46 8.05 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.918 0.711 . . . . 0.0 112.918 -176.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.2 m -78.37 -24.09 46.57 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 119.346 -0.359 . . . . 0.0 111.921 174.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.6 t80 53.32 39.04 29.21 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.226 1.01 . . . . 0.0 111.079 -174.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -88.14 36.77 0.79 Allowed 'General case' 0 CA--C 1.554 1.119 0 CA-C-O 122.117 0.961 . . . . 0.0 111.184 -169.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.562 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 61.0 m -107.85 134.41 50.83 Favored 'General case' 0 C--N 1.348 0.507 0 C-N-CA 124.126 0.971 . . . . 0.0 109.127 177.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -37.44 83.12 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.533 0.733 . . . . 0.0 110.591 173.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.7 t -141.9 144.12 33.65 Favored 'General case' 0 C--O 1.243 0.741 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 167.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.54 162.34 30.26 Favored Glycine 0 C--N 1.338 0.689 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.989 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.3 m -94.95 145.43 24.93 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.076 0.95 . . . . 0.0 109.714 177.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 62.7 m -74.11 76.06 1.75 Allowed 'General case' 0 CA--C 1.549 0.92 0 CA-C-O 122.07 0.938 . . . . 0.0 110.957 175.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.1 mtp180 -84.26 112.86 20.68 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 124.627 1.171 . . . . 0.0 109.28 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.7 t30 58.99 40.54 22.22 Favored 'General case' 0 CA--C 1.557 1.23 0 CA-C-O 122.576 1.179 . . . . 0.0 109.894 178.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.83 -13.78 61.96 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 114.658 -1.155 . . . . 0.0 114.397 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -126.79 154.2 44.58 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 117.952 0.876 . . . . 0.0 111.25 -171.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.5 m . . . . . 0 CA--C 1.547 0.863 0 C-N-CA 124.193 0.997 . . . . 0.0 111.098 -175.446 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 14' ' ' ASP . 14.6 p . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.675 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 47.5 mmtm -80.28 126.77 31.56 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 118.272 0.487 . . . . 0.0 110.304 -171.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 172.13 9.27 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 175.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -66.81 118.0 9.71 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.089 0.471 . . . . 0.0 110.329 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 107.62 -14.05 38.76 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 115.279 -0.873 . . . . 0.0 113.016 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.0 t -72.97 152.75 41.24 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.102 0.561 . . . . 0.0 111.106 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.557 ' HA ' ' HG2' ' A' ' 24' ' ' LYS . 31.8 m -80.18 140.41 36.34 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 122.953 0.501 . . . . 0.0 110.12 177.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.462 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 6.3 p -149.2 -177.19 5.69 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.705 0.802 . . . . 0.0 110.124 178.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.499 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 49.0 ttp85 -84.53 173.46 10.8 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 168.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.499 ' H ' ' HG2' ' A' ' 9' ' ' ARG . 57.8 ttp180 -49.82 -34.0 18.4 Favored 'General case' 0 N--CA 1.5 2.055 0 C-N-CA 123.999 0.919 . . . . 0.0 112.106 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.4 t -155.14 96.04 1.78 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-O 121.895 0.855 . . . . 0.0 108.866 163.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.6 p -82.66 -12.52 57.57 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.001 -0.999 . . . . 0.0 111.696 176.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 70.9 -22.78 0.18 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 126.038 1.735 . . . . 0.0 114.278 177.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 1' ' ' CYS . 3.7 p-10 -86.83 2.77 47.88 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 118.339 0.518 . . . . 0.0 111.03 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.675 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 42.4 t -64.1 97.32 0.17 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.1 m -60.22 -34.94 74.36 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.078 0.951 . . . . 0.0 112.737 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.4 t -148.58 138.01 21.93 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 120.755 0.312 . . . . 0.0 110.415 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.3 164.42 40.25 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.605 -173.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 60.7 m -104.75 148.04 27.04 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.5 m -75.65 71.51 2.54 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.823 0.82 . . . . 0.0 112.373 -176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -84.06 124.92 31.6 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.965 1.306 . . . . 0.0 109.055 178.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 59.66 32.87 21.75 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.347 1.07 . . . . 0.0 109.335 -173.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.38 36.09 92.6 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 113.816 -1.538 . . . . 0.0 113.308 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.557 ' HG2' ' HA ' ' A' ' 7' ' ' SER . 36.2 mtmm -148.0 140.07 24.13 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.522 0.729 . . . . 0.0 110.19 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 84.6 m . . . . . 0 CA--C 1.546 0.794 0 C-N-CA 123.094 0.558 . . . . 0.0 110.913 -178.377 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 28.5 p . . . . . 0 N--CA 1.484 1.239 0 CA-C-O 120.693 0.282 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.404 ' HG2' ' HB3' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -96.68 129.01 44.16 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.787 0.835 . . . . 0.0 110.671 -176.307 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -82.98 178.68 8.04 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.077 1.351 . . . . 0.0 111.439 177.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -66.19 100.25 0.6 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.799 0.84 . . . . 0.0 110.353 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 113.09 -17.01 22.44 Favored Glycine 0 C--N 1.343 0.946 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.367 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 45.6 t -69.8 143.01 53.07 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.256 0.622 . . . . 0.0 110.558 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.494 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 21.4 p -78.01 117.04 18.94 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.016 0.526 . . . . 0.0 111.347 -173.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.404 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 25.5 p -115.56 -163.86 0.91 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.015 0.926 . . . . 0.0 109.576 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.03 -164.21 1.14 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.298 0.639 . . . . 0.0 109.908 172.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -62.02 -62.22 1.94 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.721 0.808 . . . . 0.0 112.329 -175.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.7 p -144.76 22.41 1.61 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.864 0.866 . . . . 0.0 109.824 -175.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.0 m -76.78 13.58 1.0 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -168.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 64.04 18.21 11.09 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.254 1.022 . . . . 0.0 112.893 171.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -60.26 -28.99 68.5 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.383 0.673 . . . . 0.0 111.483 -177.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.6 m -58.62 133.07 55.55 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.773 1.229 . . . . 0.0 113.025 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -72.72 -28.7 62.82 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.421 0.689 . . . . 0.0 109.855 164.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.0 t -155.19 145.56 21.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.745 0.818 . . . . 0.0 109.705 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 83.65 -168.99 46.44 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 116.264 -0.425 . . . . 0.0 112.552 -175.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.427 ' HB3' HH12 ' A' ' 21' ' ' ARG . 25.8 t -134.95 152.8 52.06 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.331 0.652 . . . . 0.0 109.816 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.2 m -72.49 114.96 11.18 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.386 0.675 . . . . 0.0 112.675 -173.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.427 HH12 ' HB3' ' A' ' 19' ' ' SER . 63.0 mmt-85 -102.26 105.25 15.86 Favored 'General case' 0 C--O 1.245 0.823 0 C-N-CA 124.459 1.104 . . . . 0.0 109.864 170.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.1 t30 50.55 70.38 0.52 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.783 1.233 . . . . 0.0 112.006 171.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.36 7.78 34.55 Favored Glycine 0 CA--C 1.539 1.576 0 N-CA-C 114.69 0.636 . . . . 0.0 114.69 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 8.5 mtmp? -131.94 161.0 34.14 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.494 1.118 . . . . 0.0 108.37 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 48.5 t . . . . . 0 N--CA 1.476 0.825 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -178.128 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 52.2 t . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.599 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 73.8 mmtt -127.2 141.83 51.64 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.492 0.717 . . . . 0.0 110.095 177.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -120.61 173.51 7.14 Favored 'General case' 0 C--O 1.245 0.836 0 C-N-CA 124.438 1.095 . . . . 0.0 108.755 173.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -64.04 113.52 3.55 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.187 0.595 . . . . 0.0 111.046 -178.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 121.65 -29.23 5.7 Favored Glycine 0 C--N 1.339 0.748 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.737 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.0 t -77.35 137.16 38.58 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.95 0.5 . . . . 0.0 111.002 -175.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.6 p -79.21 126.86 31.31 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.256 0.622 . . . . 0.0 111.387 -175.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 25' ' ' CYS . 8.0 p -152.66 155.3 37.02 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.378 0.671 . . . . 0.0 110.848 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -70.34 144.42 51.67 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.1 ttp180 -43.23 -43.11 4.6 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 125.111 1.364 . . . . 0.0 114.145 -164.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.3 p -133.5 75.14 1.59 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.589 0.709 . . . . 0.0 109.741 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.4 m -88.12 -11.97 45.42 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.709 172.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.3 t80 61.06 19.28 9.79 Favored 'General case' 0 CA--C 1.559 1.296 0 C-N-CA 124.622 1.169 . . . . 0.0 112.244 -174.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -96.98 -15.7 20.97 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.569 -174.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 52.4 m -64.78 110.17 2.3 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.129 0.571 . . . . 0.0 111.278 176.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 79.4 m -74.97 -46.89 32.36 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.351 0.661 . . . . 0.0 110.034 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.2 p -130.6 101.14 5.57 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.842 0.857 . . . . 0.0 108.916 175.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 125.94 -166.27 18.77 Favored Glycine 0 C--N 1.348 1.235 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.869 -177.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 63.1 m -146.88 143.32 28.46 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.176 0.991 . . . . 0.0 108.956 174.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 61.7 m -73.13 99.4 2.8 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.292 0.637 . . . . 0.0 110.446 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -111.98 128.39 56.15 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.914 0.486 . . . . 0.0 110.288 177.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 58.98 26.21 14.76 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 125.652 1.581 . . . . 0.0 112.073 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 100.42 -0.9 55.77 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-N 115.007 -0.997 . . . . 0.0 115.021 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -138.49 144.38 40.0 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 118.901 1.351 . . . . 0.0 110.876 176.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 10.8 t . . . . . 0 N--CA 1.475 0.82 0 C-N-CA 124.409 1.084 . . . . 0.0 110.898 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.4 p . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.426 ' HE3' ' N ' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -71.18 139.41 50.16 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 123.314 0.384 . . . . 0.0 111.131 -178.191 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -82.18 173.23 12.31 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.497 0.719 . . . . 0.0 110.394 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.439 ' NZ ' ' HB2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -67.0 124.57 23.4 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-O 120.836 0.351 . . . . 0.0 110.574 -178.365 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.481 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . 96.18 -17.35 59.44 Favored Glycine 0 C--N 1.352 1.451 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.653 -172.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.7 t -79.28 149.2 31.88 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.256 0.622 . . . . 0.0 111.125 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.7 m -79.03 101.1 7.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.51 0.724 . . . . 0.0 111.323 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 20.1 p -107.31 148.22 29.28 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.964 0.905 . . . . 0.0 110.31 177.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.433 ' HB3' ' OG ' ' A' ' 12' ' ' SER . 44.6 ttt180 -59.97 131.29 50.39 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 122.787 0.435 . . . . 0.0 110.086 -179.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.405 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 73.9 ttt180 -50.34 -40.85 50.26 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 115.668 1.729 . . . . 0.0 115.668 -153.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.3 p -135.46 14.22 3.47 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.433 ' OG ' ' HB3' ' A' ' 9' ' ' ARG . 81.0 p -83.55 -12.92 55.57 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.134 0.573 . . . . 0.0 110.842 175.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 61.93 40.02 12.91 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 124.793 1.237 . . . . 0.0 110.329 -176.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -70.64 -4.23 22.39 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 113.505 -1.679 . . . . 0.0 112.006 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.509 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 11.5 t -85.47 164.86 17.59 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.788 0.835 . . . . 0.0 110.9 176.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.78 -21.59 16.28 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.462 1.105 . . . . 0.0 110.015 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.0 t -153.92 143.82 21.9 Favored 'General case' 0 C--N 1.353 0.735 0 C-N-CA 123.609 0.764 . . . . 0.0 109.735 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.3 -162.53 49.68 Favored Glycine 0 C--N 1.337 0.628 0 CA-C-N 116.586 -0.279 . . . . 0.0 112.63 -177.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.0 t -119.74 158.29 26.82 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.816 0.846 . . . . 0.0 109.18 176.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 96.7 m -84.42 69.06 10.47 Favored 'General case' 0 CA--C 1.558 1.256 0 CA-C-O 121.678 0.751 . . . . 0.0 111.195 -177.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -68.07 115.39 7.51 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.237 1.415 . . . . 0.0 109.654 177.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 60.85 28.09 17.87 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 122.383 1.087 . . . . 0.0 110.218 -178.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.49 28.9 66.76 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 114.523 -1.217 . . . . 0.0 113.643 -176.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -141.15 158.8 43.42 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.809 0.844 . . . . 0.0 110.216 173.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.481 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 76.5 m . . . . . 0 CA--C 1.542 0.668 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.404 -175.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.9 p . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.703 0.287 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.638 ' HG3' ' HA ' ' A' ' 8' ' ' CYS . 74.7 mmtt -93.4 155.5 17.33 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-O 120.683 0.277 . . . . 0.0 110.271 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -107.25 170.67 7.82 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.029 0.532 . . . . 0.0 109.672 -177.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -63.41 128.64 36.77 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.109 0.564 . . . . 0.0 110.747 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.8 -9.32 77.62 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.327 -177.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.1 t -94.3 148.88 21.77 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.333 0.653 . . . . 0.0 110.043 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.9 p -79.35 108.07 12.59 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.322 0.649 . . . . 0.0 110.58 -176.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.638 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 2.9 p -89.39 -97.62 0.1 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.541 0.736 . . . . 0.0 109.869 178.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.6 ttt180 175.46 142.57 0.06 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.674 1.19 . . . . 0.0 108.073 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -29.13 -66.26 0.09 Allowed 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 127.043 2.137 . . . . 0.0 115.697 -162.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.7 p -129.55 18.32 5.79 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.767 0.827 . . . . 0.0 111.405 -174.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.9 m -71.84 -35.31 69.82 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.066 0.546 . . . . 0.0 112.446 -176.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.6 t80 55.7 32.82 20.12 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.8 1.24 . . . . 0.0 112.36 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -70.59 -14.71 62.6 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.723 168.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.6 t -66.71 130.19 42.34 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.673 0.789 . . . . 0.0 109.892 171.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.97 -37.66 85.61 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.543 0.527 . . . . 0.0 111.703 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.4 t -154.39 140.52 18.45 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 122.73 0.412 . . . . 0.0 110.158 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.67 140.26 10.88 Favored Glycine 0 C--N 1.343 0.966 0 C-N-CA 123.247 0.451 . . . . 0.0 112.2 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.2 m -80.12 127.32 32.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 122.98 0.512 . . . . 0.0 109.845 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.1 m -68.69 80.04 0.28 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.902 0.881 . . . . 0.0 112.694 -177.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -84.43 125.27 32.19 Favored 'General case' 0 C--O 1.243 0.752 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.5 t30 59.26 29.92 19.57 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.048 0.939 . . . . 0.0 110.184 -174.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.93 32.69 77.81 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.515 -175.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.45 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -145.78 133.12 20.63 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -176.734 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 CA--C 1.549 0.91 0 C-N-CA 124.175 0.99 . . . . 0.0 111.969 -177.148 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 120.304 0.097 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.408 ' H ' ' HA ' ' A' ' 15' ' ' CYS . 45.9 mmtm -118.45 166.53 12.57 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 121.459 0.647 . . . . 0.0 111.308 -178.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -120.97 169.44 10.47 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.911 174.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.39 139.23 43.88 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 122.68 0.392 . . . . 0.0 110.931 175.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.38 -0.3 89.15 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-N 116.211 -0.45 . . . . 0.0 113.78 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t -88.82 -173.43 4.1 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 117.568 0.684 . . . . 0.0 109.673 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 79.6 p -113.1 118.49 34.89 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.586 0.755 . . . . 0.0 109.034 174.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.9 p -124.88 174.88 7.65 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 122.741 0.416 . . . . 0.0 111.511 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.494 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 4.7 mpt_? -76.53 169.79 17.6 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.851 0.861 . . . . 0.0 110.01 176.11 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -55.73 -57.47 11.87 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.84 0.856 . . . . 0.0 113.14 -171.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -157.41 26.68 0.29 Allowed 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.248 0.547 . . . . 0.0 110.15 -178.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -78.0 10.05 3.18 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 124.235 1.014 . . . . 0.0 112.12 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 62.6 30.57 17.02 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.64 1.176 . . . . 0.0 111.011 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -67.79 -21.13 65.26 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.851 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 75.0 m -92.64 146.01 23.99 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 121.904 -0.498 . . . . 0.0 111.036 174.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.8 m -86.19 -50.8 6.71 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 166.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.4 p -127.32 112.11 14.67 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.232 1.013 . . . . 0.0 109.398 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.96 137.64 4.35 Favored Glycine 0 C--N 1.35 1.334 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -177.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.437 ' HB2' ' NH1' ' A' ' 21' ' ' ARG . 25.4 m -89.56 131.5 35.55 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 117.374 0.587 . . . . 0.0 109.511 177.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.1 m -79.31 115.08 18.74 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -173.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.437 ' NH1' ' HB2' ' A' ' 19' ' ' SER . 7.9 mpt_? -103.36 -168.44 1.51 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.223 1.009 . . . . 0.0 109.549 172.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -52.15 99.08 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.743 1.217 . . . . 0.0 112.481 -177.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.35 0.62 47.25 Favored Glycine 0 C--N 1.356 1.661 0 CA-C-N 115.161 -0.927 . . . . 0.0 114.581 175.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.9 mtmp? -136.94 155.73 49.37 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-N 117.463 0.632 . . . . 0.0 111.816 -168.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.1 t . . . . . 0 N--CA 1.467 0.396 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 170.762 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.478 0.973 0 CA-C-O 120.704 0.288 . . . . 0.0 110.62 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.471 ' HD3' ' HB3' ' A' ' 14' ' ' ASP . 4.4 mptp? -83.89 129.07 34.94 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.245 0.618 . . . . 0.0 110.384 -177.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.94 177.85 7.81 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.21 0.604 . . . . 0.0 109.506 177.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -59.21 115.77 3.43 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.155 0.582 . . . . 0.0 111.1 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.33 -20.98 36.34 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-O 119.838 -0.423 . . . . 0.0 113.268 -178.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.1 t -76.5 153.18 35.74 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.924 0.49 . . . . 0.0 110.886 178.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 30.5 p -79.13 103.45 9.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.533 0.733 . . . . 0.0 111.678 -174.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.476 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 30.1 p -114.9 131.56 56.83 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.656 0.782 . . . . 0.0 109.857 177.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.671 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 96.5 mtt180 -58.21 139.75 54.38 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.048 0.539 . . . . 0.0 111.784 -174.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.2 ttp-105 -39.43 -46.76 1.71 Allowed 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 126.634 1.974 . . . . 0.0 115.126 -162.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -139.03 7.35 2.44 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.812 0.445 . . . . 0.0 111.377 -176.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.671 ' HB3' ' HB2' ' A' ' 9' ' ' ARG . 47.4 t -80.77 -0.65 39.54 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.49 0.716 . . . . 0.0 111.502 179.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.0 t80 59.83 34.37 21.82 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.886 1.274 . . . . 0.0 112.727 170.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.471 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 7.2 m-20 -68.09 -17.1 64.28 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.309 0.644 . . . . 0.0 112.192 176.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.467 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 4.8 t -72.65 150.69 42.79 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 123.351 0.66 . . . . 0.0 110.269 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.6 m -64.88 -42.78 94.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.769 0.828 . . . . 0.0 109.719 176.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.5 t -172.01 148.98 2.33 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.89 1.276 . . . . 0.0 108.716 167.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 125.11 -171.92 17.14 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-N 116.432 -0.349 . . . . 0.0 112.639 -178.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.6 m -101.97 114.63 28.91 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.659 0.783 . . . . 0.0 110.257 -175.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 94.9 m -76.19 74.67 3.02 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.233 0.613 . . . . 0.0 110.53 175.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -89.27 128.33 35.85 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.2 t30 55.29 31.17 16.08 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.508 1.123 . . . . 0.0 110.316 -175.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.13 40.61 92.77 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 114.375 -1.284 . . . . 0.0 113.871 -176.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -151.37 141.17 21.88 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 117.288 0.544 . . . . 0.0 109.661 179.722 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.476 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 88.8 m . . . . . 0 N--CA 1.483 1.218 0 C-N-CA 124.238 1.015 . . . . 0.0 111.696 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.3 p . . . . . 0 N--CA 1.475 0.796 0 CA-C-O 121.49 0.662 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.477 ' HG3' ' HB3' ' A' ' 8' ' ' CYS . 43.7 mmtm -91.85 154.09 19.12 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.457 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -107.01 177.96 4.7 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -67.8 106.89 2.41 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 125.72 -19.26 6.62 Favored Glycine 0 C--N 1.337 0.585 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.13 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.2 t -91.71 152.09 20.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.676 0.79 . . . . 0.0 110.755 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.43 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 72.4 p -77.36 136.64 38.46 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.389 0.676 . . . . 0.0 110.052 -178.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.487 ' SG ' ' HB2' ' A' ' 25' ' ' CYS . 7.5 p -154.48 163.17 40.6 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.932 0.493 . . . . 0.0 112.013 -171.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -64.0 136.26 57.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.824 0.85 . . . . 0.0 109.985 173.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.495 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 30.4 ttp-105 -52.06 -58.34 6.84 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 124.762 1.289 . . . . 0.0 113.378 -166.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.4 p -132.46 18.32 4.37 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.567 -0.708 . . . . 0.0 111.827 -178.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.4 t -87.76 11.33 15.66 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.998 0.519 . . . . 0.0 111.419 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 59.01 35.67 24.11 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.24 1.016 . . . . 0.0 112.129 176.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -72.62 -30.86 64.69 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.319 177.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.2 t -80.86 139.74 35.78 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 166.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.64 -48.69 76.23 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.517 0.727 . . . . 0.0 112.471 -172.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.0 t -146.62 31.0 0.98 Allowed 'General case' 0 N--CA 1.486 1.333 0 CA-C-O 122.15 0.976 . . . . 0.0 112.017 -171.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.416 ' HA3' ' SG ' ' A' ' 25' ' ' CYS . . . -140.6 150.7 21.85 Favored Glycine 0 N--CA 1.469 0.867 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.656 -179.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.0 m -82.37 124.37 29.95 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.185 0.594 . . . . 0.0 110.963 -179.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 98.6 m -90.25 119.44 30.56 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.658 0.783 . . . . 0.0 110.767 -178.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -141.59 155.18 45.76 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 173.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 60.39 22.81 12.37 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.733 0.813 . . . . 0.0 110.574 -170.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.24 32.22 83.11 Favored Glycine 0 C--N 1.342 0.869 0 CA-C-N 115.163 -0.926 . . . . 0.0 114.122 -172.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 1.0 OUTLIER -154.48 139.71 17.55 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 117.655 0.727 . . . . 0.0 110.667 -179.0 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.487 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 43.7 t . . . . . 0 N--CA 1.472 0.664 0 C-N-CA 124.222 1.009 . . . . 0.0 109.742 -179.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.446 ' HG3' ' HA ' ' A' ' 8' ' ' CYS . 75.3 mmtt -130.31 130.61 44.71 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.135 0.974 . . . . 0.0 109.801 -175.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -72.99 172.03 11.74 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.115 0.566 . . . . 0.0 111.498 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -62.01 106.11 0.67 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.779 0.832 . . . . 0.0 111.151 -177.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 116.39 -10.35 17.0 Favored Glycine 0 C--N 1.356 1.639 0 C-N-CA 123.132 0.396 . . . . 0.0 113.484 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.4 t -92.8 150.86 20.35 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 117.492 0.646 . . . . 0.0 110.49 177.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.63 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 38.5 p -78.85 112.4 15.97 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.962 0.505 . . . . 0.0 111.362 -175.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.446 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 27.9 p -100.85 152.36 20.61 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.091 0.556 . . . . 0.0 111.418 -178.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -59.03 131.97 52.63 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.689 0.796 . . . . 0.0 110.461 175.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -45.79 -45.61 14.86 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 125.219 1.574 . . . . 0.0 114.46 -161.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.4 p -137.23 12.94 3.05 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.873 0.469 . . . . 0.0 111.674 -175.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.7 t -93.94 21.9 6.22 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -168.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.8 t80 52.3 40.84 29.96 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 124.515 1.126 . . . . 0.0 111.759 -179.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -91.71 7.59 40.97 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.05 -175.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.5 m -89.48 122.89 33.1 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.177 0.591 . . . . 0.0 111.27 174.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 83.5 m -69.3 -38.03 78.08 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.812 0.845 . . . . 0.0 109.539 166.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.2 t -158.46 134.42 9.09 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.943 0.897 . . . . 0.0 109.094 176.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.71 -170.83 20.46 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 112.348 -0.301 . . . . 0.0 112.348 -177.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 37.7 m -116.59 146.3 42.76 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.555 0.742 . . . . 0.0 110.248 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.3 m -75.28 82.21 2.41 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 122.139 0.971 . . . . 0.0 111.004 174.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 -92.33 111.39 22.95 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.517 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.7 t30 61.12 30.15 19.25 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 124.666 1.186 . . . . 0.0 110.791 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.4 29.01 68.73 Favored Glycine 0 C--N 1.342 0.909 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.937 -175.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.63 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.4 mtmp? -135.31 136.85 41.9 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.554 0.741 . . . . 0.0 109.685 175.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.3 t . . . . . 0 N--CA 1.473 0.694 0 C-N-CA 123.093 0.557 . . . . 0.0 110.475 -173.865 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 120.926 0.393 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -109.17 165.68 11.42 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.539 0.735 . . . . 0.0 109.447 169.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -109.03 -177.88 3.43 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.395 0.678 . . . . 0.0 110.781 177.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -63.5 122.25 15.81 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.82 0.848 . . . . 0.0 110.515 -177.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.4 -9.07 72.03 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 116.076 -0.511 . . . . 0.0 113.105 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.5 t -90.42 152.35 21.01 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 117.328 0.564 . . . . 0.0 110.202 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.1 m -78.71 126.31 30.55 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.378 0.671 . . . . 0.0 111.171 -172.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.603 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 23.9 p -146.45 147.29 31.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.658 0.783 . . . . 0.0 109.364 -176.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.446 ' HB2' ' OG ' ' A' ' 12' ' ' SER . 28.4 mmt180 -60.11 138.47 57.88 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 122.839 0.456 . . . . 0.0 111.402 -173.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -44.53 -44.96 9.07 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 125.694 1.598 . . . . 0.0 115.289 -159.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.6 t -129.0 1.13 5.28 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 122.0 -0.438 . . . . 0.0 112.047 -175.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.446 ' OG ' ' HB2' ' A' ' 9' ' ' ARG . 99.0 p -66.75 -19.22 65.7 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -174.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 63.48 39.29 9.23 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 124.655 1.182 . . . . 0.0 109.992 -172.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.603 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 22.0 t0 -68.54 -22.23 64.51 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.155 176.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.414 ' HB2' ' HB2' ' A' ' 25' ' ' CYS . 48.9 t -80.15 145.01 32.56 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.344 0.657 . . . . 0.0 109.549 166.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.76 -42.96 99.65 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.205 0.602 . . . . 0.0 111.996 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.5 t -148.25 137.26 21.85 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.191 0.596 . . . . 0.0 110.251 175.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.9 151.96 14.94 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.951 -176.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.4 t -82.97 131.09 35.2 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.445 0.698 . . . . 0.0 110.428 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.2 m -75.23 79.71 2.34 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-O 121.764 0.793 . . . . 0.0 110.984 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -85.71 130.7 34.49 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.776 0.831 . . . . 0.0 109.373 -175.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 61.0 28.99 18.75 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.992 0.917 . . . . 0.0 111.028 -175.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.26 36.1 91.27 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 114.782 -1.099 . . . . 0.0 112.853 -174.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HE3' ' HB3' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -155.29 131.77 10.43 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.237 0.615 . . . . 0.0 109.669 -177.735 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.414 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 46.2 t . . . . . 0 CA--C 1.55 0.972 0 C-N-CA 124.506 1.123 . . . . 0.0 112.888 -174.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.6 p . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.392 0.139 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.77 146.42 35.86 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 176.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -87.14 162.34 17.58 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.87 0.468 . . . . 0.0 111.089 -170.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -70.39 117.0 11.38 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 102.03 -18.6 51.74 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.517 -173.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.3 t -83.49 162.97 20.75 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.332 0.653 . . . . 0.0 110.382 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.464 ' HA ' ' HG2' ' A' ' 24' ' ' LYS . 58.2 p -78.65 131.78 36.81 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.19 0.596 . . . . 0.0 110.742 -177.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 23.4 p -150.84 170.39 19.39 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.108 0.563 . . . . 0.0 111.435 -176.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -76.06 -156.19 0.06 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.215 0.606 . . . . 0.0 111.011 -178.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -74.59 -73.63 0.23 Allowed 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 122.465 0.306 . . . . 0.0 111.716 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.5 p -146.26 18.61 1.38 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.975 0.51 . . . . 0.0 112.337 -167.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.6 m -87.88 48.26 1.62 Allowed 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.907 -0.496 . . . . 0.0 111.948 -174.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.3 t80 53.03 38.08 26.38 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.176 1.39 . . . . 0.0 111.772 -178.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.776 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 13.5 m-20 -71.03 -60.14 2.39 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.483 -1.235 . . . . 0.0 112.149 -174.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.8 t -69.4 135.7 50.64 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.6 t -67.58 -37.56 82.8 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.798 0.839 . . . . 0.0 111.2 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.1 t -153.07 83.24 1.2 Allowed 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 122.209 1.004 . . . . 0.0 108.575 173.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 161.13 -173.5 37.58 Favored Glycine 0 C--N 1.341 0.825 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.386 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.4 m -109.51 144.14 38.2 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.374 0.67 . . . . 0.0 110.002 176.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 25' ' ' CYS . 52.0 m -87.47 98.86 11.62 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.735 0.814 . . . . 0.0 110.556 177.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -87.56 107.06 18.41 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.395 1.078 . . . . 0.0 109.437 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.8 t30 46.79 69.65 0.47 Allowed 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 125.051 1.34 . . . . 0.0 112.659 173.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.71 -7.41 58.65 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.616 -1.102 . . . . 0.0 115.221 173.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HG2' ' HA ' ' A' ' 7' ' ' SER . 10.4 mtmp? -145.12 147.9 33.03 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 118.781 1.29 . . . . 0.0 110.195 176.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 20' ' ' CYS . 41.6 t . . . . . 0 N--CA 1.477 0.923 0 O-C-N 122.114 -0.366 . . . . 0.0 110.329 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 C--O 1.243 0.748 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -74.32 146.58 42.99 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.482 0.713 . . . . 0.0 111.665 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -87.49 165.7 15.33 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.562 0.745 . . . . 0.0 109.196 171.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 25' ' ' CYS . 86.9 tttt -63.67 126.78 28.66 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 123.494 0.496 . . . . 0.0 110.6 -176.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 112.19 -40.95 2.36 Favored Glycine 0 C--N 1.342 0.903 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.684 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.9 t -70.42 146.75 50.16 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 122.942 0.497 . . . . 0.0 110.693 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.536 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 34.7 p -76.3 101.92 5.67 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.443 0.64 . . . . 0.0 110.433 -175.338 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 19.1 p -93.53 178.9 5.55 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.814 174.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -73.1 178.96 4.05 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.009 0.524 . . . . 0.0 111.072 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 70.8 mmt-85 -69.28 -67.49 0.47 Allowed 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.908 0.483 . . . . 0.0 111.097 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 71.8 p -131.58 13.11 4.95 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.95 0.5 . . . . 0.0 111.331 -175.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.6 t -82.01 10.52 6.41 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.068 0.547 . . . . 0.0 112.417 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 58.6 34.84 24.16 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.486 1.114 . . . . 0.0 111.644 176.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.53 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 28.2 t70 -74.45 -8.34 55.98 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.224 -177.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 m -64.36 147.31 52.86 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.567 0.747 . . . . 0.0 111.455 166.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 t -90.57 -47.47 7.67 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.2 t -155.04 80.6 1.07 Allowed 'General case' 0 CA--C 1.556 1.186 0 CA-C-O 122.483 1.135 . . . . 0.0 108.465 172.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -174.61 -165.22 30.72 Favored Glycine 0 C--N 1.342 0.895 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.951 -175.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.3 m -126.08 104.9 8.51 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 122.98 0.512 . . . . 0.0 110.479 -177.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.0 m -59.61 115.44 3.32 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 121.122 0.487 . . . . 0.0 110.483 172.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -169.19 137.25 1.91 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.803 1.241 . . . . 0.0 108.414 -167.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 60.97 26.17 16.14 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.359 1.064 . . . . 0.0 111.75 178.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.96 4.13 90.54 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 114.966 -1.016 . . . . 0.0 114.799 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.2 mtmp? -133.67 161.63 34.13 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.421 0.688 . . . . 0.0 110.416 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 4' ' ' LYS . 34.5 t . . . . . 0 CA--C 1.537 0.462 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.336 0.112 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.447 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.4 OUTLIER -97.3 155.88 16.68 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.464 0.706 . . . . 0.0 110.746 179.095 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -117.63 -178.68 3.53 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.46 1.104 . . . . 0.0 109.461 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.472 ' HE3' ' HB ' ' A' ' 17' ' ' THR . 34.3 mmtp -54.01 114.96 1.78 Allowed 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.06 0.944 . . . . 0.0 112.954 -172.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.21 -23.44 24.28 Favored Glycine 0 C--N 1.349 1.304 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.233 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.4 t -65.24 137.59 57.68 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 123.156 0.582 . . . . 0.0 109.942 178.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 24.3 m -78.94 104.85 9.87 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.989 -167.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.6 p -91.63 -160.62 0.74 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.354 1.061 . . . . 0.0 110.155 175.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -95.33 -164.89 1.21 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.524 0.73 . . . . 0.0 110.851 178.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -69.05 -63.27 1.09 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.007 0.523 . . . . 0.0 110.923 177.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.5 t -148.46 21.44 1.05 Allowed 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 122.866 0.466 . . . . 0.0 111.639 -172.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.4 m -68.21 -16.15 63.86 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.068 0.547 . . . . 0.0 111.756 177.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.0 t80 58.43 31.86 21.44 Favored 'General case' 0 C--N 1.358 0.967 0 C-N-CA 125.152 1.381 . . . . 0.0 111.243 -176.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -78.22 0.81 23.69 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.622 175.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 50.3 t -90.98 134.55 34.39 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.234 1.013 . . . . 0.0 109.369 168.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.2 m -77.19 -65.6 0.93 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.006 0.522 . . . . 0.0 110.754 174.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.472 ' HB ' ' HE3' ' A' ' 4' ' ' LYS . 33.3 p -97.45 111.91 23.97 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.69 -0.687 . . . . 0.0 111.443 -170.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.73 -173.31 35.01 Favored Glycine 0 C--N 1.35 1.311 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.226 -177.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 57.2 m -113.02 163.84 14.2 Favored 'General case' 0 C--O 1.243 0.743 0 C-N-CA 123.328 0.651 . . . . 0.0 110.3 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 96.8 m -84.39 101.95 12.39 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.27 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -108.46 125.37 51.7 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 169.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.4 t30 56.98 37.68 28.93 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.181 0.992 . . . . 0.0 110.505 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.26 31.27 78.58 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 114.304 -1.316 . . . . 0.0 113.377 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.452 ' NZ ' ' HB2' ' A' ' 24' ' ' LYS . 9.2 mtmp? -139.09 159.01 43.17 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.174 0.99 . . . . 0.0 109.52 177.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.447 ' SG ' ' HB3' ' A' ' 2' ' ' LYS . 86.0 m . . . . . 0 N--CA 1.477 0.878 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.5 p . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.492 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 73.8 mmtt -56.02 122.94 12.77 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.775 0.83 . . . . 0.0 111.871 -176.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -69.05 177.58 2.61 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.983 0.913 . . . . 0.0 111.692 -179.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -70.31 104.08 2.58 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 122.845 0.458 . . . . 0.0 109.998 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.77 10.43 58.93 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.986 -178.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 40.2 t -75.5 149.14 38.49 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 117.135 0.467 . . . . 0.0 110.248 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.1 p -76.89 100.39 5.53 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.363 0.665 . . . . 0.0 111.148 -169.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.0 p -108.46 178.13 4.58 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.556 0.743 . . . . 0.0 110.796 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -77.05 -158.46 0.11 Allowed 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.839 0.856 . . . . 0.0 111.826 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -62.93 -45.26 93.32 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.189 0.595 . . . . 0.0 111.436 177.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 t -158.39 76.53 0.76 Allowed 'General case' 0 CA--C 1.548 0.899 0 CA-C-O 122.376 1.084 . . . . 0.0 108.076 175.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 89.9 p -71.37 -41.0 70.25 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.222 -170.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 66.25 8.72 5.8 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.122 1.369 . . . . 0.0 112.213 -167.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -80.47 -18.09 49.71 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.569 0.748 . . . . 0.0 109.356 176.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.492 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 61.7 m -50.65 111.31 0.52 Allowed 'General case' 0 C--N 1.355 0.83 0 C-N-CA 124.539 1.136 . . . . 0.0 111.102 174.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.64 -39.01 61.33 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.966 1.306 . . . . 0.0 110.784 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.4 t -155.89 116.03 3.7 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 114.633 -1.167 . . . . 0.0 107.927 166.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.77 -173.74 22.2 Favored Glycine 0 C--N 1.352 1.445 0 N-CA-C 114.003 0.361 . . . . 0.0 114.003 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.4 m -134.49 150.03 50.76 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.061 0.944 . . . . 0.0 110.481 -178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 95.5 m -74.7 85.69 2.14 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.395 0.678 . . . . 0.0 112.021 -177.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -111.73 129.78 56.0 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 124.804 1.242 . . . . 0.0 108.68 174.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 60.0 t30 62.5 30.91 17.23 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 122.466 1.127 . . . . 0.0 110.351 -176.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.43 20.24 69.47 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-N 114.328 -1.306 . . . . 0.0 114.465 -178.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -138.42 158.96 43.27 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.716 0.806 . . . . 0.0 109.551 178.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 82.8 m . . . . . 0 N--CA 1.477 0.887 0 CA-C-O 121.62 0.724 . . . . 0.0 110.044 179.13 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.1 p . . . . . 0 N--CA 1.475 0.814 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 6' ' ' SER . 13.0 mptt -76.11 142.89 41.55 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.237 0.615 . . . . 0.0 111.656 -174.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -89.43 176.85 6.75 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.33 0.652 . . . . 0.0 110.552 177.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.97 118.65 10.07 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.422 0.689 . . . . 0.0 110.867 -174.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.89 -3.58 55.86 Favored Glycine 0 C--N 1.338 0.642 0 CA-C-N 115.545 -0.752 . . . . 0.0 113.41 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.459 ' HB3' ' HB3' ' A' ' 2' ' ' LYS . 34.9 t -82.44 176.19 9.61 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.008 0.523 . . . . 0.0 110.449 174.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.2 m -108.39 138.9 43.9 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.297 0.639 . . . . 0.0 111.411 -173.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.6 p -135.9 -156.38 0.71 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -110.43 -175.62 2.77 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 166.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -54.6 -47.56 73.24 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.337 0.655 . . . . 0.0 112.332 -170.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 p -141.56 66.12 1.36 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.832 0.853 . . . . 0.0 109.897 177.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.1 m -79.1 -29.24 43.17 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.907 171.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 60.9 16.3 6.78 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 125.009 1.324 . . . . 0.0 111.47 -174.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -92.63 -5.58 51.19 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 122.843 0.457 . . . . 0.0 111.218 -173.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 73.9 m -64.27 106.86 1.18 Allowed 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 169.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -51.69 -61.68 2.1 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.181 1.392 . . . . 0.0 111.753 -171.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.8 p -123.28 89.07 3.03 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 170.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.51 174.55 28.36 Favored Glycine 0 C--N 1.337 0.636 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.697 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.0 m -110.0 153.42 24.61 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.42 0.688 . . . . 0.0 109.39 176.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.0 m -74.63 79.25 2.0 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.43 0.633 . . . . 0.0 109.538 172.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -73.49 101.42 3.53 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.229 1.412 . . . . 0.0 108.716 -176.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.1 t30 55.76 36.04 26.49 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.59 1.156 . . . . 0.0 111.55 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.07 5.85 65.56 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 115.244 -0.889 . . . . 0.0 114.629 175.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.7 mtmp? -138.44 145.29 40.74 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 117.895 0.848 . . . . 0.0 110.111 172.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.9 m . . . . . 0 CA--C 1.547 0.83 0 C-N-CA 123.686 0.794 . . . . 0.0 111.512 -179.404 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.7 p . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.698 0.285 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.522 ' HD3' ' HB3' ' A' ' 14' ' ' ASP . 13.5 mptt -98.9 152.7 19.47 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.044 0.537 . . . . 0.0 109.894 -178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -97.13 152.64 18.59 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.358 177.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HB2' HG23 ' A' ' 17' ' ' THR . 0.4 OUTLIER -63.82 126.64 28.29 Favored 'General case' 0 C--O 1.244 0.772 0 N-CA-C 108.623 -0.881 . . . . 0.0 108.623 171.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.02 -22.48 33.25 Favored Glycine 0 C--N 1.337 0.637 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.903 -176.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 t -78.84 178.62 7.8 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.243 0.617 . . . . 0.0 109.454 173.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 22.0 p -97.26 136.1 38.23 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.956 0.502 . . . . 0.0 110.717 176.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.669 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 30.7 p -147.95 148.43 30.77 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.853 0.461 . . . . 0.0 110.126 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -73.75 146.15 44.57 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.504 0.722 . . . . 0.0 111.196 -173.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.616 ' HG2' HG23 ' A' ' 11' ' ' THR . 54.5 ttp180 -35.46 -61.25 0.46 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 126.91 2.084 . . . . 0.0 115.521 -166.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.616 HG23 ' HG2' ' A' ' 10' ' ' ARG . 19.4 p -133.73 28.68 3.9 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 120.892 0.377 . . . . 0.0 110.996 -175.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 45.7 m -86.61 4.05 41.91 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.394 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 60.15 23.32 12.61 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 124.857 1.263 . . . . 0.0 112.49 176.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.639 ' HB2' ' HB2' ' A' ' 8' ' ' CYS . 83.6 m-20 -61.35 -36.26 79.71 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -169.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.669 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 99.6 m -75.86 152.49 37.19 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.6 m -89.33 -23.63 22.2 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.248 165.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.435 HG23 ' HB2' ' A' ' 4' ' ' LYS . 11.5 t -156.4 147.05 21.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.891 0.876 . . . . 0.0 108.79 172.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.16 141.22 11.9 Favored Glycine 0 C--N 1.343 0.952 0 N-CA-C 111.755 -0.538 . . . . 0.0 111.755 -176.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.6 m -83.6 126.36 32.75 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 94.0 m -71.58 76.88 0.81 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 121.844 0.83 . . . . 0.0 110.749 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.2 ttt180 -117.19 133.4 56.03 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 124.56 1.144 . . . . 0.0 108.382 -174.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 64.9 t30 62.18 35.91 15.28 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 124.538 1.135 . . . . 0.0 110.152 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.15 13.11 64.13 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 114.455 -1.248 . . . . 0.0 114.196 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.5 mtmp? -136.86 160.41 38.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.683 0.793 . . . . 0.0 111.182 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -88.65 76.76 8.05 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.121 0.969 . . . . 0.0 110.055 -173.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 0.484 0 CA-C-N 115.525 -0.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.0 p . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.627 ' HG2' ' HB3' ' A' ' 8' ' ' CYS . 5.6 mptp? -65.21 119.34 10.7 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.528 0.731 . . . . 0.0 112.923 -173.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -78.78 159.68 27.77 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.726 0.81 . . . . 0.0 109.995 171.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -62.67 123.79 19.32 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.692 0.397 . . . . 0.0 110.699 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.89 -27.56 10.22 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.595 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.4 t -75.69 148.84 38.32 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.116 0.566 . . . . 0.0 110.241 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 62.3 p -77.94 134.94 37.79 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 120.897 0.379 . . . . 0.0 110.249 -176.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.627 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 14.8 p -145.69 165.25 29.3 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.786 0.834 . . . . 0.0 109.893 -179.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.75 153.18 44.27 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 173.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -50.49 -45.15 56.17 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.432 1.093 . . . . 0.0 112.665 -172.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -126.56 48.68 2.12 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.061 0.944 . . . . 0.0 109.271 174.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.0 p -55.16 -40.35 70.53 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.881 0.873 . . . . 0.0 112.229 -176.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.9 t80 65.55 9.78 6.13 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 125.221 1.409 . . . . 0.0 111.638 -174.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -93.16 -14.42 27.21 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.445 1.098 . . . . 0.0 109.592 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.0 t -62.88 108.55 1.22 Allowed 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.007 -178.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.4 t -50.83 -45.95 59.79 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 126.328 1.851 . . . . 0.0 113.255 -168.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.3 t -158.91 39.66 0.22 Allowed 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.074 0.94 . . . . 0.0 109.451 -174.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -150.77 174.51 30.06 Favored Glycine 0 C--N 1.339 0.699 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.48 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 36.9 m -112.74 133.93 54.52 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 174.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.9 m -72.3 84.16 1.06 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.744 0.783 . . . . 0.0 110.553 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.8 mtt180 -100.77 132.71 46.03 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.112 1.365 . . . . 0.0 109.327 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 61.7 25.21 15.15 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.207 1.003 . . . . 0.0 111.534 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.54 2.79 81.9 Favored Glycine 0 CA--C 1.538 1.521 0 CA-C-N 115.565 -0.743 . . . . 0.0 114.685 178.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -139.45 159.71 41.52 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-N 118.154 0.977 . . . . 0.0 109.761 174.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.584 ' SG ' ' HB3' ' A' ' 2' ' ' LYS . 49.5 m -60.32 143.61 52.54 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.178 0.591 . . . . 0.0 111.721 176.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 0.408 0 O-C-N 123.542 0.526 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.7 p . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' A' ' 7' ' ' SER . 2.3 mptm? -69.51 137.27 52.38 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.248 0.619 . . . . 0.0 111.974 -174.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 71.7 mtp180 -90.12 177.66 6.38 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.742 0.817 . . . . 0.0 110.074 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -52.0 125.94 16.91 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.371 1.068 . . . . 0.0 111.222 179.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.27 -23.07 33.44 Favored Glycine 0 C--N 1.348 1.216 0 O-C-N 123.396 0.435 . . . . 0.0 113.626 178.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.1 t -85.41 165.72 16.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.157 0.583 . . . . 0.0 111.056 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 2' ' ' LYS . 37.3 p -79.34 104.86 10.25 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 123.944 0.898 . . . . 0.0 113.101 -166.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.6 p -119.39 153.31 35.39 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.45 0.7 . . . . 0.0 110.617 176.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.1 mmt-85 -74.66 -177.26 3.12 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 122.574 0.35 . . . . 0.0 110.439 -174.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -50.47 -66.88 0.31 Allowed 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.349 1.059 . . . . 0.0 113.077 -173.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.3 p -140.84 24.57 2.19 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.424 0.69 . . . . 0.0 110.481 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.3 p -64.64 -20.98 66.6 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.646 1.178 . . . . 0.0 113.853 -173.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER 65.86 26.05 11.16 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.849 1.26 . . . . 0.0 110.633 -169.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.27 -31.73 72.95 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 124.093 0.957 . . . . 0.0 109.666 169.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.564 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 5.4 t -67.62 125.75 27.19 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.967 171.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 t -69.06 -36.48 77.72 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.301 1.041 . . . . 0.0 111.3 -170.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 t -160.65 80.48 0.65 Allowed 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.506 0.722 . . . . 0.0 109.834 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 167.2 158.52 11.6 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.153 -0.931 . . . . 0.0 112.616 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.4 m -86.28 138.95 31.45 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.236 0.614 . . . . 0.0 109.737 175.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.564 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 83.8 m -93.94 132.74 38.09 Favored 'General case' 0 C--O 1.24 0.591 0 C-N-CA 123.238 0.615 . . . . 0.0 111.612 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.4 ttm-85 -141.94 137.48 31.3 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.373 1.069 . . . . 0.0 109.089 174.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.9 t30 58.89 39.43 23.84 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-O 122.582 1.182 . . . . 0.0 110.782 175.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.84 8.25 81.97 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 114.329 -1.305 . . . . 0.0 114.857 175.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -139.03 158.81 43.52 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 118.122 0.961 . . . . 0.0 111.433 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 66.0 m -68.36 129.59 40.39 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.256 1.022 . . . . 0.0 110.702 174.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.284 0 O-C-N 123.606 0.566 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.9 p . . . . . 0 N--CA 1.485 1.313 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -119.5 157.64 27.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.048 0.539 . . . . 0.0 110.16 174.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -94.1 155.26 17.18 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.746 0.819 . . . . 0.0 109.656 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.421 ' HB2' HG23 ' A' ' 17' ' ' THR . 0.2 OUTLIER -63.16 111.07 2.06 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 172.751 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 126.89 -27.42 4.88 Favored Glycine 0 C--N 1.342 0.909 0 O-C-N 123.455 0.472 . . . . 0.0 112.642 -176.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 t -74.11 -174.99 2.07 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.63 0.772 . . . . 0.0 111.763 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.46 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 49.2 m -101.93 133.14 47.19 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.099 0.559 . . . . 0.0 109.655 173.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.57 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 27.2 p -155.23 150.37 26.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.44 0.696 . . . . 0.0 110.294 -176.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -70.81 140.72 51.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.513 0.325 . . . . 0.0 110.859 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.676 ' HG2' HG23 ' A' ' 11' ' ' THR . 44.3 ttp180 -34.21 -53.23 0.49 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 127.155 2.182 . . . . 0.0 115.939 -169.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.676 HG23 ' HG2' ' A' ' 10' ' ' ARG . 24.6 p -137.74 28.12 2.69 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 120.926 0.393 . . . . 0.0 111.716 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.442 ' OG ' ' HB2' ' A' ' 14' ' ' ASP . 27.4 p -77.39 -6.45 53.42 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.624 0.602 . . . . 0.0 112.624 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 62.44 29.17 17.11 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.983 0.913 . . . . 0.0 110.217 -173.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.57 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 45.4 t0 -69.77 -29.67 67.06 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.634 1.174 . . . . 0.0 111.281 -172.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.567 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 71.7 m -84.78 152.74 23.45 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.516 0.726 . . . . 0.0 111.466 176.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 72.0 m -84.97 -28.36 25.86 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.862 165.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.421 HG23 ' HB2' ' A' ' 4' ' ' LYS . 10.0 t -151.96 152.52 32.6 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.165 0.586 . . . . 0.0 110.158 175.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.66 164.45 36.9 Favored Glycine 0 C--N 1.346 1.118 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.076 -174.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.5 m -107.58 122.55 46.9 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 122.745 0.418 . . . . 0.0 109.9 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.436 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 85.6 m -69.26 87.75 0.43 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.268 0.556 . . . . 0.0 110.532 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -120.01 136.85 54.4 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.965 0.906 . . . . 0.0 109.732 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 59.27 32.01 21.62 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.568 1.147 . . . . 0.0 111.582 -176.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.32 8.57 87.03 Favored Glycine 0 C--N 1.343 0.926 0 CA-C-N 115.064 -0.971 . . . . 0.0 114.707 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.3 mtmp? -136.07 147.0 47.66 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.56 0.695 . . . . 0.0 111.717 178.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.0 t -72.45 124.87 26.06 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.014 1.326 . . . . 0.0 110.737 177.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.237 0 CA-C-N 117.683 0.22 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.0 p . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -105.57 153.27 22.0 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.5 0.72 . . . . 0.0 110.606 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -70.99 166.97 20.18 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.481 0.713 . . . . 0.0 111.236 178.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -66.28 118.99 10.75 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 174.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.22 -0.52 63.99 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 123.026 0.346 . . . . 0.0 112.832 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 43.0 t -92.12 152.3 19.98 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.102 0.561 . . . . 0.0 110.097 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.8 m -79.25 120.87 24.34 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.864 0.466 . . . . 0.0 111.108 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.562 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 9.8 p -109.5 -92.39 0.44 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.745 0.818 . . . . 0.0 109.557 178.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 177.09 131.3 0.05 Allowed 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -43.72 -37.56 2.73 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 115.761 1.763 . . . . 0.0 115.761 -165.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.2 p -124.87 6.46 8.05 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.918 0.711 . . . . 0.0 112.918 -176.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 75.2 m -78.37 -24.09 46.57 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-O 119.346 -0.359 . . . . 0.0 111.921 174.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.6 t80 53.32 39.04 29.21 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.226 1.01 . . . . 0.0 111.079 -174.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -88.14 36.77 0.79 Allowed 'General case' 0 CA--C 1.554 1.119 0 CA-C-O 122.117 0.961 . . . . 0.0 111.184 -169.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.562 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 61.0 m -107.85 134.41 50.83 Favored 'General case' 0 C--N 1.348 0.507 0 C-N-CA 124.126 0.971 . . . . 0.0 109.127 177.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -37.44 83.12 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.533 0.733 . . . . 0.0 110.591 173.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.7 t -141.9 144.12 33.65 Favored 'General case' 0 C--O 1.243 0.741 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 167.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.54 162.34 30.26 Favored Glycine 0 C--N 1.338 0.689 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.989 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.3 m -94.95 145.43 24.93 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.076 0.95 . . . . 0.0 109.714 177.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 62.7 m -74.11 76.06 1.75 Allowed 'General case' 0 CA--C 1.549 0.92 0 CA-C-O 122.07 0.938 . . . . 0.0 110.957 175.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.1 mtp180 -84.26 112.86 20.68 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 124.627 1.171 . . . . 0.0 109.28 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.7 t30 58.99 40.54 22.22 Favored 'General case' 0 CA--C 1.557 1.23 0 CA-C-O 122.576 1.179 . . . . 0.0 109.894 178.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.83 -13.78 61.96 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 114.658 -1.155 . . . . 0.0 114.397 177.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -126.79 154.2 44.58 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 117.952 0.876 . . . . 0.0 111.25 -171.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.5 m -72.48 95.8 1.84 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.193 0.997 . . . . 0.0 111.098 -175.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.204 0 CA-C-N 116.517 -0.311 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 14' ' ' ASP . 14.6 p . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.675 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 47.5 mmtm -80.28 126.77 31.56 Favored 'General case' 0 N--CA 1.484 1.249 0 CA-C-N 118.272 0.487 . . . . 0.0 110.304 -171.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 172.13 9.27 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 175.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -66.81 118.0 9.71 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.089 0.471 . . . . 0.0 110.329 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 107.62 -14.05 38.76 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 115.279 -0.873 . . . . 0.0 113.016 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.0 t -72.97 152.75 41.24 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.102 0.561 . . . . 0.0 111.106 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.557 ' HA ' ' HG2' ' A' ' 24' ' ' LYS . 31.8 m -80.18 140.41 36.34 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 122.953 0.501 . . . . 0.0 110.12 177.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.462 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 6.3 p -149.2 -177.19 5.69 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.705 0.802 . . . . 0.0 110.124 178.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.499 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 49.0 ttp85 -84.53 173.46 10.8 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 168.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.499 ' H ' ' HG2' ' A' ' 9' ' ' ARG . 57.8 ttp180 -49.82 -34.0 18.4 Favored 'General case' 0 N--CA 1.5 2.055 0 C-N-CA 123.999 0.919 . . . . 0.0 112.106 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.4 t -155.14 96.04 1.78 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-O 121.895 0.855 . . . . 0.0 108.866 163.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.6 p -82.66 -12.52 57.57 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.001 -0.999 . . . . 0.0 111.696 176.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 70.9 -22.78 0.18 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 126.038 1.735 . . . . 0.0 114.278 177.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 1' ' ' CYS . 3.7 p-10 -86.83 2.77 47.88 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 118.339 0.518 . . . . 0.0 111.03 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.675 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 42.4 t -64.1 97.32 0.17 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.1 m -60.22 -34.94 74.36 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.078 0.951 . . . . 0.0 112.737 -176.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.4 t -148.58 138.01 21.93 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 120.755 0.312 . . . . 0.0 110.415 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.3 164.42 40.25 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.605 -173.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 60.7 m -104.75 148.04 27.04 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.5 m -75.65 71.51 2.54 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-O 121.823 0.82 . . . . 0.0 112.373 -176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -84.06 124.92 31.6 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.965 1.306 . . . . 0.0 109.055 178.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 59.66 32.87 21.75 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.347 1.07 . . . . 0.0 109.335 -173.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.38 36.09 92.6 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 113.816 -1.538 . . . . 0.0 113.308 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.557 ' HG2' ' HA ' ' A' ' 7' ' ' SER . 36.2 mtmm -148.0 140.07 24.13 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.522 0.729 . . . . 0.0 110.19 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 84.6 m -66.06 132.98 49.8 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.094 0.558 . . . . 0.0 110.913 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.32 0 O-C-N 122.998 0.186 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 28.5 p . . . . . 0 N--CA 1.484 1.239 0 CA-C-O 120.693 0.282 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.404 ' HG2' ' HB3' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -96.68 129.01 44.16 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.787 0.835 . . . . 0.0 110.671 -176.307 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -82.98 178.68 8.04 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.077 1.351 . . . . 0.0 111.439 177.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -66.19 100.25 0.6 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.799 0.84 . . . . 0.0 110.353 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 113.09 -17.01 22.44 Favored Glycine 0 C--N 1.343 0.946 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.367 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 45.6 t -69.8 143.01 53.07 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.256 0.622 . . . . 0.0 110.558 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.494 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 21.4 p -78.01 117.04 18.94 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.016 0.526 . . . . 0.0 111.347 -173.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.404 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 25.5 p -115.56 -163.86 0.91 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.015 0.926 . . . . 0.0 109.576 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.03 -164.21 1.14 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.298 0.639 . . . . 0.0 109.908 172.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -62.02 -62.22 1.94 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.721 0.808 . . . . 0.0 112.329 -175.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.7 p -144.76 22.41 1.61 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.864 0.866 . . . . 0.0 109.824 -175.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.0 m -76.78 13.58 1.0 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -168.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 64.04 18.21 11.09 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.254 1.022 . . . . 0.0 112.893 171.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -60.26 -28.99 68.5 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.383 0.673 . . . . 0.0 111.483 -177.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 81.6 m -58.62 133.07 55.55 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.773 1.229 . . . . 0.0 113.025 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -72.72 -28.7 62.82 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.421 0.689 . . . . 0.0 109.855 164.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.0 t -155.19 145.56 21.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.745 0.818 . . . . 0.0 109.705 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 83.65 -168.99 46.44 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 116.264 -0.425 . . . . 0.0 112.552 -175.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.427 ' HB3' HH12 ' A' ' 21' ' ' ARG . 25.8 t -134.95 152.8 52.06 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.331 0.652 . . . . 0.0 109.816 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.2 m -72.49 114.96 11.18 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.386 0.675 . . . . 0.0 112.675 -173.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.427 HH12 ' HB3' ' A' ' 19' ' ' SER . 63.0 mmt-85 -102.26 105.25 15.86 Favored 'General case' 0 C--O 1.245 0.823 0 C-N-CA 124.459 1.104 . . . . 0.0 109.864 170.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.1 t30 50.55 70.38 0.52 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.783 1.233 . . . . 0.0 112.006 171.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.36 7.78 34.55 Favored Glycine 0 CA--C 1.539 1.576 0 N-CA-C 114.69 0.636 . . . . 0.0 114.69 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.494 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 8.5 mtmp? -131.94 161.0 34.14 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.494 1.118 . . . . 0.0 108.37 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 48.5 t -104.99 136.22 44.86 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -178.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.282 0 O-C-N 122.913 0.133 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 52.2 t . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.599 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 73.8 mmtt -127.2 141.83 51.64 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.492 0.717 . . . . 0.0 110.095 177.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -120.61 173.51 7.14 Favored 'General case' 0 C--O 1.245 0.836 0 C-N-CA 124.438 1.095 . . . . 0.0 108.755 173.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -64.04 113.52 3.55 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.187 0.595 . . . . 0.0 111.046 -178.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 121.65 -29.23 5.7 Favored Glycine 0 C--N 1.339 0.748 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.737 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.0 t -77.35 137.16 38.58 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.95 0.5 . . . . 0.0 111.002 -175.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.6 p -79.21 126.86 31.31 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.256 0.622 . . . . 0.0 111.387 -175.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 25' ' ' CYS . 8.0 p -152.66 155.3 37.02 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.378 0.671 . . . . 0.0 110.848 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -70.34 144.42 51.67 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.1 ttp180 -43.23 -43.11 4.6 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 125.111 1.364 . . . . 0.0 114.145 -164.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.3 p -133.5 75.14 1.59 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.589 0.709 . . . . 0.0 109.741 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.4 m -88.12 -11.97 45.42 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.709 172.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.3 t80 61.06 19.28 9.79 Favored 'General case' 0 CA--C 1.559 1.296 0 C-N-CA 124.622 1.169 . . . . 0.0 112.244 -174.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -96.98 -15.7 20.97 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.569 -174.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 52.4 m -64.78 110.17 2.3 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.129 0.571 . . . . 0.0 111.278 176.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 79.4 m -74.97 -46.89 32.36 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.351 0.661 . . . . 0.0 110.034 176.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.2 p -130.6 101.14 5.57 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.842 0.857 . . . . 0.0 108.916 175.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 125.94 -166.27 18.77 Favored Glycine 0 C--N 1.348 1.235 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.869 -177.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 63.1 m -146.88 143.32 28.46 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.176 0.991 . . . . 0.0 108.956 174.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 61.7 m -73.13 99.4 2.8 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.292 0.637 . . . . 0.0 110.446 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -111.98 128.39 56.15 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.914 0.486 . . . . 0.0 110.288 177.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 58.98 26.21 14.76 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 125.652 1.581 . . . . 0.0 112.073 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 100.42 -0.9 55.77 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-N 115.007 -0.997 . . . . 0.0 115.021 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -138.49 144.38 40.0 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 118.901 1.351 . . . . 0.0 110.876 176.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 10.8 t -76.7 143.51 39.97 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.409 1.084 . . . . 0.0 110.898 -178.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.199 0 CA-C-N 117.0 -0.091 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.4 p . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.426 ' HE3' ' N ' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -71.18 139.41 50.16 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 123.314 0.384 . . . . 0.0 111.131 -178.191 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -82.18 173.23 12.31 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.497 0.719 . . . . 0.0 110.394 175.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.439 ' NZ ' ' HB2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -67.0 124.57 23.4 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-O 120.836 0.351 . . . . 0.0 110.574 -178.365 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.481 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . 96.18 -17.35 59.44 Favored Glycine 0 C--N 1.352 1.451 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.653 -172.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.7 t -79.28 149.2 31.88 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.256 0.622 . . . . 0.0 111.125 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.7 m -79.03 101.1 7.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.51 0.724 . . . . 0.0 111.323 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 20.1 p -107.31 148.22 29.28 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.964 0.905 . . . . 0.0 110.31 177.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.433 ' HB3' ' OG ' ' A' ' 12' ' ' SER . 44.6 ttt180 -59.97 131.29 50.39 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 122.787 0.435 . . . . 0.0 110.086 -179.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.405 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 73.9 ttt180 -50.34 -40.85 50.26 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 115.668 1.729 . . . . 0.0 115.668 -153.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.3 p -135.46 14.22 3.47 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.433 ' OG ' ' HB3' ' A' ' 9' ' ' ARG . 81.0 p -83.55 -12.92 55.57 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.134 0.573 . . . . 0.0 110.842 175.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 61.93 40.02 12.91 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 124.793 1.237 . . . . 0.0 110.329 -176.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -70.64 -4.23 22.39 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 113.505 -1.679 . . . . 0.0 112.006 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.509 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 11.5 t -85.47 164.86 17.59 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.788 0.835 . . . . 0.0 110.9 176.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.78 -21.59 16.28 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.462 1.105 . . . . 0.0 110.015 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.0 t -153.92 143.82 21.9 Favored 'General case' 0 C--N 1.353 0.735 0 C-N-CA 123.609 0.764 . . . . 0.0 109.735 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.3 -162.53 49.68 Favored Glycine 0 C--N 1.337 0.628 0 CA-C-N 116.586 -0.279 . . . . 0.0 112.63 -177.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.0 t -119.74 158.29 26.82 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.816 0.846 . . . . 0.0 109.18 176.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 96.7 m -84.42 69.06 10.47 Favored 'General case' 0 CA--C 1.558 1.256 0 CA-C-O 121.678 0.751 . . . . 0.0 111.195 -177.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -68.07 115.39 7.51 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.237 1.415 . . . . 0.0 109.654 177.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 60.85 28.09 17.87 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 122.383 1.087 . . . . 0.0 110.218 -178.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.49 28.9 66.76 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 114.523 -1.217 . . . . 0.0 113.643 -176.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -141.15 158.8 43.42 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.809 0.844 . . . . 0.0 110.216 173.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.481 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 76.5 m -77.73 123.41 26.66 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.404 -175.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.288 0 O-C-N 123.284 0.365 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.9 p . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.703 0.287 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.638 ' HG3' ' HA ' ' A' ' 8' ' ' CYS . 74.7 mmtt -93.4 155.5 17.33 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-O 120.683 0.277 . . . . 0.0 110.271 178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -107.25 170.67 7.82 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.029 0.532 . . . . 0.0 109.672 -177.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -63.41 128.64 36.77 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.109 0.564 . . . . 0.0 110.747 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.8 -9.32 77.62 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.327 -177.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.1 t -94.3 148.88 21.77 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.333 0.653 . . . . 0.0 110.043 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.9 p -79.35 108.07 12.59 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.322 0.649 . . . . 0.0 110.58 -176.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.638 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 2.9 p -89.39 -97.62 0.1 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.541 0.736 . . . . 0.0 109.869 178.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.6 ttt180 175.46 142.57 0.06 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.674 1.19 . . . . 0.0 108.073 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -29.13 -66.26 0.09 Allowed 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 127.043 2.137 . . . . 0.0 115.697 -162.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.7 p -129.55 18.32 5.79 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.767 0.827 . . . . 0.0 111.405 -174.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.9 m -71.84 -35.31 69.82 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.066 0.546 . . . . 0.0 112.446 -176.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.6 t80 55.7 32.82 20.12 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.8 1.24 . . . . 0.0 112.36 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -70.59 -14.71 62.6 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.723 168.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.6 t -66.71 130.19 42.34 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.673 0.789 . . . . 0.0 109.892 171.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.97 -37.66 85.61 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.543 0.527 . . . . 0.0 111.703 178.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.4 t -154.39 140.52 18.45 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 122.73 0.412 . . . . 0.0 110.158 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.67 140.26 10.88 Favored Glycine 0 C--N 1.343 0.966 0 C-N-CA 123.247 0.451 . . . . 0.0 112.2 -176.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.2 m -80.12 127.32 32.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 122.98 0.512 . . . . 0.0 109.845 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.1 m -68.69 80.04 0.28 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.902 0.881 . . . . 0.0 112.694 -177.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -84.43 125.27 32.19 Favored 'General case' 0 C--O 1.243 0.752 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.5 t30 59.26 29.92 19.57 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.048 0.939 . . . . 0.0 110.184 -174.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.93 32.69 77.81 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-N 114.837 -1.074 . . . . 0.0 113.515 -175.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.45 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -145.78 133.12 20.63 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -176.734 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 57.5 m -58.75 109.02 0.73 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.175 0.99 . . . . 0.0 111.969 -177.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.05 0 CA-C-N 116.306 -0.406 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 120.304 0.097 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.408 ' H ' ' HA ' ' A' ' 15' ' ' CYS . 45.9 mmtm -118.45 166.53 12.57 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 121.459 0.647 . . . . 0.0 111.308 -178.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -120.97 169.44 10.47 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.911 174.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.39 139.23 43.88 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 122.68 0.392 . . . . 0.0 110.931 175.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.38 -0.3 89.15 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-N 116.211 -0.45 . . . . 0.0 113.78 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t -88.82 -173.43 4.1 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 117.568 0.684 . . . . 0.0 109.673 173.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 79.6 p -113.1 118.49 34.89 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.586 0.755 . . . . 0.0 109.034 174.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.9 p -124.88 174.88 7.65 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 122.741 0.416 . . . . 0.0 111.511 -178.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.494 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 4.7 mpt_? -76.53 169.79 17.6 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.851 0.861 . . . . 0.0 110.01 176.11 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -55.73 -57.47 11.87 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.84 0.856 . . . . 0.0 113.14 -171.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -157.41 26.68 0.29 Allowed 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.248 0.547 . . . . 0.0 110.15 -178.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -78.0 10.05 3.18 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 124.235 1.014 . . . . 0.0 112.12 -178.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 62.6 30.57 17.02 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.64 1.176 . . . . 0.0 111.011 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -67.79 -21.13 65.26 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.851 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 75.0 m -92.64 146.01 23.99 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 121.904 -0.498 . . . . 0.0 111.036 174.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.8 m -86.19 -50.8 6.71 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 166.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.4 p -127.32 112.11 14.67 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.232 1.013 . . . . 0.0 109.398 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.96 137.64 4.35 Favored Glycine 0 C--N 1.35 1.334 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -177.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.437 ' HB2' ' NH1' ' A' ' 21' ' ' ARG . 25.4 m -89.56 131.5 35.55 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 117.374 0.587 . . . . 0.0 109.511 177.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.1 m -79.31 115.08 18.74 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -173.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.437 ' NH1' ' HB2' ' A' ' 19' ' ' SER . 7.9 mpt_? -103.36 -168.44 1.51 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.223 1.009 . . . . 0.0 109.549 172.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -52.15 99.08 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.743 1.217 . . . . 0.0 112.481 -177.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.35 0.62 47.25 Favored Glycine 0 C--N 1.356 1.661 0 CA-C-N 115.161 -0.927 . . . . 0.0 114.581 175.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.9 mtmp? -136.94 155.73 49.37 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-N 117.463 0.632 . . . . 0.0 111.816 -168.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 13.1 t -91.98 86.89 5.99 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 170.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.175 0 CA-C-N 115.913 -0.585 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.478 0.973 0 CA-C-O 120.704 0.288 . . . . 0.0 110.62 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.471 ' HD3' ' HB3' ' A' ' 14' ' ' ASP . 4.4 mptp? -83.89 129.07 34.94 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.245 0.618 . . . . 0.0 110.384 -177.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.94 177.85 7.81 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.21 0.604 . . . . 0.0 109.506 177.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -59.21 115.77 3.43 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.155 0.582 . . . . 0.0 111.1 178.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 105.33 -20.98 36.34 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-O 119.838 -0.423 . . . . 0.0 113.268 -178.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.1 t -76.5 153.18 35.74 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.924 0.49 . . . . 0.0 110.886 178.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 30.5 p -79.13 103.45 9.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.533 0.733 . . . . 0.0 111.678 -174.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.476 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 30.1 p -114.9 131.56 56.83 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.656 0.782 . . . . 0.0 109.857 177.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.671 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 96.5 mtt180 -58.21 139.75 54.38 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.048 0.539 . . . . 0.0 111.784 -174.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 43.2 ttp-105 -39.43 -46.76 1.71 Allowed 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 126.634 1.974 . . . . 0.0 115.126 -162.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -139.03 7.35 2.44 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.812 0.445 . . . . 0.0 111.377 -176.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.671 ' HB3' ' HB2' ' A' ' 9' ' ' ARG . 47.4 t -80.77 -0.65 39.54 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.49 0.716 . . . . 0.0 111.502 179.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.0 t80 59.83 34.37 21.82 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.886 1.274 . . . . 0.0 112.727 170.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.471 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 7.2 m-20 -68.09 -17.1 64.28 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.309 0.644 . . . . 0.0 112.192 176.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.467 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 4.8 t -72.65 150.69 42.79 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 123.351 0.66 . . . . 0.0 110.269 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.6 m -64.88 -42.78 94.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.769 0.828 . . . . 0.0 109.719 176.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.5 t -172.01 148.98 2.33 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.89 1.276 . . . . 0.0 108.716 167.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 125.11 -171.92 17.14 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-N 116.432 -0.349 . . . . 0.0 112.639 -178.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.6 m -101.97 114.63 28.91 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.659 0.783 . . . . 0.0 110.257 -175.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.467 ' SG ' ' HB2' ' A' ' 15' ' ' CYS . 94.9 m -76.19 74.67 3.02 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.233 0.613 . . . . 0.0 110.53 175.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -89.27 128.33 35.85 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.2 t30 55.29 31.17 16.08 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.508 1.123 . . . . 0.0 110.316 -175.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.13 40.61 92.77 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 114.375 -1.284 . . . . 0.0 113.871 -176.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -151.37 141.17 21.88 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 117.288 0.544 . . . . 0.0 109.661 179.722 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.476 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 88.8 m -67.2 104.23 1.41 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.238 1.015 . . . . 0.0 111.696 179.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.133 0 CA-C-N 115.447 -0.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.3 p . . . . . 0 N--CA 1.475 0.796 0 CA-C-O 121.49 0.662 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.477 ' HG3' ' HB3' ' A' ' 8' ' ' CYS . 43.7 mmtm -91.85 154.09 19.12 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.457 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -107.01 177.96 4.7 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -67.8 106.89 2.41 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 125.72 -19.26 6.62 Favored Glycine 0 C--N 1.337 0.585 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.13 -178.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.2 t -91.71 152.09 20.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.676 0.79 . . . . 0.0 110.755 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.43 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 72.4 p -77.36 136.64 38.46 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.389 0.676 . . . . 0.0 110.052 -178.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.487 ' SG ' ' HB2' ' A' ' 25' ' ' CYS . 7.5 p -154.48 163.17 40.6 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.932 0.493 . . . . 0.0 112.013 -171.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -64.0 136.26 57.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.824 0.85 . . . . 0.0 109.985 173.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.495 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 30.4 ttp-105 -52.06 -58.34 6.84 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 124.762 1.289 . . . . 0.0 113.378 -166.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.4 p -132.46 18.32 4.37 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.567 -0.708 . . . . 0.0 111.827 -178.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.4 t -87.76 11.33 15.66 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.998 0.519 . . . . 0.0 111.419 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 59.01 35.67 24.11 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.24 1.016 . . . . 0.0 112.129 176.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -72.62 -30.86 64.69 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.319 177.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.2 t -80.86 139.74 35.78 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 166.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.64 -48.69 76.23 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.517 0.727 . . . . 0.0 112.471 -172.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.0 t -146.62 31.0 0.98 Allowed 'General case' 0 N--CA 1.486 1.333 0 CA-C-O 122.15 0.976 . . . . 0.0 112.017 -171.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.416 ' HA3' ' SG ' ' A' ' 25' ' ' CYS . . . -140.6 150.7 21.85 Favored Glycine 0 N--CA 1.469 0.867 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.656 -179.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.0 m -82.37 124.37 29.95 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.185 0.594 . . . . 0.0 110.963 -179.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 98.6 m -90.25 119.44 30.56 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.658 0.783 . . . . 0.0 110.767 -178.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -141.59 155.18 45.76 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 173.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 60.39 22.81 12.37 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.733 0.813 . . . . 0.0 110.574 -170.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.24 32.22 83.11 Favored Glycine 0 C--N 1.342 0.869 0 CA-C-N 115.163 -0.926 . . . . 0.0 114.122 -172.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 1.0 OUTLIER -154.48 139.71 17.55 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 117.655 0.727 . . . . 0.0 110.667 -179.0 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.487 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 43.7 t -70.24 100.78 1.75 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.222 1.009 . . . . 0.0 109.742 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.098 0 CA-C-N 116.368 -0.378 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.446 ' HG3' ' HA ' ' A' ' 8' ' ' CYS . 75.3 mmtt -130.31 130.61 44.71 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.135 0.974 . . . . 0.0 109.801 -175.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -72.99 172.03 11.74 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.115 0.566 . . . . 0.0 111.498 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -62.01 106.11 0.67 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.779 0.832 . . . . 0.0 111.151 -177.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 116.39 -10.35 17.0 Favored Glycine 0 C--N 1.356 1.639 0 C-N-CA 123.132 0.396 . . . . 0.0 113.484 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.4 t -92.8 150.86 20.35 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 117.492 0.646 . . . . 0.0 110.49 177.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.63 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 38.5 p -78.85 112.4 15.97 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.962 0.505 . . . . 0.0 111.362 -175.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.446 ' HA ' ' HG3' ' A' ' 2' ' ' LYS . 27.9 p -100.85 152.36 20.61 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.091 0.556 . . . . 0.0 111.418 -178.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -59.03 131.97 52.63 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.689 0.796 . . . . 0.0 110.461 175.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -45.79 -45.61 14.86 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 125.219 1.574 . . . . 0.0 114.46 -161.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.4 p -137.23 12.94 3.05 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.873 0.469 . . . . 0.0 111.674 -175.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.7 t -93.94 21.9 6.22 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -168.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.8 t80 52.3 40.84 29.96 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 124.515 1.126 . . . . 0.0 111.759 -179.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -91.71 7.59 40.97 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.05 -175.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 1.5 m -89.48 122.89 33.1 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.177 0.591 . . . . 0.0 111.27 174.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 83.5 m -69.3 -38.03 78.08 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.812 0.845 . . . . 0.0 109.539 166.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.2 t -158.46 134.42 9.09 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.943 0.897 . . . . 0.0 109.094 176.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.71 -170.83 20.46 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 112.348 -0.301 . . . . 0.0 112.348 -177.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 37.7 m -116.59 146.3 42.76 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.555 0.742 . . . . 0.0 110.248 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 78.3 m -75.28 82.21 2.41 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 122.139 0.971 . . . . 0.0 111.004 174.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 -92.33 111.39 22.95 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.517 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.7 t30 61.12 30.15 19.25 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 124.666 1.186 . . . . 0.0 110.791 -177.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.4 29.01 68.73 Favored Glycine 0 C--N 1.342 0.909 0 CA-C-N 114.934 -1.03 . . . . 0.0 112.937 -175.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.63 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.4 mtmp? -135.31 136.85 41.9 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.554 0.741 . . . . 0.0 109.685 175.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.3 t -82.49 113.12 20.01 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.093 0.557 . . . . 0.0 110.475 -173.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.183 0 CA-C-N 116.027 -0.533 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.485 1.291 0 CA-C-O 120.926 0.393 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -109.17 165.68 11.42 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.539 0.735 . . . . 0.0 109.447 169.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -109.03 -177.88 3.43 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.395 0.678 . . . . 0.0 110.781 177.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.8 tppt? -63.5 122.25 15.81 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.82 0.848 . . . . 0.0 110.515 -177.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.4 -9.07 72.03 Favored Glycine 0 C--N 1.342 0.893 0 CA-C-N 116.076 -0.511 . . . . 0.0 113.105 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.5 t -90.42 152.35 21.01 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 117.328 0.564 . . . . 0.0 110.202 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.1 m -78.71 126.31 30.55 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.378 0.671 . . . . 0.0 111.171 -172.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.603 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 23.9 p -146.45 147.29 31.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.658 0.783 . . . . 0.0 109.364 -176.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.446 ' HB2' ' OG ' ' A' ' 12' ' ' SER . 28.4 mmt180 -60.11 138.47 57.88 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 122.839 0.456 . . . . 0.0 111.402 -173.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -44.53 -44.96 9.07 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 125.694 1.598 . . . . 0.0 115.289 -159.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.6 t -129.0 1.13 5.28 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 122.0 -0.438 . . . . 0.0 112.047 -175.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.446 ' OG ' ' HB2' ' A' ' 9' ' ' ARG . 99.0 p -66.75 -19.22 65.7 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -174.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 63.48 39.29 9.23 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 124.655 1.182 . . . . 0.0 109.992 -172.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.603 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 22.0 t0 -68.54 -22.23 64.51 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.155 176.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.414 ' HB2' ' HB2' ' A' ' 25' ' ' CYS . 48.9 t -80.15 145.01 32.56 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.344 0.657 . . . . 0.0 109.549 166.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.76 -42.96 99.65 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.205 0.602 . . . . 0.0 111.996 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.5 t -148.25 137.26 21.85 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.191 0.596 . . . . 0.0 110.251 175.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.9 151.96 14.94 Favored Glycine 0 C--N 1.345 1.035 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.951 -176.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.4 t -82.97 131.09 35.2 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.445 0.698 . . . . 0.0 110.428 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.2 m -75.23 79.71 2.34 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-O 121.764 0.793 . . . . 0.0 110.984 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.4 tpt180 -85.71 130.7 34.49 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.776 0.831 . . . . 0.0 109.373 -175.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 61.0 28.99 18.75 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.992 0.917 . . . . 0.0 111.028 -175.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.26 36.1 91.27 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 114.782 -1.099 . . . . 0.0 112.853 -174.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HE3' ' HB3' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -155.29 131.77 10.43 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.237 0.615 . . . . 0.0 109.669 -177.735 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.414 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 46.2 t -58.92 96.65 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.506 1.123 . . . . 0.0 112.888 -174.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.047 0 CA-C-N 115.571 -0.741 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.6 p . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.392 0.139 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.77 146.42 35.86 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 176.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -87.14 162.34 17.58 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.87 0.468 . . . . 0.0 111.089 -170.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -70.39 117.0 11.38 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 102.03 -18.6 51.74 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.517 -173.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.3 t -83.49 162.97 20.75 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.332 0.653 . . . . 0.0 110.382 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.464 ' HA ' ' HG2' ' A' ' 24' ' ' LYS . 58.2 p -78.65 131.78 36.81 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.19 0.596 . . . . 0.0 110.742 -177.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 23.4 p -150.84 170.39 19.39 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.108 0.563 . . . . 0.0 111.435 -176.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -76.06 -156.19 0.06 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.215 0.606 . . . . 0.0 111.011 -178.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -74.59 -73.63 0.23 Allowed 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 122.465 0.306 . . . . 0.0 111.716 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.5 p -146.26 18.61 1.38 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.975 0.51 . . . . 0.0 112.337 -167.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.6 m -87.88 48.26 1.62 Allowed 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.907 -0.496 . . . . 0.0 111.948 -174.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.3 t80 53.03 38.08 26.38 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.176 1.39 . . . . 0.0 111.772 -178.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.776 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 13.5 m-20 -71.03 -60.14 2.39 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-N 114.483 -1.235 . . . . 0.0 112.149 -174.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 49.8 t -69.4 135.7 50.64 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.6 t -67.58 -37.56 82.8 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.798 0.839 . . . . 0.0 111.2 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.1 t -153.07 83.24 1.2 Allowed 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 122.209 1.004 . . . . 0.0 108.575 173.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 161.13 -173.5 37.58 Favored Glycine 0 C--N 1.341 0.825 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.386 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.4 m -109.51 144.14 38.2 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.374 0.67 . . . . 0.0 110.002 176.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 25' ' ' CYS . 52.0 m -87.47 98.86 11.62 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.735 0.814 . . . . 0.0 110.556 177.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -87.56 107.06 18.41 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.395 1.078 . . . . 0.0 109.437 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.8 t30 46.79 69.65 0.47 Allowed 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 125.051 1.34 . . . . 0.0 112.659 173.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.71 -7.41 58.65 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.616 -1.102 . . . . 0.0 115.221 173.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HG2' ' HA ' ' A' ' 7' ' ' SER . 10.4 mtmp? -145.12 147.9 33.03 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 118.781 1.29 . . . . 0.0 110.195 176.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 20' ' ' CYS . 41.6 t -71.06 108.91 4.83 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 122.114 -0.366 . . . . 0.0 110.329 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 0.473 0 CA-C-N 115.959 -0.564 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 C--O 1.243 0.748 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -74.32 146.58 42.99 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.482 0.713 . . . . 0.0 111.665 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -87.49 165.7 15.33 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.562 0.745 . . . . 0.0 109.196 171.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 25' ' ' CYS . 86.9 tttt -63.67 126.78 28.66 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 123.494 0.496 . . . . 0.0 110.6 -176.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 112.19 -40.95 2.36 Favored Glycine 0 C--N 1.342 0.903 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.684 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.9 t -70.42 146.75 50.16 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 122.942 0.497 . . . . 0.0 110.693 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.536 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 34.7 p -76.3 101.92 5.67 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.443 0.64 . . . . 0.0 110.433 -175.338 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 19.1 p -93.53 178.9 5.55 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.814 174.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -73.1 178.96 4.05 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.009 0.524 . . . . 0.0 111.072 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 70.8 mmt-85 -69.28 -67.49 0.47 Allowed 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.908 0.483 . . . . 0.0 111.097 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 71.8 p -131.58 13.11 4.95 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.95 0.5 . . . . 0.0 111.331 -175.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.6 t -82.01 10.52 6.41 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.068 0.547 . . . . 0.0 112.417 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 58.6 34.84 24.16 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.486 1.114 . . . . 0.0 111.644 176.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.53 ' HB3' ' HB2' ' A' ' 8' ' ' CYS . 28.2 t70 -74.45 -8.34 55.98 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.224 -177.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 m -64.36 147.31 52.86 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.567 0.747 . . . . 0.0 111.455 166.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 t -90.57 -47.47 7.67 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.2 t -155.04 80.6 1.07 Allowed 'General case' 0 CA--C 1.556 1.186 0 CA-C-O 122.483 1.135 . . . . 0.0 108.465 172.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -174.61 -165.22 30.72 Favored Glycine 0 C--N 1.342 0.895 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.951 -175.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.3 m -126.08 104.9 8.51 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 122.98 0.512 . . . . 0.0 110.479 -177.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.0 m -59.61 115.44 3.32 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 121.122 0.487 . . . . 0.0 110.483 172.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -169.19 137.25 1.91 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.803 1.241 . . . . 0.0 108.414 -167.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 60.97 26.17 16.14 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.359 1.064 . . . . 0.0 111.75 178.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.96 4.13 90.54 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 114.966 -1.016 . . . . 0.0 114.799 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 10.2 mtmp? -133.67 161.63 34.13 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.421 0.688 . . . . 0.0 110.416 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 4' ' ' LYS . 34.5 t -81.24 82.31 7.16 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 175.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.294 0 CA-C-N 116.322 -0.399 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.336 0.112 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.447 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.4 OUTLIER -97.3 155.88 16.68 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.464 0.706 . . . . 0.0 110.746 179.095 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -117.63 -178.68 3.53 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.46 1.104 . . . . 0.0 109.461 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.472 ' HE3' ' HB ' ' A' ' 17' ' ' THR . 34.3 mmtp -54.01 114.96 1.78 Allowed 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.06 0.944 . . . . 0.0 112.954 -172.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.21 -23.44 24.28 Favored Glycine 0 C--N 1.349 1.304 0 CA-C-N 115.37 -0.832 . . . . 0.0 113.233 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.4 t -65.24 137.59 57.68 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 123.156 0.582 . . . . 0.0 109.942 178.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 24.3 m -78.94 104.85 9.87 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.989 -167.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.6 p -91.63 -160.62 0.74 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.354 1.061 . . . . 0.0 110.155 175.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -95.33 -164.89 1.21 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.524 0.73 . . . . 0.0 110.851 178.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -69.05 -63.27 1.09 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.007 0.523 . . . . 0.0 110.923 177.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.5 t -148.46 21.44 1.05 Allowed 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 122.866 0.466 . . . . 0.0 111.639 -172.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.4 m -68.21 -16.15 63.86 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.068 0.547 . . . . 0.0 111.756 177.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.0 t80 58.43 31.86 21.44 Favored 'General case' 0 C--N 1.358 0.967 0 C-N-CA 125.152 1.381 . . . . 0.0 111.243 -176.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -78.22 0.81 23.69 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 114.645 -1.161 . . . . 0.0 110.622 175.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 50.3 t -90.98 134.55 34.39 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.234 1.013 . . . . 0.0 109.369 168.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.2 m -77.19 -65.6 0.93 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.006 0.522 . . . . 0.0 110.754 174.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.472 ' HB ' ' HE3' ' A' ' 4' ' ' LYS . 33.3 p -97.45 111.91 23.97 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.69 -0.687 . . . . 0.0 111.443 -170.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.73 -173.31 35.01 Favored Glycine 0 C--N 1.35 1.311 0 CA-C-N 115.597 -0.729 . . . . 0.0 112.226 -177.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 57.2 m -113.02 163.84 14.2 Favored 'General case' 0 C--O 1.243 0.743 0 C-N-CA 123.328 0.651 . . . . 0.0 110.3 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 96.8 m -84.39 101.95 12.39 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.27 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -108.46 125.37 51.7 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 169.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.4 t30 56.98 37.68 28.93 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.181 0.992 . . . . 0.0 110.505 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.26 31.27 78.58 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 114.304 -1.316 . . . . 0.0 113.377 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.452 ' NZ ' ' HB2' ' A' ' 24' ' ' LYS . 9.2 mtmp? -139.09 159.01 43.17 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.174 0.99 . . . . 0.0 109.52 177.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.447 ' SG ' ' HB3' ' A' ' 2' ' ' LYS . 86.0 m -75.27 81.18 2.38 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.313 0 CA-C-N 115.3 -0.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.5 p . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.492 ' HB2' ' HA ' ' A' ' 15' ' ' CYS . 73.8 mmtt -56.02 122.94 12.77 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.775 0.83 . . . . 0.0 111.871 -176.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -69.05 177.58 2.61 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.983 0.913 . . . . 0.0 111.692 -179.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -70.31 104.08 2.58 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 122.845 0.458 . . . . 0.0 109.998 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.77 10.43 58.93 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.986 -178.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 40.2 t -75.5 149.14 38.49 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 117.135 0.467 . . . . 0.0 110.248 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.1 p -76.89 100.39 5.53 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.363 0.665 . . . . 0.0 111.148 -169.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.0 p -108.46 178.13 4.58 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.556 0.743 . . . . 0.0 110.796 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -77.05 -158.46 0.11 Allowed 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.839 0.856 . . . . 0.0 111.826 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -62.93 -45.26 93.32 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.189 0.595 . . . . 0.0 111.436 177.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 t -158.39 76.53 0.76 Allowed 'General case' 0 CA--C 1.548 0.899 0 CA-C-O 122.376 1.084 . . . . 0.0 108.076 175.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 89.9 p -71.37 -41.0 70.25 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.222 -170.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 66.25 8.72 5.8 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.122 1.369 . . . . 0.0 112.213 -167.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -80.47 -18.09 49.71 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.569 0.748 . . . . 0.0 109.356 176.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.492 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 61.7 m -50.65 111.31 0.52 Allowed 'General case' 0 C--N 1.355 0.83 0 C-N-CA 124.539 1.136 . . . . 0.0 111.102 174.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.64 -39.01 61.33 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.966 1.306 . . . . 0.0 110.784 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.4 t -155.89 116.03 3.7 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 114.633 -1.167 . . . . 0.0 107.927 166.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.77 -173.74 22.2 Favored Glycine 0 C--N 1.352 1.445 0 N-CA-C 114.003 0.361 . . . . 0.0 114.003 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.4 m -134.49 150.03 50.76 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.061 0.944 . . . . 0.0 110.481 -178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 95.5 m -74.7 85.69 2.14 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.395 0.678 . . . . 0.0 112.021 -177.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -111.73 129.78 56.0 Favored 'General case' 0 C--O 1.244 0.811 0 C-N-CA 124.804 1.242 . . . . 0.0 108.68 174.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 60.0 t30 62.5 30.91 17.23 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 122.466 1.127 . . . . 0.0 110.351 -176.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.43 20.24 69.47 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-N 114.328 -1.306 . . . . 0.0 114.465 -178.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -138.42 158.96 43.27 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.716 0.806 . . . . 0.0 109.551 178.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 82.8 m -77.65 71.04 4.11 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 121.62 0.724 . . . . 0.0 110.044 179.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.51 0 CA-C-N 115.404 -0.816 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.1 p . . . . . 0 N--CA 1.475 0.814 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 6' ' ' SER . 13.0 mptt -76.11 142.89 41.55 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.237 0.615 . . . . 0.0 111.656 -174.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -89.43 176.85 6.75 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.33 0.652 . . . . 0.0 110.552 177.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -65.97 118.65 10.07 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.422 0.689 . . . . 0.0 110.867 -174.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.89 -3.58 55.86 Favored Glycine 0 C--N 1.338 0.642 0 CA-C-N 115.545 -0.752 . . . . 0.0 113.41 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.459 ' HB3' ' HB3' ' A' ' 2' ' ' LYS . 34.9 t -82.44 176.19 9.61 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.008 0.523 . . . . 0.0 110.449 174.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.2 m -108.39 138.9 43.9 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.297 0.639 . . . . 0.0 111.411 -173.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.6 p -135.9 -156.38 0.71 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -110.43 -175.62 2.77 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 166.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -54.6 -47.56 73.24 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.337 0.655 . . . . 0.0 112.332 -170.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 p -141.56 66.12 1.36 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.832 0.853 . . . . 0.0 109.897 177.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.1 m -79.1 -29.24 43.17 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.907 171.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 60.9 16.3 6.78 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 125.009 1.324 . . . . 0.0 111.47 -174.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -92.63 -5.58 51.19 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 122.843 0.457 . . . . 0.0 111.218 -173.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 73.9 m -64.27 106.86 1.18 Allowed 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 169.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -51.69 -61.68 2.1 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.181 1.392 . . . . 0.0 111.753 -171.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.8 p -123.28 89.07 3.03 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 170.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.51 174.55 28.36 Favored Glycine 0 C--N 1.337 0.636 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.697 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.0 m -110.0 153.42 24.61 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.42 0.688 . . . . 0.0 109.39 176.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.0 m -74.63 79.25 2.0 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-O 121.43 0.633 . . . . 0.0 109.538 172.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -73.49 101.42 3.53 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.229 1.412 . . . . 0.0 108.716 -176.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.1 t30 55.76 36.04 26.49 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.59 1.156 . . . . 0.0 111.55 -179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.07 5.85 65.56 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 115.244 -0.889 . . . . 0.0 114.629 175.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.7 mtmp? -138.44 145.29 40.74 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-N 117.895 0.848 . . . . 0.0 110.111 172.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 76.9 m -59.3 108.94 0.77 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.686 0.794 . . . . 0.0 111.512 -179.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.234 0 CA-C-N 116.048 -0.524 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_