data_1zta_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1zta _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.554 1.116 0 N-CA-C 111.345 0.128 . . . . 0.0 111.345 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -76.29 -23.25 54.37 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.858 1.263 . . . . 0.0 113.773 173.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.3 tp -71.76 -46.57 58.04 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.245 1.818 . . . . 0.0 111.073 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -56.18 -34.57 66.35 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 123.78 0.675 . . . . 0.0 110.936 173.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.35 -42.13 90.81 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.088 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -65.36 -52.44 53.64 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 124.607 1.192 . . . . 0.0 111.813 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.7 t -45.05 -40.53 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 124.714 1.205 . . . . 0.0 111.975 173.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.71 -61.38 2.0 Allowed 'General case' 0 CA--C 1.549 0.937 0 O-C-N 123.907 0.754 . . . . 0.0 112.147 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 22.3 mtp85 -52.83 -37.95 60.7 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.7 tp -61.84 -57.95 9.83 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.617 1.967 . . . . 0.0 112.763 173.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -61.95 -32.43 72.85 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.135 0.574 . . . . 0.0 111.454 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.87 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 172.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 . . . . . 0 N--CA 1.483 1.182 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -73.24 -31.32 64.06 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.343 1.457 . . . . 0.0 112.963 173.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.9 tp -68.24 -45.23 73.78 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.918 1.687 . . . . 0.0 111.138 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.39 -24.8 57.61 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 173.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.49 -49.61 8.48 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 115.238 -0.892 . . . . 0.0 113.04 173.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -59.87 -44.25 94.29 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.041 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.8 t -50.47 -35.18 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 126.094 1.758 . . . . 0.0 111.301 174.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.9 -62.7 1.35 Allowed 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.862 175.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -56.97 -27.27 61.2 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 174.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.4 tp -72.8 -56.87 4.6 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.085 1.754 . . . . 0.0 113.103 171.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -60.9 -25.06 66.45 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.099 0.96 . . . . 0.0 111.702 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 tttm . . . . . 0 N--CA 1.479 0.984 0 C-N-CA 125.649 1.58 . . . . 0.0 113.38 166.713 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 . . . . . 0 N--CA 1.485 1.324 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -71.1 -30.8 66.99 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.02 0.928 . . . . 0.0 113.488 173.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.1 tp -67.63 -49.61 62.1 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.077 1.751 . . . . 0.0 111.543 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -59.4 -29.41 67.71 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.453 175.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -60.18 -47.62 85.18 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.907 0.883 . . . . 0.0 112.075 172.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.95 -62.86 1.55 Allowed 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.447 1.092 . . . . 0.0 111.289 174.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.5 t -42.09 -36.66 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 125.119 1.368 . . . . 0.0 111.708 177.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.64 -71.98 0.17 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.624 1.17 . . . . 0.0 113.703 173.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.85 -34.17 26.82 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 176.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -60.37 -60.78 3.26 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 126.711 2.004 . . . . 0.0 111.309 172.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -62.11 -28.5 69.67 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.1 mttt . . . . . 0 N--CA 1.483 1.191 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 170.437 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -74.91 -18.55 60.39 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 122.008 0.909 . . . . 0.0 113.351 175.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.8 tp -66.85 -45.39 78.33 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.887 1.275 . . . . 0.0 111.274 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -61.72 -24.17 66.62 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -81.79 -50.71 8.93 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.545 171.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -61.65 -44.14 97.54 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 123.983 0.802 . . . . 0.0 112.895 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.7 t -50.87 -34.39 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.54 1.136 . . . . 0.0 111.932 173.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.05 -62.38 1.59 Allowed 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.453 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -34.05 59.87 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 174.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.5 tp -68.6 -54.95 13.3 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.267 1.827 . . . . 0.0 112.59 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -63.0 -27.79 69.66 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.302 0.641 . . . . 0.0 111.58 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.554 1.12 0 C-N-CA 124.448 1.099 . . . . 0.0 113.678 169.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 . . . . . 0 CA--C 1.546 0.807 0 CA-C-O 119.318 -0.372 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.36 -15.09 63.24 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 175.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -65.47 -35.79 81.95 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.012 0.925 . . . . 0.0 112.405 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.34 -27.41 67.34 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 176.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -55.33 -30.77 60.91 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.98 0.912 . . . . 0.0 111.392 175.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.83 -60.58 2.19 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.4 1.48 . . . . 0.0 109.303 -178.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 78.3 t -41.58 -39.5 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 124.369 1.068 . . . . 0.0 112.276 173.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.49 -66.53 0.53 Allowed 'General case' 0 CA--C 1.549 0.912 0 O-C-N 123.902 0.751 . . . . 0.0 112.887 175.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.3 -36.83 54.11 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 124.095 0.958 . . . . 0.0 113.424 176.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.9 tp -64.09 -53.74 44.88 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.375 2.27 . . . . 0.0 112.431 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.67 -26.08 67.8 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 123.695 0.622 . . . . 0.0 111.153 177.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 171.747 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 t80 . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 121.12 0.486 . . . . 0.0 110.01 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -86.31 7.01 27.18 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 126.242 1.817 . . . . 0.0 113.34 172.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 tp -111.82 -42.29 3.84 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 120.592 -1.317 . . . . 0.0 110.934 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -29.8 68.09 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.969 172.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -66.42 -43.76 84.83 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 120.966 0.412 . . . . 0.0 111.675 174.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.65 -52.75 34.45 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 117.939 -1.029 . . . . 0.0 111.812 -178.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 98.9 t -43.09 -41.21 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 O-C-N 124.748 1.28 . . . . 0.0 111.376 170.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.42 -67.64 0.43 Allowed 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 117.414 -1.279 . . . . 0.0 112.302 174.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.8 mtm-85 -51.71 -35.57 43.45 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 177.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -63.15 -60.32 3.58 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.889 2.075 . . . . 0.0 112.0 172.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -64.61 -19.58 65.77 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 119.019 -0.515 . . . . 0.0 112.359 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.9 mmtp . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 169.488 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 120.72 0.295 . . . . 0.0 111.337 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -68.4 -29.45 68.14 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.907 1.283 . . . . 0.0 112.31 171.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.1 tp -67.67 -46.52 72.13 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.545 1.938 . . . . 0.0 110.92 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -60.47 -24.3 65.15 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.949 0.781 . . . . 0.0 112.436 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -80.08 -56.9 3.91 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.103 0.961 . . . . 0.0 111.904 169.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -56.37 -44.33 80.05 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-O 118.371 -0.824 . . . . 0.0 112.796 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -49.82 -36.58 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 126.946 2.099 . . . . 0.0 111.63 173.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.31 -66.05 0.59 Allowed 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.736 175.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -51.19 -41.56 60.3 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.257 0.623 . . . . 0.0 111.843 175.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 tp -56.06 -64.07 0.98 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.345 1.858 . . . . 0.0 112.044 173.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -65.06 -18.0 64.93 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.3 mmtp . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 123.969 0.908 . . . . 0.0 113.15 170.423 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.5 t80 . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 110.753 -0.092 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -72.38 -29.48 63.81 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.359 1.463 . . . . 0.0 112.968 172.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.1 tp -68.57 -43.19 77.1 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 126.305 1.842 . . . . 0.0 111.717 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -52.22 -31.47 32.24 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 124.37 1.044 . . . . 0.0 112.465 174.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.45 -46.27 77.0 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.53 0.732 . . . . 0.0 111.978 174.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -61.18 -48.39 81.76 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 174.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.1 t -46.67 -40.93 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 CA-C-O 117.301 -1.333 . . . . 0.0 109.938 171.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.31 -62.37 1.81 Allowed 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 116.21 -1.852 . . . . 0.0 112.057 173.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -47.38 -40.88 18.61 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 119.367 0.985 . . . . 0.0 113.296 176.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.6 tp -65.16 -60.3 3.16 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 126.992 2.117 . . . . 0.0 112.391 173.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -60.36 -28.94 68.58 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.915 1.286 . . . . 0.0 110.674 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.0 mmtm . . . . . 0 CA--C 1.55 0.977 0 CA-C-N 119.389 0.995 . . . . 0.0 111.707 172.156 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 t80 . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 120.753 0.311 . . . . 0.0 110.828 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -81.82 -9.1 59.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.185 1.394 . . . . 0.0 114.071 173.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.2 tp -89.54 -44.56 10.02 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 125.668 1.587 . . . . 0.0 109.756 -177.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.16 -29.06 68.42 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.127 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.5 -47.47 14.22 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 123.477 0.486 . . . . 0.0 111.705 172.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -64.51 -45.04 88.95 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.53 -0.748 . . . . 0.0 112.427 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 62.8 t -50.65 -34.83 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.526 1.53 . . . . 0.0 111.064 172.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -71.98 0.12 Allowed 'General case' 0 CA--C 1.537 0.451 0 O-C-N 124.757 1.286 . . . . 0.0 111.339 171.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.65 -31.04 45.91 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.3 tp -64.47 -65.12 0.72 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 126.538 1.935 . . . . 0.0 112.768 172.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -22.02 65.06 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 121.919 -0.488 . . . . 0.0 111.574 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? . . . . . 0 N--CA 1.478 0.928 0 C-N-CA 124.3 1.04 . . . . 0.0 113.467 172.3 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.35 -33.93 77.13 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.36 1.064 . . . . 0.0 113.138 174.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -69.52 -46.28 66.88 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 126.451 1.9 . . . . 0.0 111.485 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -57.36 -30.64 65.03 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 174.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -64.72 -45.75 85.21 Favored 'General case' 0 N--CA 1.485 1.275 0 CA-C-N 114.406 -1.27 . . . . 0.0 111.132 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -61.51 -50.12 73.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 118.035 -0.983 . . . . 0.0 112.763 177.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.9 t -44.14 -39.55 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 C-N-CA 125.46 1.504 . . . . 0.0 112.002 171.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.55 -68.3 0.38 Allowed 'General case' 0 N--CA 1.482 1.157 0 CA-C-O 118.2 -0.905 . . . . 0.0 112.073 174.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.1 ttt180 -51.01 -34.3 28.68 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 176.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.5 tp -61.76 -57.63 11.14 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.651 1.981 . . . . 0.0 112.544 171.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -63.16 -24.34 67.84 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.023 0 C-N-CA 124.607 1.163 . . . . 0.0 113.581 169.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.553 1.085 0 CA-C-O 120.608 0.242 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -76.49 -25.09 53.91 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.454 1.502 . . . . 0.0 112.77 173.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.7 tp -72.88 -48.16 39.79 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.91 1.684 . . . . 0.0 111.506 -178.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.14 -30.73 62.55 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 123.666 0.604 . . . . 0.0 111.436 175.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.8 -41.77 91.53 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.801 174.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -61.5 -52.8 63.0 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.314 1.009 . . . . 0.0 113.27 173.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.2 t -46.31 -37.78 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 C-N-CA 124.248 1.019 . . . . 0.0 112.062 173.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.13 -64.16 0.91 Allowed 'General case' 0 N--CA 1.484 1.255 0 O-C-N 123.746 0.654 . . . . 0.0 112.374 175.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.0 ptp85 -53.25 -31.23 42.44 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 175.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.9 tp -67.98 -55.59 12.1 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.982 1.713 . . . . 0.0 112.009 172.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -62.81 -24.27 67.67 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.1 tttt . . . . . 0 N--CA 1.479 0.998 0 C-N-CA 125.619 1.568 . . . . 0.0 113.415 169.127 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -79.09 -10.93 59.96 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 174.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -70.41 -52.69 20.52 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 125.273 1.429 . . . . 0.0 111.757 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -56.2 -28.71 59.24 Favored 'General case' 0 CA--C 1.553 1.086 0 O-C-N 124.564 1.165 . . . . 0.0 111.554 174.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.7 -46.2 90.72 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.807 176.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -50.0 75.46 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.894 0.478 . . . . 0.0 111.679 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 83.7 t -43.05 -40.53 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.192 -1.931 0 O-C-N 124.882 1.364 . . . . 0.0 111.648 171.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.96 -54.83 18.08 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 117.934 -1.031 . . . . 0.0 113.208 175.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.554 ' CZ ' ' HZ1' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -52.1 -38.7 58.17 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-N 118.527 0.603 . . . . 0.0 111.851 173.865 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.1 tp -67.79 -55.46 12.92 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.868 1.267 . . . . 0.0 112.027 172.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? -58.39 -31.17 67.42 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 126.339 1.856 . . . . 0.0 109.937 -178.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.554 ' HZ1' ' CZ ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.561 1.374 0 CA-C-N 118.99 0.814 . . . . 0.0 111.586 173.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 . . . . . 0 N--CA 1.483 1.19 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -80.1 -16.21 55.48 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 172.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.4 tp -76.76 -46.19 26.17 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.159 1.384 . . . . 0.0 112.483 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -51.02 -31.85 19.61 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 174.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -58.59 -53.75 54.85 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.599 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -60.28 -55.26 35.91 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 116.818 -1.563 . . . . 0.0 110.314 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.9 t -42.97 -40.03 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 124.837 1.255 . . . . 0.0 112.333 174.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.97 -66.0 0.61 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.958 0.903 . . . . 0.0 112.865 175.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.3 mmm-85 -53.19 -31.71 44.24 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 174.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.7 tp -64.67 -58.97 4.84 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.28 1.832 . . . . 0.0 111.998 170.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -62.68 -21.18 65.55 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 122.956 0.502 . . . . 0.0 112.181 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.033 0 C-N-CA 123.826 0.85 . . . . 0.0 112.766 168.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 119.022 -0.513 . . . . 0.0 110.729 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -76.87 -12.8 60.01 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 123.81 0.694 . . . . 0.0 112.854 173.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.9 tp -76.76 -55.89 5.09 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.943 1.697 . . . . 0.0 110.789 -176.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.15 -25.58 33.12 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 124.728 1.268 . . . . 0.0 113.201 173.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -82.2 -50.85 8.55 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 124.595 1.184 . . . . 0.0 112.04 174.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.49 -45.77 92.81 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 118.837 -0.602 . . . . 0.0 112.251 178.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 82.6 t -51.26 -34.59 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.752 1.621 . . . . 0.0 111.065 174.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.31 -68.35 0.32 Allowed 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 118.056 -0.973 . . . . 0.0 111.138 173.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.0 tpp85 -50.87 -38.85 51.85 Favored 'General case' 0 CA--C 1.559 1.322 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 174.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.91 -65.39 0.7 Allowed 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.933 1.293 . . . . 0.0 111.734 174.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . 0.256 0.0 OUTLIER -65.71 -20.43 66.28 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.292 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.312 0 C-N-CA 124.808 1.243 . . . . 0.0 112.181 172.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -75.61 -19.44 59.24 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 172.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.6 tp -70.77 -48.81 52.33 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.939 1.296 . . . . 0.0 112.016 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -52.59 -32.32 40.79 Favored 'General case' 0 CA--C 1.555 1.17 0 O-C-N 123.999 0.812 . . . . 0.0 112.439 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.03 -48.79 62.08 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.111 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -58.21 -54.94 41.3 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 117.373 -1.298 . . . . 0.0 112.532 175.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 78.4 t -43.87 -39.63 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 125.679 1.592 . . . . 0.0 112.228 173.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.53 -69.14 0.31 Allowed 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.772 175.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -48.45 -36.5 15.09 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 174.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.9 tp -59.52 -62.21 2.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 126.714 2.006 . . . . 0.0 111.46 171.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -60.28 -24.23 64.78 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.55 0.968 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.484 173.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 . . . . . 0 N--CA 1.493 1.697 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -89.21 5.24 45.67 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 125.976 1.71 . . . . 0.0 114.433 174.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.7 tp -110.95 -50.24 2.96 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.525 0.73 . . . . 0.0 110.439 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -67.85 -24.31 65.24 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.281 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -71.79 -33.88 68.94 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 174.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -78.62 -50.41 11.54 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.987 1.315 . . . . 0.0 111.894 -178.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 85.7 t -46.85 -32.72 1.94 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-O 117.798 -1.096 . . . . 0.0 111.482 169.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.72 -63.73 1.18 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 172.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.0 ptm180 -55.19 -29.92 58.87 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 175.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.3 tp -68.92 -57.28 5.73 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.028 1.331 . . . . 0.0 111.665 173.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -59.98 -18.77 48.22 Favored 'General case' 0 C--O 1.216 -0.685 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 113.739 1.015 . . . . 0.0 113.739 167.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 119.028 -0.51 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -77.76 -14.57 59.56 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 175.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.6 tp -78.63 -45.08 22.36 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.807 1.643 . . . . 0.0 111.025 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.41 -29.93 64.52 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 124.646 1.216 . . . . 0.0 111.552 176.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -49.59 77.03 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.529 0.732 . . . . 0.0 111.076 175.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.01 -56.04 15.46 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 117.411 -1.281 . . . . 0.0 110.887 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.9 t -42.86 -39.09 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 125.214 1.571 . . . . 0.0 111.444 174.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.09 -72.76 0.12 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 117.922 -1.037 . . . . 0.0 112.782 172.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -47.92 -36.69 12.79 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.395 1.078 . . . . 0.0 112.715 177.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.7 tp -60.99 -60.14 4.26 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.897 2.079 . . . . 0.0 113.461 172.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -62.9 -25.43 68.31 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 178.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.14 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 168.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 . . . . . 0 CA--C 1.551 0.981 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -89.87 5.04 47.98 Favored 'General case' 0 CA--C 1.564 1.509 0 C-N-CA 125.917 1.687 . . . . 0.0 114.475 173.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 33.4 tp -108.1 -42.84 4.54 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.174 -0.954 . . . . 0.0 111.421 177.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -58.88 -32.77 69.78 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 175.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -64.78 -40.88 95.97 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.7 177.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -72.21 -49.6 34.04 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-O 116.342 -1.789 . . . . 0.0 110.361 -175.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.6 t -43.55 -40.95 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 124.399 1.062 . . . . 0.0 112.131 169.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.54 -64.56 0.84 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.821 0.849 . . . . 0.0 112.818 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.4 mtm105 -54.35 -27.44 36.15 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 174.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.3 tp -65.05 -60.31 3.17 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.148 1.779 . . . . 0.0 110.695 170.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . 0.3 0.1 OUTLIER -62.95 -19.13 63.98 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 178.698 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.913 0 C-N-CA 123.01 0.524 . . . . 0.0 111.354 173.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 . . . . . 0 N--CA 1.483 1.192 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.06 -18.52 61.93 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 175.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 20.5 tp -69.01 -44.41 72.84 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.097 1.359 . . . . 0.0 111.832 179.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -57.21 -31.15 65.19 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.432 1.083 . . . . 0.0 112.743 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -64.65 -48.64 74.08 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.811 172.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -61.68 -57.87 10.29 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 116.842 -1.551 . . . . 0.0 112.059 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 82.0 t -42.47 -38.61 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 125.628 1.571 . . . . 0.0 112.791 173.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.28 -66.53 0.55 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.767 0.827 . . . . 0.0 112.76 174.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -51.82 -37.6 52.4 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.119 0.967 . . . . 0.0 112.581 175.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.6 tp -57.51 -59.01 5.81 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 126.518 1.927 . . . . 0.0 112.286 171.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -61.23 -21.75 64.15 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.2 mtpt . . . . . 0 N--CA 1.483 1.193 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 172.078 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.99 -18.64 61.97 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.3 tp -66.01 -47.45 74.42 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.283 1.433 . . . . 0.0 111.571 178.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -60.53 -25.96 66.52 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 175.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -82.08 -47.52 12.48 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.309 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.72 -46.58 84.74 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 117.82 -1.086 . . . . 0.0 112.511 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 68.7 t -50.94 -34.71 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 126.062 1.745 . . . . 0.0 111.489 175.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.38 -71.52 0.15 Allowed 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.284 173.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -49.88 -36.43 27.19 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 176.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.2 tp -56.14 -62.54 1.64 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.53 1.532 . . . . 0.0 112.567 171.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -22.45 66.97 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 178.38 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 171.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.514 2.773 0 CA-C-O 122.142 0.972 . . . . 0.0 113.225 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.94 133.55 37.97 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.095 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.9 ttp85 60.73 79.72 0.24 Allowed 'General case' 0 N--CA 1.5 2.058 0 CA-C-O 123.935 1.826 . . . . 0.0 112.08 -171.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -108.64 -22.53 12.21 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 112.558 -2.11 . . . . 0.0 114.977 178.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 165.04 -32.16 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 129.551 3.14 . . . . 0.0 113.807 -173.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -90.98 -62.93 1.34 Allowed 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 35.1 mt -63.34 -16.5 60.6 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.174 174.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.46 -44.68 89.35 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 117.543 -1.217 . . . . 0.0 111.942 171.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.7 -34.54 78.08 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 123.675 0.609 . . . . 0.0 112.065 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -72.53 -54.29 9.63 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.741 176.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.5 t -63.97 -41.44 92.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 124.571 1.148 . . . . 0.0 112.265 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -62.05 -45.68 92.49 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 118.595 -0.717 . . . . 0.0 110.865 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -52.04 -26.75 11.61 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 124.368 1.043 . . . . 0.0 113.538 174.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.3 mt -64.91 -62.72 1.39 Allowed 'General case' 0 C--O 1.21 -1.001 0 CA-C-O 116.532 -1.699 . . . . 0.0 108.781 175.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.2 mt -54.78 -46.45 74.43 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-O 117.503 -1.237 . . . . 0.0 111.767 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.3 m -45.0 -34.94 2.66 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 174.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 19.8 ttpp -100.4 -54.0 2.97 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 173.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -54.65 -47.76 73.15 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.417 1.487 . . . . 0.0 112.695 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.3 -33.96 76.65 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 124.476 1.111 . . . . 0.0 111.345 175.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -76.29 -23.25 54.37 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.858 1.263 . . . . 0.0 113.773 173.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.3 tp -71.76 -46.57 58.04 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.245 1.818 . . . . 0.0 111.073 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -56.18 -34.57 66.35 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 123.78 0.675 . . . . 0.0 110.936 173.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.35 -42.13 90.81 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.088 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -65.36 -52.44 53.64 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 124.607 1.192 . . . . 0.0 111.813 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.7 t -45.05 -40.53 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 124.714 1.205 . . . . 0.0 111.975 173.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.71 -61.38 2.0 Allowed 'General case' 0 CA--C 1.549 0.937 0 O-C-N 123.907 0.754 . . . . 0.0 112.147 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 22.3 mtp85 -52.83 -37.95 60.7 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.7 tp -61.84 -57.95 9.83 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.617 1.967 . . . . 0.0 112.763 173.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -61.95 -32.43 72.85 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.135 0.574 . . . . 0.0 111.454 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.96 -31.53 59.09 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 172.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mt -65.2 -22.82 66.94 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.639 0.776 . . . . 0.0 112.688 174.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.4 t -86.01 5.91 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.351 173.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -112.2 -13.26 12.29 Favored Glycine 0 CA--C 1.54 1.595 0 C-N-CA 124.402 1.001 . . . . 0.0 114.029 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -173.41 87.64 0.06 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.626 1.571 . . . . 0.0 110.362 -178.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.7 ptt180 . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 116.849 -1.548 . . . . 0.0 114.266 175.896 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.9 tp . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 122.598 1.189 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -114.57 161.56 17.89 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.983 -175.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -114.9 136.84 52.67 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 114.467 -1.242 . . . . 0.0 109.923 -179.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 65.55 1.92 1.87 Allowed 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -173.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 tptt -119.6 -50.15 2.32 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 114.526 -1.215 . . . . 0.0 110.906 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.18 -31.8 66.25 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.754 175.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.4 mt -58.9 -39.96 83.04 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 118.256 -0.878 . . . . 0.0 112.078 173.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -66.61 -23.68 66.21 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 174.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.36 -25.04 29.45 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.692 0.797 . . . . 0.0 112.635 175.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.83 -34.59 13.09 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.9 t -59.63 -36.97 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 125.261 1.425 . . . . 0.0 111.138 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -59.38 -45.13 92.31 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 118.624 -0.703 . . . . 0.0 112.849 173.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.19 -34.92 74.28 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.155 0.582 . . . . 0.0 112.458 173.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.6 mt -63.55 -58.24 7.61 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 119.292 -0.385 . . . . 0.0 110.519 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.6 mt -59.39 -50.62 73.26 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.94 0.496 . . . . 0.0 111.568 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.0 m -53.26 -31.1 41.95 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 173.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -83.68 -46.92 11.77 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 173.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -45.45 93.14 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.813 0.845 . . . . 0.0 112.55 178.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -58.31 -38.24 76.7 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.204 1.001 . . . . 0.0 112.607 172.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -73.24 -31.32 64.06 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.343 1.457 . . . . 0.0 112.963 173.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.9 tp -68.24 -45.23 73.78 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.918 1.687 . . . . 0.0 111.138 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.39 -24.8 57.61 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 173.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.49 -49.61 8.48 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 115.238 -0.892 . . . . 0.0 113.04 173.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -59.87 -44.25 94.29 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.041 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.8 t -50.47 -35.18 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 126.094 1.758 . . . . 0.0 111.301 174.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.9 -62.7 1.35 Allowed 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.862 175.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -56.97 -27.27 61.2 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 174.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.4 tp -72.8 -56.87 4.6 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.085 1.754 . . . . 0.0 113.103 171.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -60.9 -25.06 66.45 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.099 0.96 . . . . 0.0 111.702 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -51.59 -36.53 45.89 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.649 1.58 . . . . 0.0 113.38 166.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.9 mp -54.39 -40.65 68.41 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.288 1.035 . . . . 0.0 111.35 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.2 t -95.8 16.99 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.446 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.374 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.96 -28.5 2.87 Favored Glycine 0 N--CA 1.482 1.732 0 C-N-CA 125.457 1.504 . . . . 0.0 113.371 177.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.67 60.12 1.38 Allowed 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 123.323 1.535 . . . . 0.0 113.293 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.3 mtm105 . . . . . 0 C--O 1.259 1.569 0 CA-C-N 113.938 -1.483 . . . . 0.0 112.998 -179.843 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 115.815 1.783 . . . . 0.0 115.815 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 11.8 mt-30 56.29 51.81 11.06 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 123.665 1.698 . . . . 0.0 113.707 -175.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -130.33 14.52 5.58 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 113.471 -1.695 . . . . 0.0 113.639 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 35.8 mmt -77.45 5.19 9.33 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -106.18 -27.29 11.16 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.086 1.354 . . . . 0.0 113.138 174.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -100.56 -45.78 5.42 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.542 0.737 . . . . 0.0 111.966 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.2 mt -60.97 -34.77 75.28 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 119.19 -0.433 . . . . 0.0 111.679 174.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.69 -37.6 68.55 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 116.956 -1.497 . . . . 0.0 112.024 174.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -56.41 -33.46 65.81 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.227 1.011 . . . . 0.0 112.128 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -89.27 -49.7 6.57 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.8 1.24 . . . . 0.0 111.408 177.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.7 t -57.42 -42.23 80.25 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 124.41 1.084 . . . . 0.0 112.835 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -68.26 -39.64 82.16 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.576 1.15 . . . . 0.0 111.194 174.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.67 -31.2 71.31 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 117.793 -1.099 . . . . 0.0 110.209 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 mt -61.79 -58.62 7.29 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 119.206 -0.425 . . . . 0.0 110.476 177.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.6 mt -59.04 -52.0 67.65 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 118.748 -0.644 . . . . 0.0 111.859 177.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -49.89 -33.79 18.27 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 172.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 40.6 mttm -83.12 -47.27 11.81 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 174.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.47 -44.82 95.49 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.703 0.801 . . . . 0.0 111.743 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -58.32 -39.64 79.95 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.729 0.811 . . . . 0.0 112.325 171.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -71.1 -30.8 66.99 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.02 0.928 . . . . 0.0 113.488 173.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.1 tp -67.63 -49.61 62.1 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.077 1.751 . . . . 0.0 111.543 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -59.4 -29.41 67.71 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.453 175.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -60.18 -47.62 85.18 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.907 0.883 . . . . 0.0 112.075 172.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.95 -62.86 1.55 Allowed 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.447 1.092 . . . . 0.0 111.289 174.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.5 t -42.09 -36.66 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 125.119 1.368 . . . . 0.0 111.708 177.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.64 -71.98 0.17 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.624 1.17 . . . . 0.0 113.703 173.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.85 -34.17 26.82 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 176.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -60.37 -60.78 3.26 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 126.711 2.004 . . . . 0.0 111.309 172.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -62.11 -28.5 69.67 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -72.08 -29.07 63.75 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 170.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.0 5.6 48.62 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.589 0.756 . . . . 0.0 112.979 174.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 70.9 t -124.5 4.51 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 124.762 1.225 . . . . 0.0 111.801 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.39 -14.89 8.61 Favored Glycine 0 N--CA 1.483 1.796 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.616 177.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -175.74 81.69 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 125.952 1.701 . . . . 0.0 112.175 -174.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 116.519 -1.705 . . . . 0.0 115.268 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 29.0 tp . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 119.471 -0.3 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.69 -164.81 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 O-C-N 124.971 1.42 . . . . 0.0 111.157 -174.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.0 mtm105 -146.49 -145.75 0.18 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.979 0.511 . . . . 0.0 110.961 -176.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 37.8 mmt -40.88 -28.03 0.07 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.748 1.619 . . . . 0.0 113.13 168.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -62.06 -49.45 75.92 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 175.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -80.95 -42.82 20.67 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.907 -0.496 . . . . 0.0 111.67 173.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 43.5 mt -64.39 -16.96 63.28 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 124.815 1.246 . . . . 0.0 111.485 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.63 -49.56 76.05 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 116.213 -1.851 . . . . 0.0 109.747 170.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -59.83 -35.2 74.23 Favored 'General case' 0 CA--C 1.553 1.076 0 O-C-N 124.112 0.883 . . . . 0.0 111.652 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -72.72 -53.24 12.21 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 175.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.5 t -65.87 -47.18 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 125.462 1.505 . . . . 0.0 112.432 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -62.75 -29.93 71.06 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.018 0.527 . . . . 0.0 111.425 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.91 -23.42 61.22 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 123.898 0.749 . . . . 0.0 112.453 172.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 37.5 mt -74.39 -60.93 2.05 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 117.445 -1.264 . . . . 0.0 109.362 173.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.1 mt -53.09 -44.13 67.34 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.386 0.994 . . . . 0.0 113.07 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.1 m -47.41 -41.4 20.01 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 173.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.8 ptmm? -92.97 -38.84 11.46 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 114.511 1.301 . . . . 0.0 114.511 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.63 -32.83 63.49 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 120.554 -1.341 . . . . 0.0 112.923 174.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -64.9 -46.48 81.53 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.957 1.303 . . . . 0.0 113.041 171.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -74.91 -18.55 60.39 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 122.008 0.909 . . . . 0.0 113.351 175.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.8 tp -66.85 -45.39 78.33 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.887 1.275 . . . . 0.0 111.274 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -61.72 -24.17 66.62 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -81.79 -50.71 8.93 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.545 171.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -61.65 -44.14 97.54 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 123.983 0.802 . . . . 0.0 112.895 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.7 t -50.87 -34.39 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.54 1.136 . . . . 0.0 111.932 173.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.05 -62.38 1.59 Allowed 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.453 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -34.05 59.87 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 174.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.5 tp -68.6 -54.95 13.3 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.267 1.827 . . . . 0.0 112.59 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -63.0 -27.79 69.66 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.302 0.641 . . . . 0.0 111.58 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.22 -30.18 66.3 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 124.448 1.099 . . . . 0.0 113.678 169.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.1 mt -69.49 -35.54 75.67 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.053 0.541 . . . . 0.0 111.227 176.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.7 t -89.02 15.86 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.565 1.542 0 C-N-CA 124.239 1.016 . . . . 0.0 110.848 175.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.88 -49.97 1.31 Allowed Glycine 0 CA--C 1.537 1.433 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.224 177.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -177.68 81.68 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 125.282 1.433 . . . . 0.0 112.095 -177.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.145 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.125 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.154 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 60.25 114.25 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 125.176 1.39 . . . . 0.0 111.117 178.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.8 mtm180 -85.95 15.16 5.19 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 35.4 mmt -80.17 8.99 6.17 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 113.61 -1.632 . . . . 0.0 113.253 -178.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -111.52 -30.7 7.27 Favored 'General case' 0 CA--C 1.554 1.124 0 O-C-N 124.586 1.179 . . . . 0.0 112.061 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -95.68 -47.06 6.36 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 114.968 -1.015 . . . . 0.0 112.975 175.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.3 mt -60.67 -32.72 71.91 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.805 175.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -55.11 -41.72 72.03 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-O 116.996 -1.478 . . . . 0.0 113.366 170.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -68.41 -33.51 74.35 Favored 'General case' 0 CA--C 1.557 1.215 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 176.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.2 tttm -70.88 -49.87 41.21 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.694 1.198 . . . . 0.0 112.293 174.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.0 t -69.87 -31.03 46.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.137 0.975 . . . . 0.0 112.031 177.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -55.83 -53.16 60.09 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-O 117.755 -1.117 . . . . 0.0 111.495 175.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -60.98 -24.57 66.21 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 125.154 1.534 . . . . 0.0 113.18 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.4 mt -75.43 -62.19 1.65 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 117.117 -1.421 . . . . 0.0 109.553 173.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 19.0 mt -55.28 -48.28 74.28 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 118.138 -0.934 . . . . 0.0 112.602 -178.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.1 p -48.44 -36.2 14.44 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.445 1.098 . . . . 0.0 112.462 175.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.2 mtmp? -90.24 -45.97 8.72 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.753 1.221 . . . . 0.0 113.717 176.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.64 -32.43 59.02 Favored 'General case' 0 CA--C 1.553 1.093 0 O-C-N 120.608 -1.308 . . . . 0.0 112.333 174.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -65.08 -51.13 63.16 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.064 1.345 . . . . 0.0 111.384 171.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.36 -15.09 63.24 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 175.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -65.47 -35.79 81.95 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.012 0.925 . . . . 0.0 112.405 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.34 -27.41 67.34 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 176.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -55.33 -30.77 60.91 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.98 0.912 . . . . 0.0 111.392 175.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.83 -60.58 2.19 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.4 1.48 . . . . 0.0 109.303 -178.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 78.3 t -41.58 -39.5 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 124.369 1.068 . . . . 0.0 112.276 173.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.49 -66.53 0.53 Allowed 'General case' 0 CA--C 1.549 0.912 0 O-C-N 123.902 0.751 . . . . 0.0 112.887 175.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.3 -36.83 54.11 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 124.095 0.958 . . . . 0.0 113.424 176.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.9 tp -64.09 -53.74 44.88 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.375 2.27 . . . . 0.0 112.431 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.67 -26.08 67.8 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 123.695 0.622 . . . . 0.0 111.153 177.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -76.79 -24.87 52.84 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 171.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 27.9 mt -71.8 -32.34 67.5 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.571 0.749 . . . . 0.0 111.295 172.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.9 t -86.27 13.55 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.051 0.541 . . . . 0.0 111.704 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -94.3 -42.54 3.96 Favored Glycine 0 CA--C 1.539 1.581 0 C-N-CA 124.991 1.282 . . . . 0.0 112.557 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -143.68 17.66 1.82 Allowed 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 114.8 1.408 . . . . 0.0 114.8 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 116.06 -1.924 . . . . 0.0 112.785 -178.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 122.201 1.0 . . . . 0.0 113.101 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -162.39 173.45 14.09 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 113.652 -1.613 . . . . 0.0 111.347 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 26.2 mtt85 -89.9 12.66 16.71 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 113.969 -1.469 . . . . 0.0 114.333 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.25 -11.73 59.85 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 178.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.88 -25.49 26.16 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.733 0.813 . . . . 0.0 112.014 173.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.44 -39.37 7.99 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.329 0.652 . . . . 0.0 111.871 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.4 mt -62.73 -47.08 85.12 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 117.622 -1.18 . . . . 0.0 110.328 177.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.08 -29.61 70.5 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 174.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -72.51 -37.88 68.25 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.332 0.653 . . . . 0.0 112.309 174.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.4 -30.61 23.46 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 79.3 t -70.63 -37.55 69.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 125.155 1.382 . . . . 0.0 111.055 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.8 -39.47 91.85 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 174.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.38 -28.02 67.88 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 115.355 -0.839 . . . . 0.0 112.621 173.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.9 mt -65.55 -62.15 1.69 Allowed 'General case' 0 C--O 1.205 -1.253 0 CA-C-O 117.806 -1.092 . . . . 0.0 109.083 176.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.4 mt -55.86 -47.06 78.0 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 117.942 -1.027 . . . . 0.0 111.829 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.5 m -45.52 -34.49 3.3 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -95.91 -58.87 1.98 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.709 1.204 . . . . 0.0 112.003 172.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.74 -46.12 81.55 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.935 2.094 . . . . 0.0 114.175 -176.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -62.86 -34.98 78.49 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.801 1.241 . . . . 0.0 110.01 173.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -86.31 7.01 27.18 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 126.242 1.817 . . . . 0.0 113.34 172.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 tp -111.82 -42.29 3.84 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 120.592 -1.317 . . . . 0.0 110.934 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -29.8 68.09 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.969 172.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -66.42 -43.76 84.83 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 120.966 0.412 . . . . 0.0 111.675 174.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.65 -52.75 34.45 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 117.939 -1.029 . . . . 0.0 111.812 -178.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 98.9 t -43.09 -41.21 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 O-C-N 124.748 1.28 . . . . 0.0 111.376 170.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.42 -67.64 0.43 Allowed 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 117.414 -1.279 . . . . 0.0 112.302 174.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.8 mtm-85 -51.71 -35.57 43.45 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 177.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -63.15 -60.32 3.58 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.889 2.075 . . . . 0.0 112.0 172.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -64.61 -19.58 65.77 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 119.019 -0.515 . . . . 0.0 112.359 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.9 mmtp -65.08 -20.26 66.39 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 169.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.4 mt -94.58 -26.06 16.54 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.173 0.989 . . . . 0.0 111.22 176.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.3 t -104.54 17.89 5.09 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 C-N-CA 124.925 1.29 . . . . 0.0 111.53 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.85 -39.15 0.72 Allowed Glycine 0 N--CA 1.479 1.55 0 C-N-CA 124.661 1.125 . . . . 0.0 112.012 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -107.46 34.59 3.44 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.652 0.781 . . . . 0.0 111.023 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 . . . . . 0 C--O 1.259 1.587 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -178.774 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 37.73 41.27 0.31 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 125.129 1.372 . . . . 0.0 113.843 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.4 mpp_? -80.15 48.97 1.05 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.668 -175.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 34.5 mmt -62.08 -14.84 40.3 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.417 1.487 . . . . 0.0 112.581 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.18 -55.1 5.72 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.08 1.352 . . . . 0.0 111.364 168.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -79.63 -49.49 12.07 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 125.825 1.65 . . . . 0.0 113.937 -178.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 73.8 mt -52.11 -30.84 28.12 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.483 1.113 . . . . 0.0 110.823 174.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -65.97 -22.5 66.48 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 172.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.75 -38.7 70.37 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.193 0.997 . . . . 0.0 110.186 176.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.59 -23.26 22.0 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 174.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.8 t -48.91 -41.22 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 172.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -71.22 -42.12 69.33 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.77 176.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -60.57 -20.49 60.59 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 65.3 mt -66.62 -62.54 1.4 Allowed 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 118.017 -0.992 . . . . 0.0 108.68 175.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.0 mt -55.95 -44.77 78.75 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-O 117.351 -1.309 . . . . 0.0 111.729 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.7 p -50.87 -27.72 8.05 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -103.08 -53.02 2.91 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.024 1.73 . . . . 0.0 112.554 175.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -60.15 -44.85 94.64 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.618 1.967 . . . . 0.0 114.085 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.91 -38.31 88.39 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.923 1.289 . . . . 0.0 111.337 174.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -68.4 -29.45 68.14 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.907 1.283 . . . . 0.0 112.31 171.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.1 tp -67.67 -46.52 72.13 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.545 1.938 . . . . 0.0 110.92 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -60.47 -24.3 65.15 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.949 0.781 . . . . 0.0 112.436 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -80.08 -56.9 3.91 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.103 0.961 . . . . 0.0 111.904 169.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -56.37 -44.33 80.05 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-O 118.371 -0.824 . . . . 0.0 112.796 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -49.82 -36.58 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 126.946 2.099 . . . . 0.0 111.63 173.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.31 -66.05 0.59 Allowed 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.736 175.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -51.19 -41.56 60.3 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.257 0.623 . . . . 0.0 111.843 175.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.2 tp -56.06 -64.07 0.98 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.345 1.858 . . . . 0.0 112.044 173.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -65.06 -18.0 64.93 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.3 mmtp -77.32 -30.02 53.83 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.969 0.908 . . . . 0.0 113.15 170.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.1 pp -100.36 -0.7 37.76 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.382 1.623 . . . . 0.0 115.382 174.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 70.4 t -124.97 4.13 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 125.441 1.496 . . . . 0.0 111.765 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.43 -41.61 2.17 Favored Glycine 0 N--CA 1.479 1.558 0 C-N-CA 124.035 0.826 . . . . 0.0 111.937 177.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.95 70.96 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 125.265 1.426 . . . . 0.0 113.53 -175.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 . . . . . 0 C--O 1.254 1.308 0 CA-C-O 117.393 -1.289 . . . . 0.0 113.732 175.611 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.511 2.591 0 CA-C-O 122.508 1.147 . . . . 0.0 113.26 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -113.41 88.29 2.8 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 123.525 1.631 . . . . 0.0 110.941 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -133.31 150.42 51.88 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 111.911 -2.404 . . . . 0.0 109.874 177.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 31.3 mmt 64.92 6.51 3.43 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 114.174 -1.376 . . . . 0.0 114.563 -177.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -108.57 -42.11 4.63 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.545 1.138 . . . . 0.0 113.529 173.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -92.3 -34.64 14.14 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 175.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.1 mt -65.49 -32.34 73.9 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.752 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.22 -34.88 73.43 Favored 'General case' 0 CA--C 1.552 1.056 0 CA-C-N 115.232 -0.895 . . . . 0.0 112.769 173.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -38.84 90.05 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.828 0.851 . . . . 0.0 112.366 175.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.53 -40.1 85.04 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.252 173.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.72 -45.27 95.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 C-N-CA 123.28 0.632 . . . . 0.0 112.337 177.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -67.43 -32.21 72.93 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.09 -20.0 63.57 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.808 0.843 . . . . 0.0 112.85 177.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.8 mt -66.95 -63.96 0.95 Allowed 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 117.19 -1.386 . . . . 0.0 108.795 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.8 mt -55.22 -46.74 75.95 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 117.667 -1.158 . . . . 0.0 111.731 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 m -46.11 -31.36 2.32 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 172.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.59 -50.1 3.66 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 172.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -58.99 -46.74 87.4 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.295 1.838 . . . . 0.0 113.131 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.98 -34.81 78.95 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.93 1.292 . . . . 0.0 110.753 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -72.38 -29.48 63.81 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.359 1.463 . . . . 0.0 112.968 172.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.1 tp -68.57 -43.19 77.1 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 126.305 1.842 . . . . 0.0 111.717 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -52.22 -31.47 32.24 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 124.37 1.044 . . . . 0.0 112.465 174.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.45 -46.27 77.0 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.53 0.732 . . . . 0.0 111.978 174.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -61.18 -48.39 81.76 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 174.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.1 t -46.67 -40.93 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 CA-C-O 117.301 -1.333 . . . . 0.0 109.938 171.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.31 -62.37 1.81 Allowed 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 116.21 -1.852 . . . . 0.0 112.057 173.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -47.38 -40.88 18.61 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 119.367 0.985 . . . . 0.0 113.296 176.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.6 tp -65.16 -60.3 3.16 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 126.992 2.117 . . . . 0.0 112.391 173.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -60.36 -28.94 68.58 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.915 1.286 . . . . 0.0 110.674 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.0 mmtm -49.47 -33.62 14.8 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 119.389 0.995 . . . . 0.0 111.707 172.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.8 mp -71.74 -47.78 51.46 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.09 0.956 . . . . 0.0 113.395 173.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.4 t -89.19 17.97 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 C-N-CA 124.056 0.942 . . . . 0.0 111.278 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -121.46 -41.42 0.5 Allowed Glycine 0 CA--C 1.533 1.205 0 C-N-CA 125.297 1.427 . . . . 0.0 111.52 -176.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.98 38.4 1.08 Allowed 'General case' 0 N--CA 1.485 1.29 0 CA-C-O 122.388 1.09 . . . . 0.0 111.018 174.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.306 0 CA-C-N 114.584 -1.189 . . . . 0.0 112.022 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -61.56 96.15 0.06 Allowed 'General case' 0 N--CA 1.488 1.455 0 CA-C-O 123.109 1.433 . . . . 0.0 112.31 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.407 ' C ' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -122.96 151.04 42.21 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 112.932 -1.94 . . . . 0.0 112.627 -178.892 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.67 5.74 0.99 Allowed 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 112.512 -2.131 . . . . 0.0 114.305 -168.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.407 ' H ' ' C ' ' A' ' 3' ' ' ARG . 0.1 OUTLIER -116.07 -23.5 8.47 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 125.127 1.371 . . . . 0.0 114.182 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -110.23 -26.99 9.33 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 165.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 49.0 mt -66.46 -40.5 89.44 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 121.769 -0.582 . . . . 0.0 111.581 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -62.7 -31.25 72.12 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-O 116.545 -1.693 . . . . 0.0 111.445 173.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -40.91 86.75 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 121.034 1.743 . . . . 0.0 111.476 177.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -80.53 -45.7 17.02 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 112.794 -2.003 . . . . 0.0 110.385 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.7 t -67.05 -18.35 24.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 124.333 1.053 . . . . 0.0 113.279 175.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 63.0 tt0 -71.68 -39.4 70.26 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 125.359 1.464 . . . . 0.0 111.49 174.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -58.74 -22.32 57.52 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 125.211 1.57 . . . . 0.0 110.797 175.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.7 mt -67.15 -64.68 0.8 Allowed 'General case' 0 C--O 1.215 -0.732 0 CA-C-O 116.713 -1.613 . . . . 0.0 109.543 175.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.7 mt -54.78 -47.39 74.02 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-O 117.739 -1.124 . . . . 0.0 112.097 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 62.3 m -45.28 -33.34 2.35 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 172.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.04 -52.95 3.4 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 170.099 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -57.61 -46.37 84.17 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 126.159 1.784 . . . . 0.0 113.203 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -63.31 -34.9 78.7 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.66 1.184 . . . . 0.0 110.828 175.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -81.82 -9.1 59.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.185 1.394 . . . . 0.0 114.071 173.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.2 tp -89.54 -44.56 10.02 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 125.668 1.587 . . . . 0.0 109.756 -177.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.16 -29.06 68.42 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.127 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.5 -47.47 14.22 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 123.477 0.486 . . . . 0.0 111.705 172.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -64.51 -45.04 88.95 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.53 -0.748 . . . . 0.0 112.427 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 62.8 t -50.65 -34.83 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.526 1.53 . . . . 0.0 111.064 172.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -71.98 0.12 Allowed 'General case' 0 CA--C 1.537 0.451 0 O-C-N 124.757 1.286 . . . . 0.0 111.339 171.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.65 -31.04 45.91 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.3 tp -64.47 -65.12 0.72 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 126.538 1.935 . . . . 0.0 112.768 172.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -22.02 65.06 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 121.919 -0.488 . . . . 0.0 111.574 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -64.59 -16.51 62.8 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.3 1.04 . . . . 0.0 113.467 172.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 28.3 mt -73.8 -17.37 61.09 Favored 'General case' 0 C--O 1.21 -1.02 0 O-C-N 125.039 1.462 . . . . 0.0 112.953 168.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 57.4 t -93.65 8.42 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 124.112 0.965 . . . . 0.0 111.309 176.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -88.74 -28.07 22.49 Favored Glycine 0 N--CA 1.485 1.965 0 C-N-CA 124.264 0.935 . . . . 0.0 113.608 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -121.1 35.74 4.8 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.775 1.63 . . . . 0.0 112.467 -176.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 116.675 -1.631 . . . . 0.0 114.128 176.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? 68.2 95.8 0.06 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 124.851 1.344 . . . . 0.0 111.407 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.73 137.45 0.6 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 127.023 2.129 . . . . 0.0 108.709 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.4 tpp 75.34 -29.49 0.19 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 126.046 1.738 . . . . 0.0 114.812 -178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -77.94 -34.83 51.02 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.615 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -89.46 -36.59 15.34 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 123.12 0.262 . . . . 0.0 111.502 169.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.5 mt -53.5 -34.02 56.52 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 116.813 -1.565 . . . . 0.0 112.164 -178.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -56.29 -51.87 66.58 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.73 1.382 . . . . 0.0 114.73 170.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.59 -23.14 53.47 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 178.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.89 -32.15 31.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.545 1.538 . . . . 0.0 112.552 174.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.1 t -67.27 -45.22 86.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 125.936 1.695 . . . . 0.0 111.419 177.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -66.43 -41.9 88.5 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 123.94 0.775 . . . . 0.0 111.448 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.24 -22.14 60.65 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 114.902 -1.045 . . . . 0.0 112.96 177.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.3 -59.28 5.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.193 0.597 . . . . 0.0 111.393 177.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.3 mt -58.85 -49.99 75.68 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.323 0.649 . . . . 0.0 110.564 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.8 m -50.77 -36.93 39.25 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.8 1.24 . . . . 0.0 113.511 174.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -80.61 -49.07 11.76 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.918 0.887 . . . . 0.0 113.196 174.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -58.89 -42.07 88.65 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.174 0.99 . . . . 0.0 112.772 178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -58.79 -45.15 90.54 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.999 171.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.35 -33.93 77.13 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.36 1.064 . . . . 0.0 113.138 174.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -69.52 -46.28 66.88 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 126.451 1.9 . . . . 0.0 111.485 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -57.36 -30.64 65.03 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 174.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -64.72 -45.75 85.21 Favored 'General case' 0 N--CA 1.485 1.275 0 CA-C-N 114.406 -1.27 . . . . 0.0 111.132 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -61.51 -50.12 73.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 118.035 -0.983 . . . . 0.0 112.763 177.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 71.9 t -44.14 -39.55 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 C-N-CA 125.46 1.504 . . . . 0.0 112.002 171.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.55 -68.3 0.38 Allowed 'General case' 0 N--CA 1.482 1.157 0 CA-C-O 118.2 -0.905 . . . . 0.0 112.073 174.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.1 ttt180 -51.01 -34.3 28.68 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 176.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.5 tp -61.76 -57.63 11.14 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.651 1.981 . . . . 0.0 112.544 171.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -63.16 -24.34 67.84 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.39 -20.7 63.81 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.607 1.163 . . . . 0.0 113.581 169.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.6 mt -67.75 -26.34 66.08 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 120.884 -1.135 . . . . 0.0 111.791 175.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 42.5 t -85.08 12.81 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 CA-C-O 122.432 1.11 . . . . 0.0 111.478 173.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.54 -21.88 12.14 Favored Glycine 0 CA--C 1.549 2.173 0 C-N-CA 125.191 1.376 . . . . 0.0 113.15 175.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -104.92 -89.2 0.42 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.972 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.139 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -112.52 85.52 2.18 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-O 122.815 1.293 . . . . 0.0 109.53 176.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.24 -9.01 9.61 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 110.141 -3.209 . . . . 0.0 114.156 175.236 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.4 mpp? 50.69 25.97 2.3 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.606 1.163 . . . . 0.0 113.009 -173.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.9 12.38 4.78 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 126.735 2.014 . . . . 0.0 113.864 -175.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -120.44 -45.99 2.4 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.125 1.37 . . . . 0.0 113.509 -176.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.4 mt -61.61 -27.96 69.03 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.884 -0.51 . . . . 0.0 111.076 171.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -68.38 -46.12 70.89 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.202 171.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.56 -36.28 80.18 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 124.4 1.063 . . . . 0.0 111.875 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . 0.261 0.0 OUTLIER -75.36 -28.73 59.67 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 175.045 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 12.9 t -57.94 -45.42 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 123.368 0.417 . . . . 0.0 111.328 177.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -69.07 -33.62 73.84 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 176.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -59.91 -24.42 64.3 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 124.01 0.818 . . . . 0.0 111.892 175.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.8 mt -64.85 -64.44 0.87 Allowed 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 117.342 -1.313 . . . . 0.0 109.414 174.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.9 mt -55.86 -44.56 78.19 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 118.031 -0.985 . . . . 0.0 111.568 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 t -49.53 -29.53 7.01 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 174.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.0 mmtp -101.28 -52.94 3.13 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 126.101 1.76 . . . . 0.0 113.666 173.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -59.49 -46.96 87.31 Favored 'General case' 0 CA--C 1.56 1.337 0 C-N-CA 126.742 2.017 . . . . 0.0 113.828 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.73 -32.21 73.79 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.64 1.176 . . . . 0.0 111.135 174.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -76.49 -25.09 53.91 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.454 1.502 . . . . 0.0 112.77 173.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.7 tp -72.88 -48.16 39.79 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.91 1.684 . . . . 0.0 111.506 -178.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.14 -30.73 62.55 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 123.666 0.604 . . . . 0.0 111.436 175.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.8 -41.77 91.53 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.801 174.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -61.5 -52.8 63.0 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.314 1.009 . . . . 0.0 113.27 173.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.2 t -46.31 -37.78 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 C-N-CA 124.248 1.019 . . . . 0.0 112.062 173.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.13 -64.16 0.91 Allowed 'General case' 0 N--CA 1.484 1.255 0 O-C-N 123.746 0.654 . . . . 0.0 112.374 175.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.0 ptp85 -53.25 -31.23 42.44 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 175.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.9 tp -67.98 -55.59 12.1 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.982 1.713 . . . . 0.0 112.009 172.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -62.81 -24.27 67.67 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -60.67 -29.65 69.43 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.619 1.568 . . . . 0.0 113.415 169.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.64 -28.38 66.84 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.484 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.6 t -88.28 15.39 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 124.364 1.066 . . . . 0.0 110.326 174.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.75 -45.71 1.74 Allowed Glycine 0 CA--C 1.541 1.705 0 C-N-CA 125.13 1.347 . . . . 0.0 111.809 177.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -85.64 20.73 2.03 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.208 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.415 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.03 58.61 0.22 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 126.658 1.983 . . . . 0.0 111.543 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 179.13 72.04 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 116.1 1.889 . . . . 0.0 116.1 -170.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -98.51 -25.69 14.68 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 177.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.5 tttm 172.54 -40.48 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 126.933 2.093 . . . . 0.0 111.463 -171.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -96.55 -55.48 2.9 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 113.676 -1.602 . . . . 0.0 113.038 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 36.6 mt -69.76 -24.11 63.47 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.348 176.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -63.7 -36.15 82.9 Favored 'General case' 0 C--O 1.204 -1.34 0 CA-C-O 117.254 -1.355 . . . . 0.0 111.964 173.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -56.14 -34.83 66.48 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 123.895 0.747 . . . . 0.0 112.567 177.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -81.76 -50.01 9.74 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 114.248 -1.342 . . . . 0.0 111.277 177.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.9 t -65.09 -15.71 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 124.316 1.047 . . . . 0.0 112.619 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.32 -44.91 96.41 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.437 1.495 . . . . 0.0 110.454 175.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.18 -28.6 69.25 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 125.593 1.808 . . . . 0.0 111.355 175.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 45.4 mt -71.33 -59.73 2.61 Favored 'General case' 0 C--O 1.195 -1.767 0 CA-C-O 118.718 -0.658 . . . . 0.0 110.412 175.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 15.3 mt -57.89 -49.12 77.79 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 124.24 0.962 . . . . 0.0 112.904 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.5 p -51.18 -35.1 34.55 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.734 0.813 . . . . 0.0 112.478 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.1 tmmm? -80.06 -55.86 4.64 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 170.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -48.77 -33.5 10.45 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 125.609 1.563 . . . . 0.0 111.823 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -69.36 -44.56 71.34 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 126.034 1.734 . . . . 0.0 112.668 173.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -79.09 -10.93 59.96 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 174.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -70.41 -52.69 20.52 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 125.273 1.429 . . . . 0.0 111.757 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -56.2 -28.71 59.24 Favored 'General case' 0 CA--C 1.553 1.086 0 O-C-N 124.564 1.165 . . . . 0.0 111.554 174.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.7 -46.2 90.72 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.807 176.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -50.0 75.46 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.894 0.478 . . . . 0.0 111.679 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 83.7 t -43.05 -40.53 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.192 -1.931 0 O-C-N 124.882 1.364 . . . . 0.0 111.648 171.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.96 -54.83 18.08 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 117.934 -1.031 . . . . 0.0 113.208 175.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.554 ' CZ ' ' HZ1' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -52.1 -38.7 58.17 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-N 118.527 0.603 . . . . 0.0 111.851 173.865 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.1 tp -67.79 -55.46 12.92 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.868 1.267 . . . . 0.0 112.027 172.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? -58.39 -31.17 67.42 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 126.339 1.856 . . . . 0.0 109.937 -178.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.554 ' HZ1' ' CZ ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -53.35 -35.39 60.19 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-N 118.99 0.814 . . . . 0.0 111.586 173.631 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.1 mp -71.27 -41.16 70.38 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.23 174.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 57.4 t -82.7 6.67 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 C-N-CA 123.877 0.871 . . . . 0.0 111.524 175.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -90.31 -42.5 5.21 Favored Glycine 0 N--CA 1.484 1.888 0 C-N-CA 125.11 1.338 . . . . 0.0 111.104 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -129.41 12.6 5.98 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.302 1.964 . . . . 0.0 116.302 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.933 0 CA-C-O 116.442 -1.742 . . . . 0.0 113.489 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.1 pt? . . . . . 0 CA--C 1.552 1.024 0 CA-C-O 121.88 0.848 . . . . 0.0 112.747 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -155.92 159.83 39.62 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 114.23 -1.35 . . . . 0.0 108.908 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 89.08 119.5 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 127.113 2.165 . . . . 0.0 109.374 170.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.6 mmt -57.27 -29.64 64.02 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 113.782 1.03 . . . . 0.0 113.782 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -73.63 -12.15 60.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 125.7 1.875 . . . . 0.0 114.046 171.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -113.31 -36.75 4.9 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 175.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.7 mt -56.8 -44.01 81.5 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 175.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -66.53 -30.48 70.8 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 114.507 -1.224 . . . . 0.0 111.743 173.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -41.4 81.41 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.466 0.706 . . . . 0.0 110.264 177.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -66.12 -42.97 88.44 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 113.925 -1.489 . . . . 0.0 110.53 174.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.3 t -66.53 -34.15 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 121.698 -0.626 . . . . 0.0 112.25 175.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -59.73 -36.14 75.98 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 117.707 -1.14 . . . . 0.0 111.751 178.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -53.94 -36.05 62.38 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 124.382 1.051 . . . . 0.0 111.922 173.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.7 mt -69.76 -60.12 2.51 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 114.81 -1.086 . . . . 0.0 108.906 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.1 mt -55.71 -47.38 76.96 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 118.332 -0.842 . . . . 0.0 112.215 178.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.0 t -49.02 -38.25 23.07 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.752 1.221 . . . . 0.0 112.624 174.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.74 -44.74 12.27 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 172.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -55.18 -33.47 63.03 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.572 1.549 . . . . 0.0 112.288 178.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -66.22 -39.92 89.94 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 125.568 1.547 . . . . 0.0 113.648 170.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -80.1 -16.21 55.48 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 172.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.4 tp -76.76 -46.19 26.17 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.159 1.384 . . . . 0.0 112.483 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -51.02 -31.85 19.61 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 174.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -58.59 -53.75 54.85 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.599 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -60.28 -55.26 35.91 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 116.818 -1.563 . . . . 0.0 110.314 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.9 t -42.97 -40.03 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 124.837 1.255 . . . . 0.0 112.333 174.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.97 -66.0 0.61 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.958 0.903 . . . . 0.0 112.865 175.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.3 mmm-85 -53.19 -31.71 44.24 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 174.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.7 tp -64.67 -58.97 4.84 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.28 1.832 . . . . 0.0 111.998 170.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -62.68 -21.18 65.55 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 122.956 0.502 . . . . 0.0 112.181 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -34.49 77.83 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.826 0.85 . . . . 0.0 112.766 168.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 pp -104.97 8.15 34.39 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 176.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 69.4 t -128.06 4.13 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 125.338 1.455 . . . . 0.0 112.749 177.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.63 -32.25 1.96 Allowed Glycine 0 N--CA 1.487 2.063 0 C-N-CA 123.829 0.728 . . . . 0.0 113.761 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -118.88 -91.77 0.55 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.69 0.796 . . . . 0.0 111.882 -178.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.262 1.717 0 CA-C-O 115.83 -2.033 . . . . 0.0 113.336 177.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 63.81 96.51 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.821 1.248 . . . . 0.0 112.387 -179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.99 75.53 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 112.871 -1.968 . . . . 0.0 115.145 -174.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.53 -29.55 14.85 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 114.02 -1.446 . . . . 0.0 114.391 178.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 167.99 -30.12 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 129.318 3.047 . . . . 0.0 113.677 -172.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.4 mp0 -100.72 -54.16 2.89 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.761 -178.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 30.3 mt -68.46 -21.83 64.6 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-N 114.077 -1.419 . . . . 0.0 112.167 176.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -67.29 -31.84 72.42 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 172.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.76 -35.49 63.83 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 123.805 0.691 . . . . 0.0 111.337 174.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.2 mmtt -76.16 -18.25 59.2 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 112.825 -1.989 . . . . 0.0 111.769 -178.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.8 t -90.93 -41.47 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 C-N-CA 125.325 1.45 . . . . 0.0 109.623 178.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -61.43 -37.15 82.49 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.026 0.53 . . . . 0.0 111.777 174.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -60.98 -26.83 67.85 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 124.453 1.095 . . . . 0.0 113.014 171.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.0 mt -73.59 -63.98 1.09 Allowed 'General case' 0 N--CA 1.481 1.106 0 CA-C-O 116.73 -1.605 . . . . 0.0 108.374 177.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.0 mt -52.36 -46.53 66.19 Favored 'General case' 0 N--CA 1.485 1.3 0 O-C-N 124.687 1.242 . . . . 0.0 112.73 -178.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.1 p -45.58 -33.41 2.79 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 16.1 mttt -103.26 -55.26 2.44 Favored 'General case' 0 C--O 1.213 -0.826 0 C-N-CA 125.821 1.648 . . . . 0.0 115.274 172.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.45 -38.13 58.56 Favored 'General case' 0 CA--C 1.568 1.639 0 C-N-CA 125.05 1.34 . . . . 0.0 113.175 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.46 -39.69 67.57 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 124.593 1.157 . . . . 0.0 110.729 176.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -76.87 -12.8 60.01 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 123.81 0.694 . . . . 0.0 112.854 173.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.9 tp -76.76 -55.89 5.09 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.943 1.697 . . . . 0.0 110.789 -176.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.15 -25.58 33.12 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 124.728 1.268 . . . . 0.0 113.201 173.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -82.2 -50.85 8.55 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 124.595 1.184 . . . . 0.0 112.04 174.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.49 -45.77 92.81 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 118.837 -0.602 . . . . 0.0 112.251 178.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 82.6 t -51.26 -34.59 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.752 1.621 . . . . 0.0 111.065 174.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.31 -68.35 0.32 Allowed 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 118.056 -0.973 . . . . 0.0 111.138 173.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.0 tpp85 -50.87 -38.85 51.85 Favored 'General case' 0 CA--C 1.559 1.322 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 174.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.91 -65.39 0.7 Allowed 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.933 1.293 . . . . 0.0 111.734 174.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . 0.256 0.0 OUTLIER -65.71 -20.43 66.28 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.292 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.62 -33.45 66.28 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.808 1.243 . . . . 0.0 112.181 172.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.0 pp -103.56 13.31 33.64 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 175.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.6 t -118.1 -12.71 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.871 175.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.31 -46.7 6.03 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.066 1.317 . . . . 0.0 111.738 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.03 18.31 9.41 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 . . . . . 0 C--O 1.263 1.775 0 C-N-CA 126.289 1.835 . . . . 0.0 113.355 -171.934 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.896 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.32 144.14 50.91 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 114.151 -1.386 . . . . 0.0 107.901 176.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 78.84 66.89 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 128.399 2.679 . . . . 0.0 110.632 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.11 -35.15 24.5 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 177.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp -59.62 -50.67 72.97 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 125.117 1.367 . . . . 0.0 110.969 176.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 38.5 tp60 -76.98 -44.15 32.17 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.461 1.104 . . . . 0.0 113.283 176.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.0 mt -54.0 -33.89 58.33 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 118.396 -0.811 . . . . 0.0 111.796 175.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.98 -21.73 66.33 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.84 -41.24 68.37 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.972 0.909 . . . . 0.0 110.284 175.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . 0.254 0.1 OUTLIER -89.2 -26.03 21.46 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.906 1.817 . . . . 0.0 115.906 176.054 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 24.1 t -45.97 -40.62 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 172.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.37 -48.54 67.13 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 174.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -55.98 -29.68 60.63 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.323 1.049 . . . . 0.0 111.602 173.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.9 mt -66.71 -62.74 1.29 Allowed 'General case' 0 C--O 1.212 -0.872 0 CA-C-O 117.769 -1.11 . . . . 0.0 109.599 175.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.1 -45.72 75.49 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 118.38 -0.819 . . . . 0.0 113.116 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.5 p -51.45 -35.49 39.85 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.291 0.636 . . . . 0.0 112.312 176.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -91.19 -43.32 9.93 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 176.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -54.25 -31.86 54.61 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.298 1.039 . . . . 0.0 112.137 174.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -68.83 -41.86 77.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.989 1.715 . . . . 0.0 113.604 172.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -75.61 -19.44 59.24 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 172.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.6 tp -70.77 -48.81 52.33 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.939 1.296 . . . . 0.0 112.016 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -52.59 -32.32 40.79 Favored 'General case' 0 CA--C 1.555 1.17 0 O-C-N 123.999 0.812 . . . . 0.0 112.439 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.03 -48.79 62.08 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.111 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -58.21 -54.94 41.3 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 117.373 -1.298 . . . . 0.0 112.532 175.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 78.4 t -43.87 -39.63 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 125.679 1.592 . . . . 0.0 112.228 173.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.53 -69.14 0.31 Allowed 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.772 175.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -48.45 -36.5 15.09 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 174.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.9 tp -59.52 -62.21 2.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 126.714 2.006 . . . . 0.0 111.46 171.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -60.28 -24.23 64.78 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -78.8 -34.27 45.55 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.484 173.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.26 1.29 53.63 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 174.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 44.2 t -114.1 4.71 7.83 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.229 0 C-N-CA 123.9 0.88 . . . . 0.0 111.88 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -92.3 -39.25 5.43 Favored Glycine 0 N--CA 1.481 1.69 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.955 175.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -144.68 20.7 1.66 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 ttt-85 . . . . . 0 C--O 1.257 1.497 0 CA-C-O 115.837 -2.03 . . . . 0.0 114.479 -176.001 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.59 46.99 0.5 Allowed 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 115.24 -0.891 . . . . 0.0 113.355 -177.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 74.75 140.87 0.07 Allowed 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 127.894 2.477 . . . . 0.0 110.647 -177.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.2 mmt -57.35 -46.77 82.99 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -24.11 22.7 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 172.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.599 HE22 ' CE ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -98.43 -42.22 7.44 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 173.066 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 58.8 mt -57.18 -42.4 81.1 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 172.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -55.93 -36.5 67.81 Favored 'General case' 0 N--CA 1.482 1.16 0 CA-C-O 117.198 -1.382 . . . . 0.0 112.127 175.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -59.75 -33.54 71.79 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 173.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.599 ' CE ' HE22 ' A' ' 6' ' ' GLN . 13.4 mmtt -87.16 -30.16 21.24 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.915 1.286 . . . . 0.0 110.757 -177.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 12.4 t -79.81 -28.49 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 125.45 1.5 . . . . 0.0 111.668 176.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -65.33 -47.13 77.6 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.997 1.319 . . . . 0.0 112.536 176.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -58.08 -30.31 66.13 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 114.229 -1.351 . . . . 0.0 111.375 173.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.9 mt -66.19 -61.89 1.78 Allowed 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.67 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.0 mt -53.2 -42.04 65.88 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.1 m -50.83 -44.73 59.39 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 173.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 16.1 pttm -86.09 -35.72 20.07 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 174.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.48 -43.94 97.98 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.724 1.21 . . . . 0.0 112.341 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -58.59 -35.46 72.46 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 124.62 1.2 . . . . 0.0 111.888 170.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -89.21 5.24 45.67 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 125.976 1.71 . . . . 0.0 114.433 174.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.7 tp -110.95 -50.24 2.96 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.525 0.73 . . . . 0.0 110.439 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -67.85 -24.31 65.24 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.281 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -71.79 -33.88 68.94 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 174.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -78.62 -50.41 11.54 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.987 1.315 . . . . 0.0 111.894 -178.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 85.7 t -46.85 -32.72 1.94 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-O 117.798 -1.096 . . . . 0.0 111.482 169.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.72 -63.73 1.18 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 172.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.0 ptm180 -55.19 -29.92 58.87 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 175.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.3 tp -68.92 -57.28 5.73 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.028 1.331 . . . . 0.0 111.665 173.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -59.98 -18.77 48.22 Favored 'General case' 0 C--O 1.216 -0.685 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.96 -37.64 69.29 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.739 1.015 . . . . 0.0 113.739 167.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -29.56 45.64 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.195 176.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 61.8 t -90.85 13.43 1.7 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.605 0 C-N-CA 124.985 1.314 . . . . 0.0 110.959 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.23 -41.64 3.19 Favored Glycine 0 N--CA 1.484 1.893 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -138.63 27.82 2.47 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -176.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.436 ' H2 ' ' CZ ' ' A' ' 3' ' ' ARG . 3.0 mm? . . . . . 0 N--CA 1.485 1.293 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -74.92 90.06 2.4 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.859 0.864 . . . . 0.0 110.213 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.436 ' CZ ' ' H2 ' ' A' ' 1' ' ' LEU . 0.3 OUTLIER -146.42 163.84 34.35 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 114.218 -1.355 . . . . 0.0 111.088 178.995 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.1 mmt -54.94 -27.66 45.24 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 118.061 -0.971 . . . . 0.0 113.615 176.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -72.54 -31.66 65.46 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 175.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -97.01 -46.21 6.28 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.4 mt -56.88 -34.37 67.81 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 118.123 -0.941 . . . . 0.0 110.62 176.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -57.13 -32.36 66.28 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 116.544 -1.693 . . . . 0.0 113.829 169.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -60.3 -36.3 77.57 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 119.964 1.256 . . . . 0.0 111.021 175.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.0 mttm -83.65 -49.56 9.04 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.726 1.21 . . . . 0.0 109.931 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.8 t -63.4 -15.41 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 124.329 1.052 . . . . 0.0 111.735 176.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -39.54 93.47 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.306 1.442 . . . . 0.0 110.914 176.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -56.95 -29.76 63.44 Favored 'General case' 0 CA--C 1.554 1.119 0 O-C-N 125.014 1.446 . . . . 0.0 111.522 173.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 mt -77.83 -61.58 1.95 Allowed 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 116.573 -1.68 . . . . 0.0 107.769 177.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.39 -45.43 62.48 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 117.373 -1.298 . . . . 0.0 113.226 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.3 p -44.67 -36.09 2.95 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 175.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.45 -50.79 3.14 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 172.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.91 -38.85 65.27 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 125.467 1.507 . . . . 0.0 112.464 177.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -68.92 -40.74 78.9 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.902 1.281 . . . . 0.0 110.732 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -77.76 -14.57 59.56 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 175.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.6 tp -78.63 -45.08 22.36 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.807 1.643 . . . . 0.0 111.025 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.41 -29.93 64.52 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 124.646 1.216 . . . . 0.0 111.552 176.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -49.59 77.03 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.529 0.732 . . . . 0.0 111.076 175.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.01 -56.04 15.46 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 117.411 -1.281 . . . . 0.0 110.887 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.9 t -42.86 -39.09 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 125.214 1.571 . . . . 0.0 111.444 174.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.09 -72.76 0.12 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 117.922 -1.037 . . . . 0.0 112.782 172.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -47.92 -36.69 12.79 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.395 1.078 . . . . 0.0 112.715 177.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.7 tp -60.99 -60.14 4.26 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.897 2.079 . . . . 0.0 113.461 172.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -62.9 -25.43 68.31 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 178.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.88 -19.52 65.95 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 168.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 16.6 mt -87.98 -42.07 12.7 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.289 1.036 . . . . 0.0 113.09 174.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 43.2 t -67.86 -14.65 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.143 0 CA-C-N 114.405 -1.27 . . . . 0.0 113.745 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -129.2 53.29 0.81 Allowed Glycine 0 N--CA 1.481 1.67 0 C-N-CA 124.25 0.929 . . . . 0.0 111.341 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 92.31 82.19 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 128.479 2.711 . . . . 0.0 111.94 176.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 . . . . . 0 N--CA 1.488 1.427 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 176.734 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.483 1.196 0 N-CA-C 116.344 1.979 . . . . 0.0 116.344 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 64.21 -166.39 0.23 Allowed 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.327 1.451 . . . . 0.0 108.75 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? 62.67 -148.17 0.36 Allowed 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.83 -1.169 . . . . 0.0 109.778 175.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.12 -32.15 2.76 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 117.22 -1.371 . . . . 0.0 114.439 173.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.6 tptt -62.38 -31.29 71.94 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 176.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -101.37 -37.37 8.5 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 171.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.9 mt -61.6 -30.0 70.4 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-O 118.295 -0.859 . . . . 0.0 111.767 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -62.43 -40.59 97.08 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 118.313 -0.851 . . . . 0.0 112.442 172.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.61 -26.69 60.07 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 174.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.5 tttm -78.82 -48.99 13.7 Favored 'General case' 0 CA--C 1.557 1.24 0 O-C-N 124.156 0.91 . . . . 0.0 111.957 173.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.0 t -69.6 -50.96 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 125.49 1.516 . . . . 0.0 112.119 178.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -60.5 -34.23 73.77 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 117.214 -1.374 . . . . 0.0 109.745 175.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -53.73 -38.25 64.16 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-O 117.47 -1.252 . . . . 0.0 110.428 172.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.5 mt -64.28 -59.11 4.79 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.784 0.434 . . . . 0.0 110.942 -178.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 15.2 mt -59.76 -51.73 68.51 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.952 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 m -54.1 -33.07 56.7 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 124.549 1.14 . . . . 0.0 113.674 175.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -77.79 -53.25 7.72 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.473 1.509 . . . . 0.0 111.895 174.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -59.69 -39.67 85.35 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.129 0.571 . . . . 0.0 111.709 178.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -57.39 -33.65 68.05 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.074 0.95 . . . . 0.0 112.716 170.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -89.87 5.04 47.98 Favored 'General case' 0 CA--C 1.564 1.509 0 C-N-CA 125.917 1.687 . . . . 0.0 114.475 173.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 33.4 tp -108.1 -42.84 4.54 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.174 -0.954 . . . . 0.0 111.421 177.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -58.88 -32.77 69.78 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 175.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -64.78 -40.88 95.97 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.7 177.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -72.21 -49.6 34.04 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-O 116.342 -1.789 . . . . 0.0 110.361 -175.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.6 t -43.55 -40.95 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 124.399 1.062 . . . . 0.0 112.131 169.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.54 -64.56 0.84 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.821 0.849 . . . . 0.0 112.818 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.4 mtm105 -54.35 -27.44 36.15 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 174.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.3 tp -65.05 -60.31 3.17 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.148 1.779 . . . . 0.0 110.695 170.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . 0.3 0.1 OUTLIER -62.95 -19.13 63.98 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 178.698 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.39 -33.09 58.58 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.01 0.524 . . . . 0.0 111.354 173.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.2 mt -80.76 -35.26 33.52 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.916 1.286 . . . . 0.0 110.182 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.4 t -58.72 -26.32 31.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 C-N-CA 124.833 1.253 . . . . 0.0 112.219 177.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.1 -36.54 61.52 Favored Glycine 0 CA--C 1.552 2.364 0 C-N-CA 124.788 1.185 . . . . 0.0 112.895 174.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -142.83 32.03 1.42 Allowed 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 178.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 115.918 -1.991 . . . . 0.0 113.92 -175.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 N--CA 1.483 1.19 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.76 46.6 0.37 Allowed 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.435 ' C ' ' H ' ' A' ' 5' ' ' LYS . 1.6 ttt85 -129.15 136.65 50.46 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 113.765 -1.561 . . . . 0.0 108.822 179.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.7 tpp 72.45 -14.42 0.56 Allowed 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 126.017 1.727 . . . . 0.0 114.927 -177.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.657 ' C ' ' HE2' ' A' ' 8' ' ' GLU . 46.6 mtpt -94.37 -21.47 18.94 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.472 1.909 . . . . 0.0 113.876 178.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -111.84 -22.42 11.12 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 118.177 -0.916 . . . . 0.0 113.106 169.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.4 mt -56.37 -44.98 80.69 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 117.532 -1.223 . . . . 0.0 112.534 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.657 ' HE2' ' C ' ' A' ' 5' ' ' LYS . 0.2 OUTLIER -71.18 -28.69 64.42 Favored 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 174.792 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.59 -27.03 55.66 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.507 1.123 . . . . 0.0 111.735 177.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.8 -26.93 16.02 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.859 0.864 . . . . 0.0 112.823 176.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 37.4 t -71.62 -40.57 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.119 0.968 . . . . 0.0 109.971 173.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -64.78 -48.32 74.93 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 118.028 -0.986 . . . . 0.0 112.391 177.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -47.85 -36.64 12.35 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 124.818 1.324 . . . . 0.0 111.847 177.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.2 mt -63.45 -61.57 2.25 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 117.356 -1.307 . . . . 0.0 109.952 178.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.3 mt -54.44 -49.66 69.49 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.966 0.906 . . . . 0.0 112.189 178.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.7 m -45.43 -39.31 6.93 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 124.837 1.255 . . . . 0.0 112.464 174.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -87.62 -47.8 8.4 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 113.898 -1.501 . . . . 0.0 114.138 177.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -53.52 -33.36 54.21 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.458 1.503 . . . . 0.0 112.427 175.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -64.08 -48.43 76.24 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 125.118 1.367 . . . . 0.0 112.618 171.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.06 -18.52 61.93 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 175.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 20.5 tp -69.01 -44.41 72.84 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.097 1.359 . . . . 0.0 111.832 179.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -57.21 -31.15 65.19 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.432 1.083 . . . . 0.0 112.743 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -64.65 -48.64 74.08 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.811 172.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -61.68 -57.87 10.29 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 116.842 -1.551 . . . . 0.0 112.059 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 82.0 t -42.47 -38.61 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 125.628 1.571 . . . . 0.0 112.791 173.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.28 -66.53 0.55 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.767 0.827 . . . . 0.0 112.76 174.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -51.82 -37.6 52.4 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.119 0.967 . . . . 0.0 112.581 175.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.6 tp -57.51 -59.01 5.81 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 126.518 1.927 . . . . 0.0 112.286 171.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -61.23 -21.75 64.15 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.2 mtpt -84.91 -27.88 26.3 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 172.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.31 -19.33 26.85 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.233 1.413 . . . . 0.0 113.673 173.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -64.94 -27.29 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 C-N-CA 126.394 1.878 . . . . 0.0 112.082 174.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -44.92 -39.77 6.52 Favored Glycine 0 CA--C 1.539 1.538 0 O-C-N 124.472 1.107 . . . . 0.0 111.96 175.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -122.38 -107.92 0.35 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 174.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.257 1.495 0 C-N-CA 128.58 2.752 . . . . 0.0 113.275 -175.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 123.7 1.714 . . . . 0.0 115.506 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.441 ' C ' HE22 ' A' ' 6' ' ' GLN . 38.1 mt-30 -83.76 53.7 2.64 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 113.225 -1.807 . . . . 0.0 110.992 -179.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.41 132.4 8.81 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 113.21 -1.813 . . . . 0.0 108.428 -178.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.3 tpp 74.83 -21.36 0.3 Allowed 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 -178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.52 -37.8 27.26 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 115.16 -0.927 . . . . 0.0 112.029 176.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.441 HE22 ' C ' ' A' ' 2' ' ' GLN . 0.0 OUTLIER -93.31 -26.8 17.14 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.776 174.225 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 70.8 mt -54.39 -42.33 70.29 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.61 177.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -63.87 -38.45 91.13 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 172.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -79.05 -16.09 57.31 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.804 0.842 . . . . 0.0 112.701 -179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.89 -32.63 10.9 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.185 0.994 . . . . 0.0 112.504 176.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 48.8 t -70.05 -45.14 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 125.237 1.415 . . . . 0.0 110.388 174.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -68.23 -34.46 76.29 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -61.44 -20.63 63.33 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.662 1.226 . . . . 0.0 112.889 174.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.8 mt -69.31 -59.62 2.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.477 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.6 mt -59.12 -49.59 77.29 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.539 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p -53.75 -33.53 56.06 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.4 ttpp -76.94 -58.69 3.14 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 171.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -51.76 -30.51 23.07 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.435 1.094 . . . . 0.0 112.827 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -70.57 -44.9 66.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.207 1.403 . . . . 0.0 113.048 172.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.99 -18.64 61.97 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.3 tp -66.01 -47.45 74.42 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.283 1.433 . . . . 0.0 111.571 178.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -60.53 -25.96 66.52 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 175.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -82.08 -47.52 12.48 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.309 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.72 -46.58 84.74 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 117.82 -1.086 . . . . 0.0 112.511 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 68.7 t -50.94 -34.71 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 126.062 1.745 . . . . 0.0 111.489 175.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.38 -71.52 0.15 Allowed 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.284 173.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -49.88 -36.43 27.19 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 176.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.2 tp -56.14 -62.54 1.64 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.53 1.532 . . . . 0.0 112.567 171.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -22.45 66.97 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 178.38 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.52 -19.79 62.5 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 171.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.54 -19.86 65.14 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 170.176 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 54.9 t -88.45 7.8 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 C-N-CA 124.386 1.074 . . . . 0.0 111.579 173.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -95.52 -47.79 2.48 Favored Glycine 0 N--CA 1.486 1.992 0 N-CA-C 111.54 -0.624 . . . . 0.0 111.54 176.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -168.5 60.49 0.06 Allowed 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.869 1.268 . . . . 0.0 113.009 -175.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 42.5 ttt85 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.613 -1.184 . . . . 0.0 113.119 -179.176 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.554 1.116 0 N-CA-C 111.345 0.128 . . . . 0.0 111.345 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -76.29 -23.25 54.37 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.858 1.263 . . . . 0.0 113.773 173.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.3 tp -71.76 -46.57 58.04 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.245 1.818 . . . . 0.0 111.073 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -56.18 -34.57 66.35 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 123.78 0.675 . . . . 0.0 110.936 173.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.35 -42.13 90.81 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.088 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -65.36 -52.44 53.64 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 124.607 1.192 . . . . 0.0 111.813 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.7 t -45.05 -40.53 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 124.714 1.205 . . . . 0.0 111.975 173.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.71 -61.38 2.0 Allowed 'General case' 0 CA--C 1.549 0.937 0 O-C-N 123.907 0.754 . . . . 0.0 112.147 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 22.3 mtp85 -52.83 -37.95 60.7 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 174.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.7 tp -61.84 -57.95 9.83 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.617 1.967 . . . . 0.0 112.763 173.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -61.95 -32.43 72.85 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.135 0.574 . . . . 0.0 111.454 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.49 ' HG3' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.87 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 172.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 . . . . . 0 N--CA 1.483 1.182 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -73.24 -31.32 64.06 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.343 1.457 . . . . 0.0 112.963 173.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.715 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 21.9 tp -68.24 -45.23 73.78 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.918 1.687 . . . . 0.0 111.138 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.39 -24.8 57.61 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 173.09 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -84.49 -49.61 8.48 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 115.238 -0.892 . . . . 0.0 113.04 173.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.715 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 9.7 pt-20 -59.87 -44.25 94.29 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.041 176.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.464 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.8 t -50.47 -35.18 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 126.094 1.758 . . . . 0.0 111.301 174.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.9 -62.7 1.35 Allowed 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.862 175.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -56.97 -27.27 61.2 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 174.283 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' A' ' 25' ' ' VAL . 8.4 tp -72.8 -56.87 4.6 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.085 1.754 . . . . 0.0 113.103 171.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -60.9 -25.06 66.45 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.099 0.96 . . . . 0.0 111.702 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 tttm . . . . . 0 N--CA 1.479 0.984 0 C-N-CA 125.649 1.58 . . . . 0.0 113.38 166.713 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 . . . . . 0 N--CA 1.485 1.324 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.505 ' O ' ' HB2' ' A' ' 23' ' ' ASN . 5.9 t60 -71.1 -30.8 66.99 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.02 0.928 . . . . 0.0 113.488 173.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.1 tp -67.63 -49.61 62.1 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.077 1.751 . . . . 0.0 111.543 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -59.4 -29.41 67.71 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.453 175.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' A' ' 20' ' ' HIS . 31.9 m-80 -60.18 -47.62 85.18 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.907 0.883 . . . . 0.0 112.075 172.458 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.95 -62.86 1.55 Allowed 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.447 1.092 . . . . 0.0 111.289 174.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.436 ' HA ' HD23 ' A' ' 28' ' ' LEU . 24.5 t -42.09 -36.66 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 125.119 1.368 . . . . 0.0 111.708 177.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.64 -71.98 0.17 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.624 1.17 . . . . 0.0 113.703 173.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.85 -34.17 26.82 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 176.243 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.8 tp -60.37 -60.78 3.26 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 126.711 2.004 . . . . 0.0 111.309 172.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -62.11 -28.5 69.67 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.1 mttt . . . . . 0 N--CA 1.483 1.191 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 170.437 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -74.91 -18.55 60.39 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 122.008 0.909 . . . . 0.0 113.351 175.181 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.717 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 27.8 tp -66.85 -45.39 78.33 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.887 1.275 . . . . 0.0 111.274 178.05 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -61.72 -24.17 66.62 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -81.79 -50.71 8.93 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.545 171.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.717 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 9.5 pt-20 -61.65 -44.14 97.54 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 123.983 0.802 . . . . 0.0 112.895 177.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.433 ' HA ' HD23 ' A' ' 28' ' ' LEU . 59.7 t -50.87 -34.39 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.54 1.136 . . . . 0.0 111.932 173.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.05 -62.38 1.59 Allowed 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.453 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.51 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -54.25 -34.05 59.87 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 174.493 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.433 HD23 ' HA ' ' A' ' 25' ' ' VAL . 10.5 tp -68.6 -54.95 13.3 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.267 1.827 . . . . 0.0 112.59 176.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -63.0 -27.79 69.66 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.302 0.641 . . . . 0.0 111.58 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 27' ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.554 1.12 0 C-N-CA 124.448 1.099 . . . . 0.0 113.678 169.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.484 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 16.9 m-85 . . . . . 0 CA--C 1.546 0.807 0 CA-C-O 119.318 -0.372 . . . . 0.0 111.384 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -15.09 63.24 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 175.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -65.47 -35.79 81.95 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.012 0.925 . . . . 0.0 112.405 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 12.6 pt-20 -60.34 -27.41 67.34 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -55.33 -30.77 60.91 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.98 0.912 . . . . 0.0 111.392 175.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -73.83 -60.58 2.19 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.4 1.48 . . . . 0.0 109.303 -178.393 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.473 ' HA ' HD23 ' A' ' 28' ' ' LEU . 78.3 t -41.58 -39.5 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 124.369 1.068 . . . . 0.0 112.276 173.432 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.49 -66.53 0.53 Allowed 'General case' 0 CA--C 1.549 0.912 0 O-C-N 123.902 0.751 . . . . 0.0 112.887 175.168 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.533 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 0.1 OUTLIER -52.3 -36.83 54.11 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 124.095 0.958 . . . . 0.0 113.424 176.625 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 25' ' ' VAL . 8.9 tp -64.09 -53.74 44.88 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.375 2.27 . . . . 0.0 112.431 175.383 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.67 -26.08 67.8 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 123.695 0.622 . . . . 0.0 111.153 177.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 171.747 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 t80 . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 121.12 0.486 . . . . 0.0 110.01 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -86.31 7.01 27.18 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 126.242 1.817 . . . . 0.0 113.34 172.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 tp -111.82 -42.29 3.84 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 120.592 -1.317 . . . . 0.0 110.934 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -29.8 68.09 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.969 172.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.42 -43.76 84.83 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 120.966 0.412 . . . . 0.0 111.675 174.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.407 ' O ' ' HB3' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -67.65 -52.75 34.45 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 117.939 -1.029 . . . . 0.0 111.812 -178.912 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.426 ' HA ' HD23 ' A' ' 28' ' ' LEU . 98.9 t -43.09 -41.21 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 O-C-N 124.748 1.28 . . . . 0.0 111.376 170.404 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.42 -67.64 0.43 Allowed 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 117.414 -1.279 . . . . 0.0 112.302 174.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.8 mtm-85 -51.71 -35.57 43.45 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 177.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 25' ' ' VAL . 6.4 tp -63.15 -60.32 3.58 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.889 2.075 . . . . 0.0 112.0 172.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -64.61 -19.58 65.77 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 119.019 -0.515 . . . . 0.0 112.359 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.9 mmtp . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 169.488 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 120.72 0.295 . . . . 0.0 111.337 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -68.4 -29.45 68.14 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.907 1.283 . . . . 0.0 112.31 171.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.77 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 14.1 tp -67.67 -46.52 72.13 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.545 1.938 . . . . 0.0 110.92 179.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -60.47 -24.3 65.15 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.949 0.781 . . . . 0.0 112.436 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -80.08 -56.9 3.91 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.103 0.961 . . . . 0.0 111.904 169.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.77 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 12.9 pt-20 -56.37 -44.33 80.05 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-O 118.371 -0.824 . . . . 0.0 112.796 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.536 ' HA ' HD23 ' A' ' 28' ' ' LEU . 38.4 t -49.82 -36.58 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 126.946 2.099 . . . . 0.0 111.63 173.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.31 -66.05 0.59 Allowed 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.736 175.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -51.19 -41.56 60.3 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.257 0.623 . . . . 0.0 111.843 175.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.536 HD23 ' HA ' ' A' ' 25' ' ' VAL . 10.2 tp -56.06 -64.07 0.98 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.345 1.858 . . . . 0.0 112.044 173.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -65.06 -18.0 64.93 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.3 mmtp . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 123.969 0.908 . . . . 0.0 113.15 170.423 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.5 t80 . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 110.753 -0.092 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -72.38 -29.48 63.81 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.359 1.463 . . . . 0.0 112.968 172.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.1 tp -68.57 -43.19 77.1 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 126.305 1.842 . . . . 0.0 111.717 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -52.22 -31.47 32.24 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 124.37 1.044 . . . . 0.0 112.465 174.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -66.45 -46.27 77.0 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.53 0.732 . . . . 0.0 111.978 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -61.18 -48.39 81.76 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 174.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.1 t -46.67 -40.93 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 CA-C-O 117.301 -1.333 . . . . 0.0 109.938 171.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -62.31 -62.37 1.81 Allowed 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 116.21 -1.852 . . . . 0.0 112.057 173.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -47.38 -40.88 18.61 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 119.367 0.985 . . . . 0.0 113.296 176.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.6 tp -65.16 -60.3 3.16 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 126.992 2.117 . . . . 0.0 112.391 173.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -60.36 -28.94 68.58 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.915 1.286 . . . . 0.0 110.674 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.565 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 29.0 mmtm . . . . . 0 CA--C 1.55 0.977 0 CA-C-N 119.389 0.995 . . . . 0.0 111.707 172.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 t80 . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 120.753 0.311 . . . . 0.0 110.828 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.443 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 2.9 t60 -81.82 -9.1 59.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.185 1.394 . . . . 0.0 114.071 173.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.709 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 22.2 tp -89.54 -44.56 10.02 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 125.668 1.587 . . . . 0.0 109.756 -177.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.16 -29.06 68.42 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.127 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.443 ' OD1' ' HA ' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -80.5 -47.47 14.22 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 123.477 0.486 . . . . 0.0 111.705 172.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.709 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 21.8 pt-20 -64.51 -45.04 88.95 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.53 -0.748 . . . . 0.0 112.427 -177.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.499 ' HA ' HD23 ' A' ' 28' ' ' LEU . 62.8 t -50.65 -34.83 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.526 1.53 . . . . 0.0 111.064 172.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 23' ' ' ASN . . . -60.49 -71.98 0.12 Allowed 'General case' 0 CA--C 1.537 0.451 0 O-C-N 124.757 1.286 . . . . 0.0 111.339 171.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.552 ' H ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -53.65 -31.04 45.91 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 177.489 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.499 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.3 tp -64.47 -65.12 0.72 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 126.538 1.935 . . . . 0.0 112.768 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -22.02 65.06 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 121.919 -0.488 . . . . 0.0 111.574 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? . . . . . 0 N--CA 1.478 0.928 0 C-N-CA 124.3 1.04 . . . . 0.0 113.467 172.3 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.35 -33.93 77.13 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.36 1.064 . . . . 0.0 113.138 174.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -69.52 -46.28 66.88 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 126.451 1.9 . . . . 0.0 111.485 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -57.36 -30.64 65.03 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 174.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -64.72 -45.75 85.21 Favored 'General case' 0 N--CA 1.485 1.275 0 CA-C-N 114.406 -1.27 . . . . 0.0 111.132 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -61.51 -50.12 73.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 118.035 -0.983 . . . . 0.0 112.763 177.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.427 ' HA ' HD23 ' A' ' 28' ' ' LEU . 71.9 t -44.14 -39.55 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 C-N-CA 125.46 1.504 . . . . 0.0 112.002 171.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.455 ' O ' ' HD3' ' A' ' 30' ' ' LYS . . . -65.55 -68.3 0.38 Allowed 'General case' 0 N--CA 1.482 1.157 0 CA-C-O 118.2 -0.905 . . . . 0.0 112.073 174.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.1 ttt180 -51.01 -34.3 28.68 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 176.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 25' ' ' VAL . 11.5 tp -61.76 -57.63 11.14 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.651 1.981 . . . . 0.0 112.544 171.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -63.16 -24.34 67.84 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HD3' ' O ' ' A' ' 26' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.023 0 C-N-CA 124.607 1.163 . . . . 0.0 113.581 169.484 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.553 1.085 0 CA-C-O 120.608 0.242 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -76.49 -25.09 53.91 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.454 1.502 . . . . 0.0 112.77 173.066 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.7 tp -72.88 -48.16 39.79 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.91 1.684 . . . . 0.0 111.506 -178.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.14 -30.73 62.55 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 123.666 0.604 . . . . 0.0 111.436 175.084 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -65.8 -41.77 91.53 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.801 174.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.408 ' HA ' ' HG2' ' A' ' 27' ' ' ARG . 1.2 mm-40 -61.5 -52.8 63.0 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.314 1.009 . . . . 0.0 113.27 173.242 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.2 t -46.31 -37.78 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 C-N-CA 124.248 1.019 . . . . 0.0 112.062 173.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.13 -64.16 0.91 Allowed 'General case' 0 N--CA 1.484 1.255 0 O-C-N 123.746 0.654 . . . . 0.0 112.374 175.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.425 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 11.0 ptp85 -53.25 -31.23 42.44 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 175.137 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.9 tp -67.98 -55.59 12.1 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.982 1.713 . . . . 0.0 112.009 172.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -62.81 -24.27 67.67 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' A' ' 27' ' ' ARG . 32.1 tttt . . . . . 0 N--CA 1.479 0.998 0 C-N-CA 125.619 1.568 . . . . 0.0 113.415 169.127 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.09 -10.93 59.96 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 174.292 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -70.41 -52.69 20.52 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 125.273 1.429 . . . . 0.0 111.757 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -56.2 -28.71 59.24 Favored 'General case' 0 CA--C 1.553 1.086 0 O-C-N 124.564 1.165 . . . . 0.0 111.554 174.25 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.7 -46.2 90.72 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.807 176.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -50.0 75.46 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.894 0.478 . . . . 0.0 111.679 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.401 ' O ' ' HB2' ' A' ' 29' ' ' LYS . 83.7 t -43.05 -40.53 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.192 -1.931 0 O-C-N 124.882 1.364 . . . . 0.0 111.648 171.09 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.96 -54.83 18.08 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 117.934 -1.031 . . . . 0.0 113.208 175.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.1 -38.7 58.17 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-N 118.527 0.603 . . . . 0.0 111.851 173.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.1 tp -67.79 -55.46 12.92 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.868 1.267 . . . . 0.0 112.027 172.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 25' ' ' VAL . 1.3 tmtm? -58.39 -31.17 67.42 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 126.339 1.856 . . . . 0.0 109.937 -178.576 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.561 1.374 0 CA-C-N 118.99 0.814 . . . . 0.0 111.586 173.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 . . . . . 0 N--CA 1.483 1.19 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -80.1 -16.21 55.48 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 172.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.4 tp -76.76 -46.19 26.17 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.159 1.384 . . . . 0.0 112.483 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -51.02 -31.85 19.61 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 174.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -58.59 -53.75 54.85 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.599 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -60.28 -55.26 35.91 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 116.818 -1.563 . . . . 0.0 110.314 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.9 t -42.97 -40.03 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 124.837 1.255 . . . . 0.0 112.333 174.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.97 -66.0 0.61 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.958 0.903 . . . . 0.0 112.865 175.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.406 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 4.3 mmm-85 -53.19 -31.71 44.24 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 174.614 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.7 tp -64.67 -58.97 4.84 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.28 1.832 . . . . 0.0 111.998 170.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -62.68 -21.18 65.55 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 122.956 0.502 . . . . 0.0 112.181 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.033 0 C-N-CA 123.826 0.85 . . . . 0.0 112.766 168.207 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 119.022 -0.513 . . . . 0.0 110.729 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -12.8 60.01 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 123.81 0.694 . . . . 0.0 112.854 173.565 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.662 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 19.9 tp -76.76 -55.89 5.09 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.943 1.697 . . . . 0.0 110.789 -176.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.15 -25.58 33.12 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 124.728 1.268 . . . . 0.0 113.201 173.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -82.2 -50.85 8.55 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 124.595 1.184 . . . . 0.0 112.04 174.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.662 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 13.1 pt-20 -61.49 -45.77 92.81 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 118.837 -0.602 . . . . 0.0 112.251 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.435 ' HA ' HD23 ' A' ' 28' ' ' LEU . 82.6 t -51.26 -34.59 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.752 1.621 . . . . 0.0 111.065 174.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.31 -68.35 0.32 Allowed 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 118.056 -0.973 . . . . 0.0 111.138 173.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.0 tpp85 -50.87 -38.85 51.85 Favored 'General case' 0 CA--C 1.559 1.322 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 174.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.3 tp -60.91 -65.39 0.7 Allowed 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.933 1.293 . . . . 0.0 111.734 174.651 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . 0.256 0.0 OUTLIER -65.71 -20.43 66.28 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.292 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.312 0 C-N-CA 124.808 1.243 . . . . 0.0 112.181 172.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.61 -19.44 59.24 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 172.406 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.6 tp -70.77 -48.81 52.33 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.939 1.296 . . . . 0.0 112.016 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -52.59 -32.32 40.79 Favored 'General case' 0 CA--C 1.555 1.17 0 O-C-N 123.999 0.812 . . . . 0.0 112.439 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -69.03 -48.79 62.08 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.111 176.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -58.21 -54.94 41.3 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 117.373 -1.298 . . . . 0.0 112.532 175.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 78.4 t -43.87 -39.63 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 125.679 1.592 . . . . 0.0 112.228 173.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.485 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -65.53 -69.14 0.31 Allowed 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.772 175.521 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -48.45 -36.5 15.09 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 174.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.9 tp -59.52 -62.21 2.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 126.714 2.006 . . . . 0.0 111.46 171.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -60.28 -24.23 64.78 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 0.9 OUTLIER . . . . . 0 CA--C 1.55 0.968 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.484 173.505 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 . . . . . 0 N--CA 1.493 1.697 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -89.21 5.24 45.67 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 125.976 1.71 . . . . 0.0 114.433 174.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.7 tp -110.95 -50.24 2.96 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.525 0.73 . . . . 0.0 110.439 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -67.85 -24.31 65.24 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.281 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -71.79 -33.88 68.94 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 174.214 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -78.62 -50.41 11.54 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.987 1.315 . . . . 0.0 111.894 -178.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.42 ' HA ' HD23 ' A' ' 28' ' ' LEU . 85.7 t -46.85 -32.72 1.94 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-O 117.798 -1.096 . . . . 0.0 111.482 169.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.431 ' O ' ' HD3' ' A' ' 30' ' ' LYS . . . -58.72 -63.73 1.18 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 172.115 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.0 ptm180 -55.19 -29.92 58.87 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 175.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 25' ' ' VAL . 5.3 tp -68.92 -57.28 5.73 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.028 1.331 . . . . 0.0 111.665 173.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -59.98 -18.77 48.22 Favored 'General case' 0 C--O 1.216 -0.685 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 26' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 113.739 1.015 . . . . 0.0 113.739 167.533 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 119.028 -0.51 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -14.57 59.56 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 175.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.6 tp -78.63 -45.08 22.36 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.807 1.643 . . . . 0.0 111.025 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.41 -29.93 64.52 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 124.646 1.216 . . . . 0.0 111.552 176.325 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -60.13 -49.59 77.03 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.529 0.732 . . . . 0.0 111.076 175.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.01 -56.04 15.46 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 117.411 -1.281 . . . . 0.0 110.887 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.498 ' HA ' HD23 ' A' ' 28' ' ' LEU . 47.9 t -42.86 -39.09 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 125.214 1.571 . . . . 0.0 111.444 174.448 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.443 ' O ' ' HD2' ' A' ' 30' ' ' LYS . . . -62.09 -72.76 0.12 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 117.922 -1.037 . . . . 0.0 112.782 172.466 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -47.92 -36.69 12.79 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.395 1.078 . . . . 0.0 112.715 177.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 25' ' ' VAL . 8.7 tp -60.99 -60.14 4.26 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.897 2.079 . . . . 0.0 113.461 172.601 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -62.9 -25.43 68.31 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 178.194 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.443 ' HD2' ' O ' ' A' ' 26' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.14 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 168.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 . . . . . 0 CA--C 1.551 0.981 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.602 ' HA ' HD22 ' A' ' 23' ' ' ASN . 6.3 t60 -89.87 5.04 47.98 Favored 'General case' 0 CA--C 1.564 1.509 0 C-N-CA 125.917 1.687 . . . . 0.0 114.475 173.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 33.4 tp -108.1 -42.84 4.54 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.174 -0.954 . . . . 0.0 111.421 177.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -58.88 -32.77 69.78 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 175.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.602 HD22 ' HA ' ' A' ' 20' ' ' HIS . 3.7 p30 -64.78 -40.88 95.97 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.7 177.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -72.21 -49.6 34.04 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-O 116.342 -1.789 . . . . 0.0 110.361 -175.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.6 t -43.55 -40.95 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 124.399 1.062 . . . . 0.0 112.131 169.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.54 -64.56 0.84 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.821 0.849 . . . . 0.0 112.818 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.4 mtm105 -54.35 -27.44 36.15 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 174.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.3 tp -65.05 -60.31 3.17 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.148 1.779 . . . . 0.0 110.695 170.198 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . 0.3 0.1 OUTLIER -62.95 -19.13 63.98 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 178.698 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.913 0 C-N-CA 123.01 0.524 . . . . 0.0 111.354 173.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 . . . . . 0 N--CA 1.483 1.192 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.06 -18.52 61.93 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 175.456 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 20.5 tp -69.01 -44.41 72.84 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.097 1.359 . . . . 0.0 111.832 179.112 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -57.21 -31.15 65.19 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.432 1.083 . . . . 0.0 112.743 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -64.65 -48.64 74.08 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.811 172.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -61.68 -57.87 10.29 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 116.842 -1.551 . . . . 0.0 112.059 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 82.0 t -42.47 -38.61 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 125.628 1.571 . . . . 0.0 112.791 173.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.28 -66.53 0.55 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.767 0.827 . . . . 0.0 112.76 174.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -51.82 -37.6 52.4 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.119 0.967 . . . . 0.0 112.581 175.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.6 tp -57.51 -59.01 5.81 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 126.518 1.927 . . . . 0.0 112.286 171.287 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -61.23 -21.75 64.15 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.2 mtpt . . . . . 0 N--CA 1.483 1.193 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 172.078 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.501 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 2.6 m-30 . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -18.64 61.97 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.659 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 24.3 tp -66.01 -47.45 74.42 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.283 1.433 . . . . 0.0 111.571 178.381 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 23.3 pt-20 -60.53 -25.96 66.52 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 175.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -82.08 -47.52 12.48 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.309 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.659 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 9.1 pt-20 -63.72 -46.58 84.74 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 117.82 -1.086 . . . . 0.0 112.511 176.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.455 ' HA ' HD23 ' A' ' 28' ' ' LEU . 68.7 t -50.94 -34.71 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 126.062 1.745 . . . . 0.0 111.489 175.414 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.38 -71.52 0.15 Allowed 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.284 173.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -49.88 -36.43 27.19 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 176.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.2 tp -56.14 -62.54 1.64 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.53 1.532 . . . . 0.0 112.567 171.508 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -22.45 66.97 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 178.38 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 171.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.514 2.773 0 CA-C-O 122.142 0.972 . . . . 0.0 113.225 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.94 133.55 37.97 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.095 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.403 ' HG3' ' CB ' ' A' ' 8' ' ' GLU . 12.9 ttp85 60.73 79.72 0.24 Allowed 'General case' 0 N--CA 1.5 2.058 0 CA-C-O 123.935 1.826 . . . . 0.0 112.08 -171.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -108.64 -22.53 12.21 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 112.558 -2.11 . . . . 0.0 114.977 178.034 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 165.04 -32.16 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 129.551 3.14 . . . . 0.0 113.807 -173.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -90.98 -62.93 1.34 Allowed 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 35.1 mt -63.34 -16.5 60.6 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.174 174.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.403 ' CB ' ' HG3' ' A' ' 3' ' ' ARG . 0.1 OUTLIER -58.46 -44.68 89.35 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 117.543 -1.217 . . . . 0.0 111.942 171.027 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.7 -34.54 78.08 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 123.675 0.609 . . . . 0.0 112.065 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -72.53 -54.29 9.63 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.741 176.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.5 t -63.97 -41.44 92.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 124.571 1.148 . . . . 0.0 112.265 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -62.05 -45.68 92.49 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 118.595 -0.717 . . . . 0.0 110.865 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -52.04 -26.75 11.61 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 124.368 1.043 . . . . 0.0 113.538 174.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.3 mt -64.91 -62.72 1.39 Allowed 'General case' 0 C--O 1.21 -1.001 0 CA-C-O 116.532 -1.699 . . . . 0.0 108.781 175.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.2 mt -54.78 -46.45 74.43 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-O 117.503 -1.237 . . . . 0.0 111.767 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.3 m -45.0 -34.94 2.66 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 174.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 19.8 ttpp -100.4 -54.0 2.97 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 173.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -54.65 -47.76 73.15 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.417 1.487 . . . . 0.0 112.695 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.3 -33.96 76.65 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 124.476 1.111 . . . . 0.0 111.345 175.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -76.29 -23.25 54.37 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.858 1.263 . . . . 0.0 113.773 173.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.3 tp -71.76 -46.57 58.04 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.245 1.818 . . . . 0.0 111.073 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -56.18 -34.57 66.35 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 123.78 0.675 . . . . 0.0 110.936 173.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.35 -42.13 90.81 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.088 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -65.36 -52.44 53.64 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 124.607 1.192 . . . . 0.0 111.813 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.7 t -45.05 -40.53 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 124.714 1.205 . . . . 0.0 111.975 173.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.71 -61.38 2.0 Allowed 'General case' 0 CA--C 1.549 0.937 0 O-C-N 123.907 0.754 . . . . 0.0 112.147 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 22.3 mtp85 -52.83 -37.95 60.7 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 174.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.7 tp -61.84 -57.95 9.83 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.617 1.967 . . . . 0.0 112.763 173.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -61.95 -32.43 72.85 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.135 0.574 . . . . 0.0 111.454 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.49 ' HG3' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -75.96 -31.53 59.09 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 172.79 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mt -65.2 -22.82 66.94 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.639 0.776 . . . . 0.0 112.688 174.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.4 t -86.01 5.91 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.351 173.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -112.2 -13.26 12.29 Favored Glycine 0 CA--C 1.54 1.595 0 C-N-CA 124.402 1.001 . . . . 0.0 114.029 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -173.41 87.64 0.06 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.626 1.571 . . . . 0.0 110.362 -178.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.7 ptt180 . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 116.849 -1.548 . . . . 0.0 114.266 175.896 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.9 tp . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 122.598 1.189 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 6' ' ' GLN . 15.4 mm100 -114.57 161.56 17.89 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.983 -175.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -114.9 136.84 52.67 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 114.467 -1.242 . . . . 0.0 109.923 -179.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.437 ' H ' HD12 ' A' ' 7' ' ' LEU . 0.0 OUTLIER 65.55 1.92 1.87 Allowed 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -173.144 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 tptt -119.6 -50.15 2.32 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 114.526 -1.215 . . . . 0.0 110.906 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 2' ' ' GLN . 0.5 OUTLIER -72.18 -31.8 66.25 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.754 175.712 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.437 HD12 ' H ' ' A' ' 4' ' ' MET . 38.4 mt -58.9 -39.96 83.04 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 118.256 -0.878 . . . . 0.0 112.078 173.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -66.61 -23.68 66.21 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 174.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.36 -25.04 29.45 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.692 0.797 . . . . 0.0 112.635 175.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.83 -34.59 13.09 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.9 t -59.63 -36.97 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 125.261 1.425 . . . . 0.0 111.138 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -59.38 -45.13 92.31 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 118.624 -0.703 . . . . 0.0 112.849 173.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.19 -34.92 74.28 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.155 0.582 . . . . 0.0 112.458 173.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.6 mt -63.55 -58.24 7.61 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 119.292 -0.385 . . . . 0.0 110.519 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.6 mt -59.39 -50.62 73.26 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.94 0.496 . . . . 0.0 111.568 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.0 m -53.26 -31.1 41.95 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 173.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -83.68 -46.92 11.77 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 173.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -60.21 -45.45 93.14 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.813 0.845 . . . . 0.0 112.55 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -58.31 -38.24 76.7 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.204 1.001 . . . . 0.0 112.607 172.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -73.24 -31.32 64.06 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.343 1.457 . . . . 0.0 112.963 173.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.715 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 21.9 tp -68.24 -45.23 73.78 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.918 1.687 . . . . 0.0 111.138 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.39 -24.8 57.61 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 173.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -84.49 -49.61 8.48 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 115.238 -0.892 . . . . 0.0 113.04 173.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.715 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 9.7 pt-20 -59.87 -44.25 94.29 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.041 176.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.464 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.8 t -50.47 -35.18 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 126.094 1.758 . . . . 0.0 111.301 174.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.9 -62.7 1.35 Allowed 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.862 175.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -56.97 -27.27 61.2 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 174.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' A' ' 25' ' ' VAL . 8.4 tp -72.8 -56.87 4.6 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.085 1.754 . . . . 0.0 113.103 171.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -60.9 -25.06 66.45 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.099 0.96 . . . . 0.0 111.702 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -51.59 -36.53 45.89 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.649 1.58 . . . . 0.0 113.38 166.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.478 ' O ' ' HG2' ' A' ' 35' ' ' ARG . 3.9 mp -54.39 -40.65 68.41 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.288 1.035 . . . . 0.0 111.35 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.2 t -95.8 16.99 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.446 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.374 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.96 -28.5 2.87 Favored Glycine 0 N--CA 1.482 1.732 0 C-N-CA 125.457 1.504 . . . . 0.0 113.371 177.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.67 60.12 1.38 Allowed 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 123.323 1.535 . . . . 0.0 113.293 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 31' ' ' LEU . 7.3 mtm105 . . . . . 0 C--O 1.259 1.569 0 CA-C-N 113.938 -1.483 . . . . 0.0 112.998 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 115.815 1.783 . . . . 0.0 115.815 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 56.29 51.81 11.06 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 123.665 1.698 . . . . 0.0 113.707 -175.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -130.33 14.52 5.58 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 113.471 -1.695 . . . . 0.0 113.639 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 35.8 mmt -77.45 5.19 9.33 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -178.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -106.18 -27.29 11.16 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.086 1.354 . . . . 0.0 113.138 174.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -100.56 -45.78 5.42 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.542 0.737 . . . . 0.0 111.966 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.444 ' O ' HG23 ' A' ' 11' ' ' VAL . 89.2 mt -60.97 -34.77 75.28 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 119.19 -0.433 . . . . 0.0 111.679 174.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.69 -37.6 68.55 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 116.956 -1.497 . . . . 0.0 112.024 174.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -56.41 -33.46 65.81 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.227 1.011 . . . . 0.0 112.128 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -89.27 -49.7 6.57 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.8 1.24 . . . . 0.0 111.408 177.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 7' ' ' LEU . 21.7 t -57.42 -42.23 80.25 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 124.41 1.084 . . . . 0.0 112.835 177.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -68.26 -39.64 82.16 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.576 1.15 . . . . 0.0 111.194 174.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.67 -31.2 71.31 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 117.793 -1.099 . . . . 0.0 110.209 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 mt -61.79 -58.62 7.29 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 119.206 -0.425 . . . . 0.0 110.476 177.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.6 mt -59.04 -52.0 67.65 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 118.748 -0.644 . . . . 0.0 111.859 177.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -49.89 -33.79 18.27 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 172.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 40.6 mttm -83.12 -47.27 11.81 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 174.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -60.47 -44.82 95.49 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.703 0.801 . . . . 0.0 111.743 178.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -58.32 -39.64 79.95 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.729 0.811 . . . . 0.0 112.325 171.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.505 ' O ' ' HB2' ' A' ' 23' ' ' ASN . 5.9 t60 -71.1 -30.8 66.99 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.02 0.928 . . . . 0.0 113.488 173.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.1 tp -67.63 -49.61 62.1 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.077 1.751 . . . . 0.0 111.543 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -59.4 -29.41 67.71 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.453 175.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' A' ' 20' ' ' HIS . 31.9 m-80 -60.18 -47.62 85.18 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.907 0.883 . . . . 0.0 112.075 172.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.95 -62.86 1.55 Allowed 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.447 1.092 . . . . 0.0 111.289 174.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.436 ' HA ' HD23 ' A' ' 28' ' ' LEU . 24.5 t -42.09 -36.66 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 125.119 1.368 . . . . 0.0 111.708 177.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.64 -71.98 0.17 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.624 1.17 . . . . 0.0 113.703 173.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.85 -34.17 26.82 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 176.243 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.8 tp -60.37 -60.78 3.26 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 126.711 2.004 . . . . 0.0 111.309 172.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -62.11 -28.5 69.67 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -72.08 -29.07 63.75 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 170.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.0 5.6 48.62 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.589 0.756 . . . . 0.0 112.979 174.654 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 70.9 t -124.5 4.51 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 124.762 1.225 . . . . 0.0 111.801 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.39 -14.89 8.61 Favored Glycine 0 N--CA 1.483 1.796 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.616 177.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -175.74 81.69 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 125.952 1.701 . . . . 0.0 112.175 -174.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 116.519 -1.705 . . . . 0.0 115.268 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 29.0 tp . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 119.471 -0.3 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.499 ' HB3' ' HG2' ' A' ' 6' ' ' GLN . 0.0 OUTLIER 46.69 -164.81 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 O-C-N 124.971 1.42 . . . . 0.0 111.157 -174.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.489 ' HB3' ' H ' ' A' ' 4' ' ' MET . 5.0 mtm105 -146.49 -145.75 0.18 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.979 0.511 . . . . 0.0 110.961 -176.051 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.489 ' H ' ' HB3' ' A' ' 3' ' ' ARG . 37.8 mmt -40.88 -28.03 0.07 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.748 1.619 . . . . 0.0 113.13 168.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -62.06 -49.45 75.92 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 175.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.499 ' HG2' ' HB3' ' A' ' 2' ' ' GLN . 10.5 pt20 -80.95 -42.82 20.67 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.907 -0.496 . . . . 0.0 111.67 173.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.411 ' N ' ' HG3' ' A' ' 6' ' ' GLN . 43.5 mt -64.39 -16.96 63.28 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 124.815 1.246 . . . . 0.0 111.485 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.63 -49.56 76.05 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 116.213 -1.851 . . . . 0.0 109.747 170.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -59.83 -35.2 74.23 Favored 'General case' 0 CA--C 1.553 1.076 0 O-C-N 124.112 0.883 . . . . 0.0 111.652 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -72.72 -53.24 12.21 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 175.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.5 t -65.87 -47.18 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 125.462 1.505 . . . . 0.0 112.432 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -62.75 -29.93 71.06 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.018 0.527 . . . . 0.0 111.425 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.55 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 2.1 mt-10 -58.91 -23.42 61.22 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 123.898 0.749 . . . . 0.0 112.453 172.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 37.5 mt -74.39 -60.93 2.05 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 117.445 -1.264 . . . . 0.0 109.362 173.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.1 mt -53.09 -44.13 67.34 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.386 0.994 . . . . 0.0 113.07 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.1 m -47.41 -41.4 20.01 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 173.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 5.8 ptmm? -92.97 -38.84 11.46 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 114.511 1.301 . . . . 0.0 114.511 175.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.63 -32.83 63.49 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 120.554 -1.341 . . . . 0.0 112.923 174.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -64.9 -46.48 81.53 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.957 1.303 . . . . 0.0 113.041 171.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -74.91 -18.55 60.39 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 122.008 0.909 . . . . 0.0 113.351 175.181 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.717 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 27.8 tp -66.85 -45.39 78.33 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.887 1.275 . . . . 0.0 111.274 178.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -61.72 -24.17 66.62 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -81.79 -50.71 8.93 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.545 171.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.717 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 9.5 pt-20 -61.65 -44.14 97.54 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 123.983 0.802 . . . . 0.0 112.895 177.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.433 ' HA ' HD23 ' A' ' 28' ' ' LEU . 59.7 t -50.87 -34.39 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.54 1.136 . . . . 0.0 111.932 173.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.05 -62.38 1.59 Allowed 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.453 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.51 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -54.25 -34.05 59.87 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 174.493 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.433 HD23 ' HA ' ' A' ' 25' ' ' VAL . 10.5 tp -68.6 -54.95 13.3 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.267 1.827 . . . . 0.0 112.59 176.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -63.0 -27.79 69.66 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.302 0.641 . . . . 0.0 111.58 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 27' ' ' ARG . 0.8 OUTLIER -58.22 -30.18 66.3 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 124.448 1.099 . . . . 0.0 113.678 169.61 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.1 mt -69.49 -35.54 75.67 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.053 0.541 . . . . 0.0 111.227 176.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.7 t -89.02 15.86 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.565 1.542 0 C-N-CA 124.239 1.016 . . . . 0.0 110.848 175.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.88 -49.97 1.31 Allowed Glycine 0 CA--C 1.537 1.433 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.224 177.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -177.68 81.68 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 125.282 1.433 . . . . 0.0 112.095 -177.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.145 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.125 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.154 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 60.25 114.25 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 125.176 1.39 . . . . 0.0 111.117 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.8 mtm180 -85.95 15.16 5.19 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.446 ' HE2' HD12 ' A' ' 7' ' ' LEU . 35.4 mmt -80.17 8.99 6.17 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 113.61 -1.632 . . . . 0.0 113.253 -178.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -111.52 -30.7 7.27 Favored 'General case' 0 CA--C 1.554 1.124 0 O-C-N 124.586 1.179 . . . . 0.0 112.061 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -95.68 -47.06 6.36 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 114.968 -1.015 . . . . 0.0 112.975 175.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.446 HD12 ' HE2' ' A' ' 4' ' ' MET . 95.3 mt -60.67 -32.72 71.91 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.805 175.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -55.11 -41.72 72.03 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-O 116.996 -1.478 . . . . 0.0 113.366 170.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -68.41 -33.51 74.35 Favored 'General case' 0 CA--C 1.557 1.215 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 176.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.559 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 15.2 tttm -70.88 -49.87 41.21 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.694 1.198 . . . . 0.0 112.293 174.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.0 t -69.87 -31.03 46.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.137 0.975 . . . . 0.0 112.031 177.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -55.83 -53.16 60.09 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-O 117.755 -1.117 . . . . 0.0 111.495 175.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 1.2 pp20? -60.98 -24.57 66.21 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 125.154 1.534 . . . . 0.0 113.18 176.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.4 mt -75.43 -62.19 1.65 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 117.117 -1.421 . . . . 0.0 109.553 173.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 19.0 mt -55.28 -48.28 74.28 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 118.138 -0.934 . . . . 0.0 112.602 -178.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.1 p -48.44 -36.2 14.44 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.445 1.098 . . . . 0.0 112.462 175.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.2 mtmp? -90.24 -45.97 8.72 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.753 1.221 . . . . 0.0 113.717 176.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.448 ' O ' ' HB3' ' A' ' 21' ' ' LEU . 0.2 OUTLIER -54.64 -32.43 59.02 Favored 'General case' 0 CA--C 1.553 1.093 0 O-C-N 120.608 -1.308 . . . . 0.0 112.333 174.713 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.484 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 16.9 m-85 -65.08 -51.13 63.16 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.064 1.345 . . . . 0.0 111.384 171.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -15.09 63.24 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 175.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.448 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 19.4 tp -65.47 -35.79 81.95 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.012 0.925 . . . . 0.0 112.405 176.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 12.6 pt-20 -60.34 -27.41 67.34 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -55.33 -30.77 60.91 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.98 0.912 . . . . 0.0 111.392 175.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -73.83 -60.58 2.19 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.4 1.48 . . . . 0.0 109.303 -178.393 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.473 ' HA ' HD23 ' A' ' 28' ' ' LEU . 78.3 t -41.58 -39.5 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 124.369 1.068 . . . . 0.0 112.276 173.432 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.49 -66.53 0.53 Allowed 'General case' 0 CA--C 1.549 0.912 0 O-C-N 123.902 0.751 . . . . 0.0 112.887 175.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.533 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 0.1 OUTLIER -52.3 -36.83 54.11 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 124.095 0.958 . . . . 0.0 113.424 176.625 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.587 ' HA ' HD12 ' A' ' 31' ' ' LEU . 8.9 tp -64.09 -53.74 44.88 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.375 2.27 . . . . 0.0 112.431 175.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.67 -26.08 67.8 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 123.695 0.622 . . . . 0.0 111.153 177.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -76.79 -24.87 52.84 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 171.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.587 HD12 ' HA ' ' A' ' 28' ' ' LEU . 27.9 mt -71.8 -32.34 67.5 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.571 0.749 . . . . 0.0 111.295 172.432 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.9 t -86.27 13.55 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.051 0.541 . . . . 0.0 111.704 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -94.3 -42.54 3.96 Favored Glycine 0 CA--C 1.539 1.581 0 C-N-CA 124.991 1.282 . . . . 0.0 112.557 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -143.68 17.66 1.82 Allowed 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 114.8 1.408 . . . . 0.0 114.8 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 116.06 -1.924 . . . . 0.0 112.785 -178.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 122.201 1.0 . . . . 0.0 113.101 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -162.39 173.45 14.09 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 113.652 -1.613 . . . . 0.0 111.347 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 26.2 mtt85 -89.9 12.66 16.71 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 113.969 -1.469 . . . . 0.0 114.333 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.25 -11.73 59.85 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 178.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.88 -25.49 26.16 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.733 0.813 . . . . 0.0 112.014 173.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.44 -39.37 7.99 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.329 0.652 . . . . 0.0 111.871 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.4 mt -62.73 -47.08 85.12 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 117.622 -1.18 . . . . 0.0 110.328 177.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.08 -29.61 70.5 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 174.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -72.51 -37.88 68.25 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.332 0.653 . . . . 0.0 112.309 174.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.4 -30.61 23.46 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 79.3 t -70.63 -37.55 69.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 125.155 1.382 . . . . 0.0 111.055 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.8 -39.47 91.85 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 174.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.38 -28.02 67.88 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 115.355 -0.839 . . . . 0.0 112.621 173.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.9 mt -65.55 -62.15 1.69 Allowed 'General case' 0 C--O 1.205 -1.253 0 CA-C-O 117.806 -1.092 . . . . 0.0 109.083 176.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.4 mt -55.86 -47.06 78.0 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 117.942 -1.027 . . . . 0.0 111.829 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.5 m -45.52 -34.49 3.3 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -95.91 -58.87 1.98 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.709 1.204 . . . . 0.0 112.003 172.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.425 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 15.8 t-20 -56.74 -46.12 81.55 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.935 2.094 . . . . 0.0 114.175 -176.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -62.86 -34.98 78.49 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.801 1.241 . . . . 0.0 110.01 173.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -86.31 7.01 27.18 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 126.242 1.817 . . . . 0.0 113.34 172.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.425 ' HB3' ' HA ' ' A' ' 18' ' ' ASN . 28.8 tp -111.82 -42.29 3.84 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 120.592 -1.317 . . . . 0.0 110.934 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -29.8 68.09 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.969 172.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.42 -43.76 84.83 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 120.966 0.412 . . . . 0.0 111.675 174.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.407 ' O ' ' HB3' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -67.65 -52.75 34.45 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 117.939 -1.029 . . . . 0.0 111.812 -178.912 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.426 ' HA ' HD23 ' A' ' 28' ' ' LEU . 98.9 t -43.09 -41.21 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 O-C-N 124.748 1.28 . . . . 0.0 111.376 170.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.42 -67.64 0.43 Allowed 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 117.414 -1.279 . . . . 0.0 112.302 174.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.8 mtm-85 -51.71 -35.57 43.45 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 177.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 25' ' ' VAL . 6.4 tp -63.15 -60.32 3.58 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.889 2.075 . . . . 0.0 112.0 172.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -64.61 -19.58 65.77 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 119.019 -0.515 . . . . 0.0 112.359 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.9 mmtp -65.08 -20.26 66.39 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 169.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.4 mt -94.58 -26.06 16.54 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.173 0.989 . . . . 0.0 111.22 176.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.3 t -104.54 17.89 5.09 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 C-N-CA 124.925 1.29 . . . . 0.0 111.53 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.85 -39.15 0.72 Allowed Glycine 0 N--CA 1.479 1.55 0 C-N-CA 124.661 1.125 . . . . 0.0 112.012 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -107.46 34.59 3.44 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.652 0.781 . . . . 0.0 111.023 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 . . . . . 0 C--O 1.259 1.587 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -178.774 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 37.73 41.27 0.31 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 125.129 1.372 . . . . 0.0 113.843 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.4 mpp_? -80.15 48.97 1.05 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.668 -175.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 34.5 mmt -62.08 -14.84 40.3 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.417 1.487 . . . . 0.0 112.581 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.18 -55.1 5.72 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.08 1.352 . . . . 0.0 111.364 168.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -79.63 -49.49 12.07 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 125.825 1.65 . . . . 0.0 113.937 -178.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.656 HD23 ' HE2' ' A' ' 10' ' ' LYS . 73.8 mt -52.11 -30.84 28.12 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.483 1.113 . . . . 0.0 110.823 174.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -65.97 -22.5 66.48 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 172.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.75 -38.7 70.37 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.193 0.997 . . . . 0.0 110.186 176.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.656 ' HE2' HD23 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -89.59 -23.26 22.0 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 174.591 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 7' ' ' LEU . 19.8 t -48.91 -41.22 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 172.184 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -71.22 -42.12 69.33 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.77 176.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -60.57 -20.49 60.59 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 65.3 mt -66.62 -62.54 1.4 Allowed 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 118.017 -0.992 . . . . 0.0 108.68 175.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.0 mt -55.95 -44.77 78.75 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-O 117.351 -1.309 . . . . 0.0 111.729 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.7 p -50.87 -27.72 8.05 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -103.08 -53.02 2.91 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.024 1.73 . . . . 0.0 112.554 175.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.493 ' O ' ' HB3' ' A' ' 21' ' ' LEU . 7.3 t-20 -60.15 -44.85 94.64 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.618 1.967 . . . . 0.0 114.085 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.91 -38.31 88.39 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.923 1.289 . . . . 0.0 111.337 174.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -68.4 -29.45 68.14 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.907 1.283 . . . . 0.0 112.31 171.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.77 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 14.1 tp -67.67 -46.52 72.13 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.545 1.938 . . . . 0.0 110.92 179.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -60.47 -24.3 65.15 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.949 0.781 . . . . 0.0 112.436 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -80.08 -56.9 3.91 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.103 0.961 . . . . 0.0 111.904 169.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.77 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 12.9 pt-20 -56.37 -44.33 80.05 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-O 118.371 -0.824 . . . . 0.0 112.796 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.536 ' HA ' HD23 ' A' ' 28' ' ' LEU . 38.4 t -49.82 -36.58 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 126.946 2.099 . . . . 0.0 111.63 173.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.31 -66.05 0.59 Allowed 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.736 175.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -51.19 -41.56 60.3 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.257 0.623 . . . . 0.0 111.843 175.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.536 HD23 ' HA ' ' A' ' 25' ' ' VAL . 10.2 tp -56.06 -64.07 0.98 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.345 1.858 . . . . 0.0 112.044 173.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -65.06 -18.0 64.93 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.3 mmtp -77.32 -30.02 53.83 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.969 0.908 . . . . 0.0 113.15 170.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.631 HD12 HG23 ' A' ' 32' ' ' VAL . 4.1 pp -100.36 -0.7 37.76 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.382 1.623 . . . . 0.0 115.382 174.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.631 HG23 HD12 ' A' ' 31' ' ' LEU . 70.4 t -124.97 4.13 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 125.441 1.496 . . . . 0.0 111.765 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.43 -41.61 2.17 Favored Glycine 0 N--CA 1.479 1.558 0 C-N-CA 124.035 0.826 . . . . 0.0 111.937 177.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.95 70.96 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 125.265 1.426 . . . . 0.0 113.53 -175.328 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 . . . . . 0 C--O 1.254 1.308 0 CA-C-O 117.393 -1.289 . . . . 0.0 113.732 175.611 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.511 2.591 0 CA-C-O 122.508 1.147 . . . . 0.0 113.26 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -113.41 88.29 2.8 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 123.525 1.631 . . . . 0.0 110.941 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -133.31 150.42 51.88 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 111.911 -2.404 . . . . 0.0 109.874 177.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 31.3 mmt 64.92 6.51 3.43 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 114.174 -1.376 . . . . 0.0 114.563 -177.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -108.57 -42.11 4.63 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.545 1.138 . . . . 0.0 113.529 173.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -92.3 -34.64 14.14 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 175.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.1 mt -65.49 -32.34 73.9 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.752 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.22 -34.88 73.43 Favored 'General case' 0 CA--C 1.552 1.056 0 CA-C-N 115.232 -0.895 . . . . 0.0 112.769 173.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -38.84 90.05 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.828 0.851 . . . . 0.0 112.366 175.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.53 -40.1 85.04 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.252 173.333 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.72 -45.27 95.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 C-N-CA 123.28 0.632 . . . . 0.0 112.337 177.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -67.43 -32.21 72.93 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.09 -20.0 63.57 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.808 0.843 . . . . 0.0 112.85 177.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.8 mt -66.95 -63.96 0.95 Allowed 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 117.19 -1.386 . . . . 0.0 108.795 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.8 mt -55.22 -46.74 75.95 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 117.667 -1.158 . . . . 0.0 111.731 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 m -46.11 -31.36 2.32 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 172.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.59 -50.1 3.66 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 172.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.402 ' O ' ' HB3' ' A' ' 21' ' ' LEU . 8.2 t-20 -58.99 -46.74 87.4 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.295 1.838 . . . . 0.0 113.131 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.98 -34.81 78.95 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.93 1.292 . . . . 0.0 110.753 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -72.38 -29.48 63.81 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.359 1.463 . . . . 0.0 112.968 172.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.402 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 13.1 tp -68.57 -43.19 77.1 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 126.305 1.842 . . . . 0.0 111.717 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -52.22 -31.47 32.24 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 124.37 1.044 . . . . 0.0 112.465 174.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -66.45 -46.27 77.0 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.53 0.732 . . . . 0.0 111.978 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -61.18 -48.39 81.76 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 174.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.1 t -46.67 -40.93 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 CA-C-O 117.301 -1.333 . . . . 0.0 109.938 171.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -62.31 -62.37 1.81 Allowed 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 116.21 -1.852 . . . . 0.0 112.057 173.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -47.38 -40.88 18.61 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 119.367 0.985 . . . . 0.0 113.296 176.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.6 tp -65.16 -60.3 3.16 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 126.992 2.117 . . . . 0.0 112.391 173.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -60.36 -28.94 68.58 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.915 1.286 . . . . 0.0 110.674 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.565 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 29.0 mmtm -49.47 -33.62 14.8 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 119.389 0.995 . . . . 0.0 111.707 172.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.8 mp -71.74 -47.78 51.46 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.09 0.956 . . . . 0.0 113.395 173.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.4 t -89.19 17.97 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 C-N-CA 124.056 0.942 . . . . 0.0 111.278 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -121.46 -41.42 0.5 Allowed Glycine 0 CA--C 1.533 1.205 0 C-N-CA 125.297 1.427 . . . . 0.0 111.52 -176.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.98 38.4 1.08 Allowed 'General case' 0 N--CA 1.485 1.29 0 CA-C-O 122.388 1.09 . . . . 0.0 111.018 174.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.306 0 CA-C-N 114.584 -1.189 . . . . 0.0 112.022 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -61.56 96.15 0.06 Allowed 'General case' 0 N--CA 1.488 1.455 0 CA-C-O 123.109 1.433 . . . . 0.0 112.31 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.96 151.04 42.21 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 112.932 -1.94 . . . . 0.0 112.627 -178.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.67 5.74 0.99 Allowed 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 112.512 -2.131 . . . . 0.0 114.305 -168.061 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.07 -23.5 8.47 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 125.127 1.371 . . . . 0.0 114.182 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -110.23 -26.99 9.33 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 165.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 49.0 mt -66.46 -40.5 89.44 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 121.769 -0.582 . . . . 0.0 111.581 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -62.7 -31.25 72.12 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-O 116.545 -1.693 . . . . 0.0 111.445 173.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -40.91 86.75 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 121.034 1.743 . . . . 0.0 111.476 177.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -80.53 -45.7 17.02 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 112.794 -2.003 . . . . 0.0 110.385 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.7 t -67.05 -18.35 24.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 124.333 1.053 . . . . 0.0 113.279 175.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 63.0 tt0 -71.68 -39.4 70.26 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 125.359 1.464 . . . . 0.0 111.49 174.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -58.74 -22.32 57.52 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 125.211 1.57 . . . . 0.0 110.797 175.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.7 mt -67.15 -64.68 0.8 Allowed 'General case' 0 C--O 1.215 -0.732 0 CA-C-O 116.713 -1.613 . . . . 0.0 109.543 175.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.7 mt -54.78 -47.39 74.02 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-O 117.739 -1.124 . . . . 0.0 112.097 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 62.3 m -45.28 -33.34 2.35 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 172.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.04 -52.95 3.4 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 170.099 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -57.61 -46.37 84.17 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 126.159 1.784 . . . . 0.0 113.203 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -63.31 -34.9 78.7 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.66 1.184 . . . . 0.0 110.828 175.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.443 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 2.9 t60 -81.82 -9.1 59.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.185 1.394 . . . . 0.0 114.071 173.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.709 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 22.2 tp -89.54 -44.56 10.02 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 125.668 1.587 . . . . 0.0 109.756 -177.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.16 -29.06 68.42 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.127 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.443 ' OD1' ' HA ' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -80.5 -47.47 14.22 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 123.477 0.486 . . . . 0.0 111.705 172.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.709 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 21.8 pt-20 -64.51 -45.04 88.95 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.53 -0.748 . . . . 0.0 112.427 -177.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.499 ' HA ' HD23 ' A' ' 28' ' ' LEU . 62.8 t -50.65 -34.83 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.526 1.53 . . . . 0.0 111.064 172.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 23' ' ' ASN . . . -60.49 -71.98 0.12 Allowed 'General case' 0 CA--C 1.537 0.451 0 O-C-N 124.757 1.286 . . . . 0.0 111.339 171.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.552 ' H ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -53.65 -31.04 45.91 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 177.489 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.499 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.3 tp -64.47 -65.12 0.72 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 126.538 1.935 . . . . 0.0 112.768 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -22.02 65.06 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 121.919 -0.488 . . . . 0.0 111.574 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -64.59 -16.51 62.8 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.3 1.04 . . . . 0.0 113.467 172.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 28.3 mt -73.8 -17.37 61.09 Favored 'General case' 0 C--O 1.21 -1.02 0 O-C-N 125.039 1.462 . . . . 0.0 112.953 168.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 57.4 t -93.65 8.42 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 124.112 0.965 . . . . 0.0 111.309 176.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -88.74 -28.07 22.49 Favored Glycine 0 N--CA 1.485 1.965 0 C-N-CA 124.264 0.935 . . . . 0.0 113.608 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -121.1 35.74 4.8 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.775 1.63 . . . . 0.0 112.467 -176.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 116.675 -1.631 . . . . 0.0 114.128 176.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 68.2 95.8 0.06 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 124.851 1.344 . . . . 0.0 111.407 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.73 137.45 0.6 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 127.023 2.129 . . . . 0.0 108.709 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.4 tpp 75.34 -29.49 0.19 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 126.046 1.738 . . . . 0.0 114.812 -178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -77.94 -34.83 51.02 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.615 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -89.46 -36.59 15.34 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 123.12 0.262 . . . . 0.0 111.502 169.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.5 mt -53.5 -34.02 56.52 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 116.813 -1.565 . . . . 0.0 112.164 -178.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -56.29 -51.87 66.58 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.73 1.382 . . . . 0.0 114.73 170.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.59 -23.14 53.47 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 178.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.89 -32.15 31.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.545 1.538 . . . . 0.0 112.552 174.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.1 t -67.27 -45.22 86.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 125.936 1.695 . . . . 0.0 111.419 177.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -66.43 -41.9 88.5 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 123.94 0.775 . . . . 0.0 111.448 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 1.9 tt0 -59.24 -22.14 60.65 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 114.902 -1.045 . . . . 0.0 112.96 177.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.3 -59.28 5.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.193 0.597 . . . . 0.0 111.393 177.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.3 mt -58.85 -49.99 75.68 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.323 0.649 . . . . 0.0 110.564 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.8 m -50.77 -36.93 39.25 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.8 1.24 . . . . 0.0 113.511 174.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 54.0 mttm -80.61 -49.07 11.76 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.918 0.887 . . . . 0.0 113.196 174.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -58.89 -42.07 88.65 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.174 0.99 . . . . 0.0 112.772 178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -58.79 -45.15 90.54 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.999 171.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.35 -33.93 77.13 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.36 1.064 . . . . 0.0 113.138 174.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -69.52 -46.28 66.88 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 126.451 1.9 . . . . 0.0 111.485 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -57.36 -30.64 65.03 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 174.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -64.72 -45.75 85.21 Favored 'General case' 0 N--CA 1.485 1.275 0 CA-C-N 114.406 -1.27 . . . . 0.0 111.132 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -61.51 -50.12 73.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 118.035 -0.983 . . . . 0.0 112.763 177.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.427 ' HA ' HD23 ' A' ' 28' ' ' LEU . 71.9 t -44.14 -39.55 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 C-N-CA 125.46 1.504 . . . . 0.0 112.002 171.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.455 ' O ' ' HD3' ' A' ' 30' ' ' LYS . . . -65.55 -68.3 0.38 Allowed 'General case' 0 N--CA 1.482 1.157 0 CA-C-O 118.2 -0.905 . . . . 0.0 112.073 174.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.1 ttt180 -51.01 -34.3 28.68 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 176.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 25' ' ' VAL . 11.5 tp -61.76 -57.63 11.14 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.651 1.981 . . . . 0.0 112.544 171.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -63.16 -24.34 67.84 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HD3' ' O ' ' A' ' 26' ' ' ALA . 0.2 OUTLIER -69.39 -20.7 63.81 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.607 1.163 . . . . 0.0 113.581 169.484 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.6 mt -67.75 -26.34 66.08 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 120.884 -1.135 . . . . 0.0 111.791 175.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 42.5 t -85.08 12.81 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 CA-C-O 122.432 1.11 . . . . 0.0 111.478 173.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.54 -21.88 12.14 Favored Glycine 0 CA--C 1.549 2.173 0 C-N-CA 125.191 1.376 . . . . 0.0 113.15 175.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -104.92 -89.2 0.42 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.972 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.139 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -112.52 85.52 2.18 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-O 122.815 1.293 . . . . 0.0 109.53 176.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.24 -9.01 9.61 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 110.141 -3.209 . . . . 0.0 114.156 175.236 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.4 mpp? 50.69 25.97 2.3 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.606 1.163 . . . . 0.0 113.009 -173.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.9 12.38 4.78 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 126.735 2.014 . . . . 0.0 113.864 -175.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -120.44 -45.99 2.4 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.125 1.37 . . . . 0.0 113.509 -176.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.494 ' HA ' ' HG3' ' A' ' 10' ' ' LYS . 38.4 mt -61.61 -27.96 69.03 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.884 -0.51 . . . . 0.0 111.076 171.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -68.38 -46.12 70.89 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.202 171.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.56 -36.28 80.18 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 124.4 1.063 . . . . 0.0 111.875 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.494 ' HG3' ' HA ' ' A' ' 7' ' ' LEU 0.261 0.0 OUTLIER -75.36 -28.73 59.67 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 175.045 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 7' ' ' LEU . 12.9 t -57.94 -45.42 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 123.368 0.417 . . . . 0.0 111.328 177.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -69.07 -33.62 73.84 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 176.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -59.91 -24.42 64.3 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 124.01 0.818 . . . . 0.0 111.892 175.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.8 mt -64.85 -64.44 0.87 Allowed 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 117.342 -1.313 . . . . 0.0 109.414 174.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.9 mt -55.86 -44.56 78.19 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 118.031 -0.985 . . . . 0.0 111.568 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 t -49.53 -29.53 7.01 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 174.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.0 mmtp -101.28 -52.94 3.13 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 126.101 1.76 . . . . 0.0 113.666 173.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.422 ' O ' ' HB3' ' A' ' 21' ' ' LEU . 9.9 t-20 -59.49 -46.96 87.31 Favored 'General case' 0 CA--C 1.56 1.337 0 C-N-CA 126.742 2.017 . . . . 0.0 113.828 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.73 -32.21 73.79 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.64 1.176 . . . . 0.0 111.135 174.728 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -76.49 -25.09 53.91 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.454 1.502 . . . . 0.0 112.77 173.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.422 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 13.7 tp -72.88 -48.16 39.79 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.91 1.684 . . . . 0.0 111.506 -178.042 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.14 -30.73 62.55 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 123.666 0.604 . . . . 0.0 111.436 175.084 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -65.8 -41.77 91.53 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.801 174.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.408 ' HA ' ' HG2' ' A' ' 27' ' ' ARG . 1.2 mm-40 -61.5 -52.8 63.0 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.314 1.009 . . . . 0.0 113.27 173.242 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.2 t -46.31 -37.78 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 C-N-CA 124.248 1.019 . . . . 0.0 112.062 173.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.13 -64.16 0.91 Allowed 'General case' 0 N--CA 1.484 1.255 0 O-C-N 123.746 0.654 . . . . 0.0 112.374 175.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.425 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 11.0 ptp85 -53.25 -31.23 42.44 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 175.137 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.9 tp -67.98 -55.59 12.1 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.982 1.713 . . . . 0.0 112.009 172.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -62.81 -24.27 67.67 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' A' ' 27' ' ' ARG . 32.1 tttt -60.67 -29.65 69.43 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.619 1.568 . . . . 0.0 113.415 169.127 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.64 -28.38 66.84 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.484 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.6 t -88.28 15.39 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 124.364 1.066 . . . . 0.0 110.326 174.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.75 -45.71 1.74 Allowed Glycine 0 CA--C 1.541 1.705 0 C-N-CA 125.13 1.347 . . . . 0.0 111.809 177.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -85.64 20.73 2.03 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.208 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.415 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.03 58.61 0.22 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 126.658 1.983 . . . . 0.0 111.543 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 179.13 72.04 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 116.1 1.889 . . . . 0.0 116.1 -170.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -98.51 -25.69 14.68 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 177.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.5 tttm 172.54 -40.48 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 126.933 2.093 . . . . 0.0 111.463 -171.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -96.55 -55.48 2.9 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 113.676 -1.602 . . . . 0.0 113.038 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 36.6 mt -69.76 -24.11 63.47 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.348 176.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -63.7 -36.15 82.9 Favored 'General case' 0 C--O 1.204 -1.34 0 CA-C-O 117.254 -1.355 . . . . 0.0 111.964 173.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -56.14 -34.83 66.48 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 123.895 0.747 . . . . 0.0 112.567 177.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -81.76 -50.01 9.74 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 114.248 -1.342 . . . . 0.0 111.277 177.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.469 HG13 HD12 ' A' ' 14' ' ' LEU . 33.9 t -65.09 -15.71 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 124.316 1.047 . . . . 0.0 112.619 176.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.32 -44.91 96.41 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.437 1.495 . . . . 0.0 110.454 175.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.18 -28.6 69.25 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 125.593 1.808 . . . . 0.0 111.355 175.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.469 HD12 HG13 ' A' ' 11' ' ' VAL . 45.4 mt -71.33 -59.73 2.61 Favored 'General case' 0 C--O 1.195 -1.767 0 CA-C-O 118.718 -0.658 . . . . 0.0 110.412 175.15 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 15.3 mt -57.89 -49.12 77.79 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 124.24 0.962 . . . . 0.0 112.904 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.5 p -51.18 -35.1 34.55 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.734 0.813 . . . . 0.0 112.478 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.1 tmmm? -80.06 -55.86 4.64 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 170.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.404 ' O ' ' HB3' ' A' ' 21' ' ' LEU . 1.9 t-20 -48.77 -33.5 10.45 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 125.609 1.563 . . . . 0.0 111.823 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -69.36 -44.56 71.34 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 126.034 1.734 . . . . 0.0 112.668 173.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.09 -10.93 59.96 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 174.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.404 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 19.4 tp -70.41 -52.69 20.52 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 125.273 1.429 . . . . 0.0 111.757 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -56.2 -28.71 59.24 Favored 'General case' 0 CA--C 1.553 1.086 0 O-C-N 124.564 1.165 . . . . 0.0 111.554 174.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.7 -46.2 90.72 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.807 176.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -50.0 75.46 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.894 0.478 . . . . 0.0 111.679 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.401 ' O ' ' HB2' ' A' ' 29' ' ' LYS . 83.7 t -43.05 -40.53 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.192 -1.931 0 O-C-N 124.882 1.364 . . . . 0.0 111.648 171.09 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.96 -54.83 18.08 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 117.934 -1.031 . . . . 0.0 113.208 175.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.1 -38.7 58.17 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-N 118.527 0.603 . . . . 0.0 111.851 173.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.1 tp -67.79 -55.46 12.92 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.868 1.267 . . . . 0.0 112.027 172.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 25' ' ' VAL . 1.3 tmtm? -58.39 -31.17 67.42 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 126.339 1.856 . . . . 0.0 109.937 -178.576 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -35.39 60.19 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-N 118.99 0.814 . . . . 0.0 111.586 173.631 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.1 mp -71.27 -41.16 70.38 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.23 174.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 57.4 t -82.7 6.67 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 C-N-CA 123.877 0.871 . . . . 0.0 111.524 175.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -90.31 -42.5 5.21 Favored Glycine 0 N--CA 1.484 1.888 0 C-N-CA 125.11 1.338 . . . . 0.0 111.104 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -129.41 12.6 5.98 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.302 1.964 . . . . 0.0 116.302 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.456 ' HG3' HH11 ' A' ' 35' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.933 0 CA-C-O 116.442 -1.742 . . . . 0.0 113.489 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.534 HD12 HD22 ' A' ' 7' ' ' LEU . 2.1 pt? . . . . . 0 CA--C 1.552 1.024 0 CA-C-O 121.88 0.848 . . . . 0.0 112.747 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.44 ' O ' ' HB2' ' A' ' 6' ' ' GLN . 60.6 tt0 -155.92 159.83 39.62 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 114.23 -1.35 . . . . 0.0 108.908 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 89.08 119.5 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 127.113 2.165 . . . . 0.0 109.374 170.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.6 mmt -57.27 -29.64 64.02 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 113.782 1.03 . . . . 0.0 113.782 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -73.63 -12.15 60.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 125.7 1.875 . . . . 0.0 114.046 171.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.44 ' HB2' ' O ' ' A' ' 2' ' ' GLN . 46.5 mt-30 -113.31 -36.75 4.9 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 175.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.534 HD22 HD12 ' A' ' 1' ' ' LEU . 19.7 mt -56.8 -44.01 81.5 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 175.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -66.53 -30.48 70.8 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 114.507 -1.224 . . . . 0.0 111.743 173.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -41.4 81.41 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.466 0.706 . . . . 0.0 110.264 177.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.438 ' HE2' HD13 ' A' ' 1' ' ' LEU . 5.2 tmtm? -66.12 -42.97 88.44 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 113.925 -1.489 . . . . 0.0 110.53 174.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.3 t -66.53 -34.15 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 121.698 -0.626 . . . . 0.0 112.25 175.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -59.73 -36.14 75.98 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 117.707 -1.14 . . . . 0.0 111.751 178.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -53.94 -36.05 62.38 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 124.382 1.051 . . . . 0.0 111.922 173.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.7 mt -69.76 -60.12 2.51 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 114.81 -1.086 . . . . 0.0 108.906 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.1 mt -55.71 -47.38 76.96 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 118.332 -0.842 . . . . 0.0 112.215 178.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.0 t -49.02 -38.25 23.07 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.752 1.221 . . . . 0.0 112.624 174.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.74 -44.74 12.27 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 172.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -55.18 -33.47 63.03 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.572 1.549 . . . . 0.0 112.288 178.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -66.22 -39.92 89.94 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 125.568 1.547 . . . . 0.0 113.648 170.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -80.1 -16.21 55.48 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 172.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.4 tp -76.76 -46.19 26.17 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.159 1.384 . . . . 0.0 112.483 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -51.02 -31.85 19.61 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 174.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -58.59 -53.75 54.85 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.599 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -60.28 -55.26 35.91 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 116.818 -1.563 . . . . 0.0 110.314 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.9 t -42.97 -40.03 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 124.837 1.255 . . . . 0.0 112.333 174.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.97 -66.0 0.61 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.958 0.903 . . . . 0.0 112.865 175.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.406 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 4.3 mmm-85 -53.19 -31.71 44.24 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 174.614 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.7 tp -64.67 -58.97 4.84 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.28 1.832 . . . . 0.0 111.998 170.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -62.68 -21.18 65.55 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 122.956 0.502 . . . . 0.0 112.181 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -63.38 -34.49 77.83 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.826 0.85 . . . . 0.0 112.766 168.207 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.737 HD12 HG23 ' A' ' 32' ' ' VAL . 3.3 pp -104.97 8.15 34.39 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 176.661 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.737 HG23 HD12 ' A' ' 31' ' ' LEU . 69.4 t -128.06 4.13 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 125.338 1.455 . . . . 0.0 112.749 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.63 -32.25 1.96 Allowed Glycine 0 N--CA 1.487 2.063 0 C-N-CA 123.829 0.728 . . . . 0.0 113.761 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -118.88 -91.77 0.55 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.69 0.796 . . . . 0.0 111.882 -178.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.262 1.717 0 CA-C-O 115.83 -2.033 . . . . 0.0 113.336 177.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.653 ' HB3' HD13 ' A' ' 7' ' ' LEU . 75.2 mt-30 63.81 96.51 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.821 1.248 . . . . 0.0 112.387 -179.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.99 75.53 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 112.871 -1.968 . . . . 0.0 115.145 -174.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.462 ' CE ' HD12 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -94.53 -29.55 14.85 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 114.02 -1.446 . . . . 0.0 114.391 178.518 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 167.99 -30.12 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 129.318 3.047 . . . . 0.0 113.677 -172.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -100.72 -54.16 2.89 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.761 -178.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.653 HD13 ' HB3' ' A' ' 2' ' ' GLN . 30.3 mt -68.46 -21.83 64.6 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-N 114.077 -1.419 . . . . 0.0 112.167 176.027 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -67.29 -31.84 72.42 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 172.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.76 -35.49 63.83 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 123.805 0.691 . . . . 0.0 111.337 174.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.2 mmtt -76.16 -18.25 59.2 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 112.825 -1.989 . . . . 0.0 111.769 -178.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.8 t -90.93 -41.47 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 C-N-CA 125.325 1.45 . . . . 0.0 109.623 178.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -61.43 -37.15 82.49 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.026 0.53 . . . . 0.0 111.777 174.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -60.98 -26.83 67.85 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 124.453 1.095 . . . . 0.0 113.014 171.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.0 mt -73.59 -63.98 1.09 Allowed 'General case' 0 N--CA 1.481 1.106 0 CA-C-O 116.73 -1.605 . . . . 0.0 108.374 177.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.0 mt -52.36 -46.53 66.19 Favored 'General case' 0 N--CA 1.485 1.3 0 O-C-N 124.687 1.242 . . . . 0.0 112.73 -178.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.1 p -45.58 -33.41 2.79 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 16.1 mttt -103.26 -55.26 2.44 Favored 'General case' 0 C--O 1.213 -0.826 0 C-N-CA 125.821 1.648 . . . . 0.0 115.274 172.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -52.45 -38.13 58.56 Favored 'General case' 0 CA--C 1.568 1.639 0 C-N-CA 125.05 1.34 . . . . 0.0 113.175 178.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.46 -39.69 67.57 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 124.593 1.157 . . . . 0.0 110.729 176.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -12.8 60.01 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 123.81 0.694 . . . . 0.0 112.854 173.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.662 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 19.9 tp -76.76 -55.89 5.09 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.943 1.697 . . . . 0.0 110.789 -176.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.15 -25.58 33.12 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 124.728 1.268 . . . . 0.0 113.201 173.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -82.2 -50.85 8.55 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 124.595 1.184 . . . . 0.0 112.04 174.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.662 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 13.1 pt-20 -61.49 -45.77 92.81 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 118.837 -0.602 . . . . 0.0 112.251 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.435 ' HA ' HD23 ' A' ' 28' ' ' LEU . 82.6 t -51.26 -34.59 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.752 1.621 . . . . 0.0 111.065 174.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.31 -68.35 0.32 Allowed 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 118.056 -0.973 . . . . 0.0 111.138 173.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.0 tpp85 -50.87 -38.85 51.85 Favored 'General case' 0 CA--C 1.559 1.322 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 174.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.3 tp -60.91 -65.39 0.7 Allowed 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.933 1.293 . . . . 0.0 111.734 174.651 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . 0.256 0.0 OUTLIER -65.71 -20.43 66.28 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.292 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.62 -33.45 66.28 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.808 1.243 . . . . 0.0 112.181 172.198 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.0 pp -103.56 13.31 33.64 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 175.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.6 t -118.1 -12.71 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.871 175.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.31 -46.7 6.03 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.066 1.317 . . . . 0.0 111.738 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.03 18.31 9.41 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 . . . . . 0 C--O 1.263 1.775 0 C-N-CA 126.289 1.835 . . . . 0.0 113.355 -171.934 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.896 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.32 144.14 50.91 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 114.151 -1.386 . . . . 0.0 107.901 176.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 78.84 66.89 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 128.399 2.679 . . . . 0.0 110.632 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.587 ' HE2' HD12 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -50.11 -35.15 24.5 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp -59.62 -50.67 72.97 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 125.117 1.367 . . . . 0.0 110.969 176.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 38.5 tp60 -76.98 -44.15 32.17 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.461 1.104 . . . . 0.0 113.283 176.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.739 HD23 ' HE3' ' A' ' 10' ' ' LYS . 76.0 mt -54.0 -33.89 58.33 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 118.396 -0.811 . . . . 0.0 111.796 175.25 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.98 -21.73 66.33 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.84 -41.24 68.37 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.972 0.909 . . . . 0.0 110.284 175.282 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.739 ' HE3' HD23 ' A' ' 7' ' ' LEU 0.254 0.1 OUTLIER -89.2 -26.03 21.46 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.906 1.817 . . . . 0.0 115.906 176.054 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 24.1 t -45.97 -40.62 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 172.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.37 -48.54 67.13 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 174.645 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -55.98 -29.68 60.63 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.323 1.049 . . . . 0.0 111.602 173.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 10' ' ' LYS . 54.9 mt -66.71 -62.74 1.29 Allowed 'General case' 0 C--O 1.212 -0.872 0 CA-C-O 117.769 -1.11 . . . . 0.0 109.599 175.366 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.1 -45.72 75.49 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 118.38 -0.819 . . . . 0.0 113.116 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.5 p -51.45 -35.49 39.85 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.291 0.636 . . . . 0.0 112.312 176.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -91.19 -43.32 9.93 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 176.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -54.25 -31.86 54.61 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.298 1.039 . . . . 0.0 112.137 174.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -68.83 -41.86 77.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.989 1.715 . . . . 0.0 113.604 172.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.61 -19.44 59.24 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 172.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.6 tp -70.77 -48.81 52.33 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.939 1.296 . . . . 0.0 112.016 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -52.59 -32.32 40.79 Favored 'General case' 0 CA--C 1.555 1.17 0 O-C-N 123.999 0.812 . . . . 0.0 112.439 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -69.03 -48.79 62.08 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.111 176.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -58.21 -54.94 41.3 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 117.373 -1.298 . . . . 0.0 112.532 175.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 78.4 t -43.87 -39.63 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 125.679 1.592 . . . . 0.0 112.228 173.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.485 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -65.53 -69.14 0.31 Allowed 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.772 175.521 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -48.45 -36.5 15.09 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 174.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.457 ' O ' HG23 ' A' ' 32' ' ' VAL . 14.9 tp -59.52 -62.21 2.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 126.714 2.006 . . . . 0.0 111.46 171.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -60.28 -24.23 64.78 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 0.9 OUTLIER -78.8 -34.27 45.55 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.484 173.505 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.26 1.29 53.63 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 174.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 28' ' ' LEU . 44.2 t -114.1 4.71 7.83 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.229 0 C-N-CA 123.9 0.88 . . . . 0.0 111.88 177.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -92.3 -39.25 5.43 Favored Glycine 0 N--CA 1.481 1.69 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.955 175.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -144.68 20.7 1.66 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 ttt-85 . . . . . 0 C--O 1.257 1.497 0 CA-C-O 115.837 -2.03 . . . . 0.0 114.479 -176.001 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.491 ' HG ' HD11 ' A' ' 7' ' ' LEU . 10.0 mp . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.554 HE22 ' HE2' ' A' ' 10' ' ' LYS . 5.9 pt20 -155.59 46.99 0.5 Allowed 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 115.24 -0.891 . . . . 0.0 113.355 -177.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.601 ' HB3' ' HE3' ' A' ' 5' ' ' LYS . 5.5 mmt-85 74.75 140.87 0.07 Allowed 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 127.894 2.477 . . . . 0.0 110.647 -177.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.2 mmt -57.35 -46.77 82.99 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.601 ' HE3' ' HB3' ' A' ' 3' ' ' ARG . 0.4 OUTLIER -55.0 -24.11 22.7 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 172.894 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.43 -42.22 7.44 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 173.066 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.557 ' O ' HG23 ' A' ' 11' ' ' VAL . 58.8 mt -57.18 -42.4 81.1 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 172.527 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -55.93 -36.5 67.81 Favored 'General case' 0 N--CA 1.482 1.16 0 CA-C-O 117.198 -1.382 . . . . 0.0 112.127 175.014 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -59.75 -33.54 71.79 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 173.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.554 ' HE2' HE22 ' A' ' 2' ' ' GLN . 13.4 mmtt -87.16 -30.16 21.24 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.915 1.286 . . . . 0.0 110.757 -177.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 7' ' ' LEU . 12.4 t -79.81 -28.49 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 125.45 1.5 . . . . 0.0 111.668 176.044 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -65.33 -47.13 77.6 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.997 1.319 . . . . 0.0 112.536 176.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -58.08 -30.31 66.13 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 114.229 -1.351 . . . . 0.0 111.375 173.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.9 mt -66.19 -61.89 1.78 Allowed 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.67 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.0 mt -53.2 -42.04 65.88 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.1 m -50.83 -44.73 59.39 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 173.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 16.1 pttm -86.09 -35.72 20.07 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 174.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.48 -43.94 97.98 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.724 1.21 . . . . 0.0 112.341 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -58.59 -35.46 72.46 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 124.62 1.2 . . . . 0.0 111.888 170.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -89.21 5.24 45.67 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 125.976 1.71 . . . . 0.0 114.433 174.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.7 tp -110.95 -50.24 2.96 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.525 0.73 . . . . 0.0 110.439 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -67.85 -24.31 65.24 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.281 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -71.79 -33.88 68.94 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 174.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -78.62 -50.41 11.54 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.987 1.315 . . . . 0.0 111.894 -178.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.42 ' HA ' HD23 ' A' ' 28' ' ' LEU . 85.7 t -46.85 -32.72 1.94 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-O 117.798 -1.096 . . . . 0.0 111.482 169.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.431 ' O ' ' HD3' ' A' ' 30' ' ' LYS . . . -58.72 -63.73 1.18 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 172.115 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.0 ptm180 -55.19 -29.92 58.87 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 175.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 25' ' ' VAL . 5.3 tp -68.92 -57.28 5.73 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.028 1.331 . . . . 0.0 111.665 173.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -59.98 -18.77 48.22 Favored 'General case' 0 C--O 1.216 -0.685 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 26' ' ' ALA . 0.5 OUTLIER -55.96 -37.64 69.29 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.739 1.015 . . . . 0.0 113.739 167.533 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -29.56 45.64 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.195 176.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 61.8 t -90.85 13.43 1.7 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.605 0 C-N-CA 124.985 1.314 . . . . 0.0 110.959 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.23 -41.64 3.19 Favored Glycine 0 N--CA 1.484 1.893 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -138.63 27.82 2.47 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -176.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 N--CA 1.485 1.293 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -74.92 90.06 2.4 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.859 0.864 . . . . 0.0 110.213 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -146.42 163.84 34.35 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 114.218 -1.355 . . . . 0.0 111.088 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.438 ' HE2' HD12 ' A' ' 7' ' ' LEU . 32.1 mmt -54.94 -27.66 45.24 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 118.061 -0.971 . . . . 0.0 113.615 176.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -72.54 -31.66 65.46 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 175.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -97.01 -46.21 6.28 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.46 ' O ' HG23 ' A' ' 11' ' ' VAL . 53.4 mt -56.88 -34.37 67.81 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 118.123 -0.941 . . . . 0.0 110.62 176.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 12' ' ' GLU . 21.5 mm-40 -57.13 -32.36 66.28 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 116.544 -1.693 . . . . 0.0 113.829 169.466 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -60.3 -36.3 77.57 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 119.964 1.256 . . . . 0.0 111.021 175.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.0 mttm -83.65 -49.56 9.04 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.726 1.21 . . . . 0.0 109.931 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.492 HG13 HD12 ' A' ' 14' ' ' LEU . 16.8 t -63.4 -15.41 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 124.329 1.052 . . . . 0.0 111.735 176.033 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -62.35 -39.54 93.47 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.306 1.442 . . . . 0.0 110.914 176.48 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -56.95 -29.76 63.44 Favored 'General case' 0 CA--C 1.554 1.119 0 O-C-N 125.014 1.446 . . . . 0.0 111.522 173.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.492 HD12 HG13 ' A' ' 11' ' ' VAL . 52.1 mt -77.83 -61.58 1.95 Allowed 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 116.573 -1.68 . . . . 0.0 107.769 177.339 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.39 -45.43 62.48 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 117.373 -1.298 . . . . 0.0 113.226 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.3 p -44.67 -36.09 2.95 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 175.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.45 -50.79 3.14 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 172.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.91 -38.85 65.27 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 125.467 1.507 . . . . 0.0 112.464 177.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -68.92 -40.74 78.9 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.902 1.281 . . . . 0.0 110.732 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -14.57 59.56 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 175.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.6 tp -78.63 -45.08 22.36 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.807 1.643 . . . . 0.0 111.025 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.41 -29.93 64.52 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 124.646 1.216 . . . . 0.0 111.552 176.325 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -60.13 -49.59 77.03 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.529 0.732 . . . . 0.0 111.076 175.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.01 -56.04 15.46 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 117.411 -1.281 . . . . 0.0 110.887 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.498 ' HA ' HD23 ' A' ' 28' ' ' LEU . 47.9 t -42.86 -39.09 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 125.214 1.571 . . . . 0.0 111.444 174.448 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.443 ' O ' ' HD2' ' A' ' 30' ' ' LYS . . . -62.09 -72.76 0.12 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 117.922 -1.037 . . . . 0.0 112.782 172.466 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.405 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.6 OUTLIER -47.92 -36.69 12.79 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.395 1.078 . . . . 0.0 112.715 177.657 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 25' ' ' VAL . 8.7 tp -60.99 -60.14 4.26 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.897 2.079 . . . . 0.0 113.461 172.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -62.9 -25.43 68.31 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 178.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.443 ' HD2' ' O ' ' A' ' 26' ' ' ALA . 0.1 OUTLIER -64.88 -19.52 65.95 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 168.754 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 28' ' ' LEU . 16.6 mt -87.98 -42.07 12.7 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.289 1.036 . . . . 0.0 113.09 174.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 43.2 t -67.86 -14.65 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.143 0 CA-C-N 114.405 -1.27 . . . . 0.0 113.745 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -129.2 53.29 0.81 Allowed Glycine 0 N--CA 1.481 1.67 0 C-N-CA 124.25 0.929 . . . . 0.0 111.341 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 92.31 82.19 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 128.479 2.711 . . . . 0.0 111.94 176.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 . . . . . 0 N--CA 1.488 1.427 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 176.734 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.483 1.196 0 N-CA-C 116.344 1.979 . . . . 0.0 116.344 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 64.21 -166.39 0.23 Allowed 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.327 1.451 . . . . 0.0 108.75 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? 62.67 -148.17 0.36 Allowed 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.83 -1.169 . . . . 0.0 109.778 175.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.12 -32.15 2.76 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 117.22 -1.371 . . . . 0.0 114.439 173.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.6 tptt -62.38 -31.29 71.94 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 176.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -101.37 -37.37 8.5 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 171.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.9 mt -61.6 -30.0 70.4 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-O 118.295 -0.859 . . . . 0.0 111.767 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -62.43 -40.59 97.08 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 118.313 -0.851 . . . . 0.0 112.442 172.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.519 ' O ' ' HB2' ' A' ' 13' ' ' GLU . 0.1 OUTLIER -74.61 -26.69 60.07 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 174.925 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.5 tttm -78.82 -48.99 13.7 Favored 'General case' 0 CA--C 1.557 1.24 0 O-C-N 124.156 0.91 . . . . 0.0 111.957 173.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.0 t -69.6 -50.96 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 125.49 1.516 . . . . 0.0 112.119 178.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -60.5 -34.23 73.77 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 117.214 -1.374 . . . . 0.0 109.745 175.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.519 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 34.7 tt0 -53.73 -38.25 64.16 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-O 117.47 -1.252 . . . . 0.0 110.428 172.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.5 mt -64.28 -59.11 4.79 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.784 0.434 . . . . 0.0 110.942 -178.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 15.2 mt -59.76 -51.73 68.51 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.952 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 m -54.1 -33.07 56.7 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 124.549 1.14 . . . . 0.0 113.674 175.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -77.79 -53.25 7.72 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.473 1.509 . . . . 0.0 111.895 174.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -59.69 -39.67 85.35 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.129 0.571 . . . . 0.0 111.709 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -57.39 -33.65 68.05 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.074 0.95 . . . . 0.0 112.716 170.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.602 ' HA ' HD22 ' A' ' 23' ' ' ASN . 0.9 OUTLIER -89.87 5.04 47.98 Favored 'General case' 0 CA--C 1.564 1.509 0 C-N-CA 125.917 1.687 . . . . 0.0 114.475 173.385 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 33.4 tp -108.1 -42.84 4.54 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.174 -0.954 . . . . 0.0 111.421 177.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -58.88 -32.77 69.78 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 175.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.602 HD22 ' HA ' ' A' ' 20' ' ' HIS . 3.7 p30 -64.78 -40.88 95.97 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.7 177.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -72.21 -49.6 34.04 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-O 116.342 -1.789 . . . . 0.0 110.361 -175.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.6 t -43.55 -40.95 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 124.399 1.062 . . . . 0.0 112.131 169.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.54 -64.56 0.84 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.821 0.849 . . . . 0.0 112.818 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.4 mtm105 -54.35 -27.44 36.15 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 174.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.3 tp -65.05 -60.31 3.17 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.148 1.779 . . . . 0.0 110.695 170.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . 0.3 0.1 OUTLIER -62.95 -19.13 63.98 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 178.698 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.39 -33.09 58.58 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.01 0.524 . . . . 0.0 111.354 173.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.2 mt -80.76 -35.26 33.52 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.916 1.286 . . . . 0.0 110.182 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.4 t -58.72 -26.32 31.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 C-N-CA 124.833 1.253 . . . . 0.0 112.219 177.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.1 -36.54 61.52 Favored Glycine 0 CA--C 1.552 2.364 0 C-N-CA 124.788 1.185 . . . . 0.0 112.895 174.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -142.83 32.03 1.42 Allowed 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 178.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 115.918 -1.991 . . . . 0.0 113.92 -175.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.42 HD12 ' H ' ' A' ' 3' ' ' ARG . 1.5 pp . . . . . 0 N--CA 1.483 1.19 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -157.76 46.6 0.37 Allowed 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.42 ' H ' HD12 ' A' ' 1' ' ' LEU . 1.6 ttt85 -129.15 136.65 50.46 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 113.765 -1.561 . . . . 0.0 108.822 179.255 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.7 tpp 72.45 -14.42 0.56 Allowed 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 126.017 1.727 . . . . 0.0 114.927 -177.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.406 ' H ' ' C ' ' A' ' 3' ' ' ARG . 46.6 mtpt -94.37 -21.47 18.94 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.472 1.909 . . . . 0.0 113.876 178.358 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -111.84 -22.42 11.12 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 118.177 -0.916 . . . . 0.0 113.106 169.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.4 mt -56.37 -44.98 80.69 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 117.532 -1.223 . . . . 0.0 112.534 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.18 -28.69 64.42 Favored 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 174.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.59 -27.03 55.66 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.507 1.123 . . . . 0.0 111.735 177.565 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.486 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -94.8 -26.93 16.02 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.859 0.864 . . . . 0.0 112.823 176.409 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 37.4 t -71.62 -40.57 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.119 0.968 . . . . 0.0 109.971 173.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -64.78 -48.32 74.93 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 118.028 -0.986 . . . . 0.0 112.391 177.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -47.85 -36.64 12.35 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 124.818 1.324 . . . . 0.0 111.847 177.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 10' ' ' LYS . 57.2 mt -63.45 -61.57 2.25 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 117.356 -1.307 . . . . 0.0 109.952 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.3 mt -54.44 -49.66 69.49 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.966 0.906 . . . . 0.0 112.189 178.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.7 m -45.43 -39.31 6.93 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 124.837 1.255 . . . . 0.0 112.464 174.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -87.62 -47.8 8.4 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 113.898 -1.501 . . . . 0.0 114.138 177.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -53.52 -33.36 54.21 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.458 1.503 . . . . 0.0 112.427 175.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -64.08 -48.43 76.24 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 125.118 1.367 . . . . 0.0 112.618 171.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.06 -18.52 61.93 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 175.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 20.5 tp -69.01 -44.41 72.84 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.097 1.359 . . . . 0.0 111.832 179.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -57.21 -31.15 65.19 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.432 1.083 . . . . 0.0 112.743 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -64.65 -48.64 74.08 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.811 172.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -61.68 -57.87 10.29 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 116.842 -1.551 . . . . 0.0 112.059 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 82.0 t -42.47 -38.61 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 125.628 1.571 . . . . 0.0 112.791 173.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.28 -66.53 0.55 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.767 0.827 . . . . 0.0 112.76 174.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -51.82 -37.6 52.4 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.119 0.967 . . . . 0.0 112.581 175.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.452 ' HA ' HD23 ' A' ' 31' ' ' LEU . 14.6 tp -57.51 -59.01 5.81 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 126.518 1.927 . . . . 0.0 112.286 171.287 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -61.23 -21.75 64.15 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.2 mtpt -84.91 -27.88 26.3 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 172.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -88.31 -19.33 26.85 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.233 1.413 . . . . 0.0 113.673 173.923 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -64.94 -27.29 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 C-N-CA 126.394 1.878 . . . . 0.0 112.082 174.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -44.92 -39.77 6.52 Favored Glycine 0 CA--C 1.539 1.538 0 O-C-N 124.472 1.107 . . . . 0.0 111.96 175.227 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -122.38 -107.92 0.35 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 174.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.257 1.495 0 C-N-CA 128.58 2.752 . . . . 0.0 113.275 -175.079 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 123.7 1.714 . . . . 0.0 115.506 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -83.76 53.7 2.64 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 113.225 -1.807 . . . . 0.0 110.992 -179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.41 132.4 8.81 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 113.21 -1.813 . . . . 0.0 108.428 -178.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.3 tpp 74.83 -21.36 0.3 Allowed 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 -178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.52 -37.8 27.26 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 115.16 -0.927 . . . . 0.0 112.029 176.155 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.4 ' H ' ' NE2' ' A' ' 6' ' ' GLN . 0.0 OUTLIER -93.31 -26.8 17.14 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.776 174.225 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 70.8 mt -54.39 -42.33 70.29 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.61 177.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -63.87 -38.45 91.13 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 172.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -79.05 -16.09 57.31 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.804 0.842 . . . . 0.0 112.701 -179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.89 -32.63 10.9 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.185 0.994 . . . . 0.0 112.504 176.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 48.8 t -70.05 -45.14 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 125.237 1.415 . . . . 0.0 110.388 174.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -68.23 -34.46 76.29 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -61.44 -20.63 63.33 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.662 1.226 . . . . 0.0 112.889 174.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.8 mt -69.31 -59.62 2.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.477 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.6 mt -59.12 -49.59 77.29 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.539 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p -53.75 -33.53 56.06 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.4 ttpp -76.94 -58.69 3.14 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 171.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.469 ' O ' ' HB3' ' A' ' 21' ' ' LEU . 1.3 t-20 -51.76 -30.51 23.07 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.435 1.094 . . . . 0.0 112.827 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.501 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 2.6 m-30 -70.57 -44.9 66.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.207 1.403 . . . . 0.0 113.048 172.198 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.99 -18.64 61.97 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.659 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 24.3 tp -66.01 -47.45 74.42 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.283 1.433 . . . . 0.0 111.571 178.381 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 23.3 pt-20 -60.53 -25.96 66.52 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 175.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -82.08 -47.52 12.48 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.309 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.659 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 9.1 pt-20 -63.72 -46.58 84.74 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 117.82 -1.086 . . . . 0.0 112.511 176.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.455 ' HA ' HD23 ' A' ' 28' ' ' LEU . 68.7 t -50.94 -34.71 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 126.062 1.745 . . . . 0.0 111.489 175.414 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.38 -71.52 0.15 Allowed 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.284 173.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -49.88 -36.43 27.19 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 176.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.2 tp -56.14 -62.54 1.64 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.53 1.532 . . . . 0.0 112.567 171.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -22.45 66.97 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 178.38 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.52 -19.79 62.5 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 171.799 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.54 -19.86 65.14 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 170.176 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 54.9 t -88.45 7.8 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 C-N-CA 124.386 1.074 . . . . 0.0 111.579 173.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -95.52 -47.79 2.48 Favored Glycine 0 N--CA 1.486 1.992 0 N-CA-C 111.54 -0.624 . . . . 0.0 111.54 176.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -168.5 60.49 0.06 Allowed 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.869 1.268 . . . . 0.0 113.009 -175.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 42.5 ttt85 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.613 -1.184 . . . . 0.0 113.119 -179.176 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.554 1.116 0 N-CA-C 111.345 0.128 . . . . 0.0 111.345 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -76.29 -23.25 54.37 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.858 1.263 . . . . 0.0 113.773 173.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.3 tp -71.76 -46.57 58.04 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.245 1.818 . . . . 0.0 111.073 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -56.18 -34.57 66.35 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 123.78 0.675 . . . . 0.0 110.936 173.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.35 -42.13 90.81 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.088 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -65.36 -52.44 53.64 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 124.607 1.192 . . . . 0.0 111.813 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.7 t -45.05 -40.53 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 124.714 1.205 . . . . 0.0 111.975 173.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.71 -61.38 2.0 Allowed 'General case' 0 CA--C 1.549 0.937 0 O-C-N 123.907 0.754 . . . . 0.0 112.147 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 22.3 mtp85 -52.83 -37.95 60.7 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 174.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.7 tp -61.84 -57.95 9.83 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.617 1.967 . . . . 0.0 112.763 173.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -61.95 -32.43 72.85 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.135 0.574 . . . . 0.0 111.454 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.49 ' HG3' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.87 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 172.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 . . . . . 0 N--CA 1.483 1.182 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -73.24 -31.32 64.06 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.343 1.457 . . . . 0.0 112.963 173.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.715 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 21.9 tp -68.24 -45.23 73.78 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.918 1.687 . . . . 0.0 111.138 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.39 -24.8 57.61 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 173.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.49 -49.61 8.48 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 115.238 -0.892 . . . . 0.0 113.04 173.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.715 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 9.7 pt-20 -59.87 -44.25 94.29 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.041 176.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.464 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.8 t -50.47 -35.18 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 126.094 1.758 . . . . 0.0 111.301 174.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.9 -62.7 1.35 Allowed 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.862 175.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -56.97 -27.27 61.2 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 174.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' A' ' 25' ' ' VAL . 8.4 tp -72.8 -56.87 4.6 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.085 1.754 . . . . 0.0 113.103 171.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -60.9 -25.06 66.45 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.099 0.96 . . . . 0.0 111.702 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 tttm . . . . . 0 N--CA 1.479 0.984 0 C-N-CA 125.649 1.58 . . . . 0.0 113.38 166.713 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 . . . . . 0 N--CA 1.485 1.324 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.505 ' O ' ' HB2' ' A' ' 23' ' ' ASN . 5.9 t60 -71.1 -30.8 66.99 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.02 0.928 . . . . 0.0 113.488 173.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.1 tp -67.63 -49.61 62.1 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.077 1.751 . . . . 0.0 111.543 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -59.4 -29.41 67.71 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.453 175.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' A' ' 20' ' ' HIS . 10.8 m120 -60.18 -47.62 85.18 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.907 0.883 . . . . 0.0 112.075 172.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.95 -62.86 1.55 Allowed 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.447 1.092 . . . . 0.0 111.289 174.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.436 ' HA ' HD23 ' A' ' 28' ' ' LEU . 24.5 t -42.09 -36.66 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 125.119 1.368 . . . . 0.0 111.708 177.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.64 -71.98 0.17 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.624 1.17 . . . . 0.0 113.703 173.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.85 -34.17 26.82 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 176.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.8 tp -60.37 -60.78 3.26 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 126.711 2.004 . . . . 0.0 111.309 172.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -62.11 -28.5 69.67 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.1 mttt . . . . . 0 N--CA 1.483 1.191 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 170.437 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -74.91 -18.55 60.39 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 122.008 0.909 . . . . 0.0 113.351 175.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.717 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 27.8 tp -66.85 -45.39 78.33 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.887 1.275 . . . . 0.0 111.274 178.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -61.72 -24.17 66.62 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -81.79 -50.71 8.93 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.545 171.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.717 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 9.5 pt-20 -61.65 -44.14 97.54 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 123.983 0.802 . . . . 0.0 112.895 177.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.433 ' HA ' HD23 ' A' ' 28' ' ' LEU . 59.7 t -50.87 -34.39 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.54 1.136 . . . . 0.0 111.932 173.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.05 -62.38 1.59 Allowed 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.453 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.51 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -54.25 -34.05 59.87 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 174.493 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.433 HD23 ' HA ' ' A' ' 25' ' ' VAL . 10.5 tp -68.6 -54.95 13.3 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.267 1.827 . . . . 0.0 112.59 176.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -63.0 -27.79 69.66 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.302 0.641 . . . . 0.0 111.58 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 27' ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.554 1.12 0 C-N-CA 124.448 1.099 . . . . 0.0 113.678 169.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.484 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 16.9 m-85 . . . . . 0 CA--C 1.546 0.807 0 CA-C-O 119.318 -0.372 . . . . 0.0 111.384 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.36 -15.09 63.24 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 175.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -65.47 -35.79 81.95 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.012 0.925 . . . . 0.0 112.405 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 12.6 pt-20 -60.34 -27.41 67.34 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -55.33 -30.77 60.91 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.98 0.912 . . . . 0.0 111.392 175.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -73.83 -60.58 2.19 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.4 1.48 . . . . 0.0 109.303 -178.393 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.473 ' HA ' HD23 ' A' ' 28' ' ' LEU . 78.3 t -41.58 -39.5 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 124.369 1.068 . . . . 0.0 112.276 173.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.49 -66.53 0.53 Allowed 'General case' 0 CA--C 1.549 0.912 0 O-C-N 123.902 0.751 . . . . 0.0 112.887 175.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.533 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 0.1 OUTLIER -52.3 -36.83 54.11 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 124.095 0.958 . . . . 0.0 113.424 176.625 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 25' ' ' VAL . 8.9 tp -64.09 -53.74 44.88 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.375 2.27 . . . . 0.0 112.431 175.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.67 -26.08 67.8 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 123.695 0.622 . . . . 0.0 111.153 177.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 171.747 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 t80 . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 121.12 0.486 . . . . 0.0 110.01 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.582 ' HA ' HD22 ' A' ' 23' ' ' ASN . 7.7 t60 -86.31 7.01 27.18 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 126.242 1.817 . . . . 0.0 113.34 172.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 tp -111.82 -42.29 3.84 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 120.592 -1.317 . . . . 0.0 110.934 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -29.8 68.09 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.969 172.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.582 HD22 ' HA ' ' A' ' 20' ' ' HIS . 2.1 p30 -66.42 -43.76 84.83 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 120.966 0.412 . . . . 0.0 111.675 174.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.407 ' O ' ' HB3' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -67.65 -52.75 34.45 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 117.939 -1.029 . . . . 0.0 111.812 -178.912 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.426 ' HA ' HD23 ' A' ' 28' ' ' LEU . 98.9 t -43.09 -41.21 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 O-C-N 124.748 1.28 . . . . 0.0 111.376 170.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.42 -67.64 0.43 Allowed 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 117.414 -1.279 . . . . 0.0 112.302 174.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.8 mtm-85 -51.71 -35.57 43.45 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 177.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 25' ' ' VAL . 6.4 tp -63.15 -60.32 3.58 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.889 2.075 . . . . 0.0 112.0 172.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -64.61 -19.58 65.77 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 119.019 -0.515 . . . . 0.0 112.359 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.9 mmtp . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 169.488 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 120.72 0.295 . . . . 0.0 111.337 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -68.4 -29.45 68.14 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.907 1.283 . . . . 0.0 112.31 171.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.77 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 14.1 tp -67.67 -46.52 72.13 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.545 1.938 . . . . 0.0 110.92 179.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -60.47 -24.3 65.15 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.949 0.781 . . . . 0.0 112.436 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -80.08 -56.9 3.91 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.103 0.961 . . . . 0.0 111.904 169.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.77 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 12.9 pt-20 -56.37 -44.33 80.05 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-O 118.371 -0.824 . . . . 0.0 112.796 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.536 ' HA ' HD23 ' A' ' 28' ' ' LEU . 38.4 t -49.82 -36.58 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 126.946 2.099 . . . . 0.0 111.63 173.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.31 -66.05 0.59 Allowed 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.736 175.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -51.19 -41.56 60.3 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.257 0.623 . . . . 0.0 111.843 175.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.536 HD23 ' HA ' ' A' ' 25' ' ' VAL . 10.2 tp -56.06 -64.07 0.98 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.345 1.858 . . . . 0.0 112.044 173.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -65.06 -18.0 64.93 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.3 mmtp . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 123.969 0.908 . . . . 0.0 113.15 170.423 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.5 t80 . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 110.753 -0.092 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -72.38 -29.48 63.81 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.359 1.463 . . . . 0.0 112.968 172.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.1 tp -68.57 -43.19 77.1 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 126.305 1.842 . . . . 0.0 111.717 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -52.22 -31.47 32.24 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 124.37 1.044 . . . . 0.0 112.465 174.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.45 -46.27 77.0 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.53 0.732 . . . . 0.0 111.978 174.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -61.18 -48.39 81.76 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 174.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.1 t -46.67 -40.93 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 CA-C-O 117.301 -1.333 . . . . 0.0 109.938 171.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -62.31 -62.37 1.81 Allowed 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 116.21 -1.852 . . . . 0.0 112.057 173.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -47.38 -40.88 18.61 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 119.367 0.985 . . . . 0.0 113.296 176.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.6 tp -65.16 -60.3 3.16 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 126.992 2.117 . . . . 0.0 112.391 173.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -60.36 -28.94 68.58 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.915 1.286 . . . . 0.0 110.674 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.565 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 29.0 mmtm . . . . . 0 CA--C 1.55 0.977 0 CA-C-N 119.389 0.995 . . . . 0.0 111.707 172.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 t80 . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 120.753 0.311 . . . . 0.0 110.828 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.443 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 2.9 t60 -81.82 -9.1 59.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.185 1.394 . . . . 0.0 114.071 173.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.709 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 22.2 tp -89.54 -44.56 10.02 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 125.668 1.587 . . . . 0.0 109.756 -177.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.16 -29.06 68.42 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.127 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.443 ' OD1' ' HA ' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -80.5 -47.47 14.22 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 123.477 0.486 . . . . 0.0 111.705 172.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.709 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 21.8 pt-20 -64.51 -45.04 88.95 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.53 -0.748 . . . . 0.0 112.427 -177.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.499 ' HA ' HD23 ' A' ' 28' ' ' LEU . 62.8 t -50.65 -34.83 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.526 1.53 . . . . 0.0 111.064 172.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 23' ' ' ASN . . . -60.49 -71.98 0.12 Allowed 'General case' 0 CA--C 1.537 0.451 0 O-C-N 124.757 1.286 . . . . 0.0 111.339 171.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.552 ' H ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -53.65 -31.04 45.91 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 177.489 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.499 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.3 tp -64.47 -65.12 0.72 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 126.538 1.935 . . . . 0.0 112.768 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -22.02 65.06 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 121.919 -0.488 . . . . 0.0 111.574 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? . . . . . 0 N--CA 1.478 0.928 0 C-N-CA 124.3 1.04 . . . . 0.0 113.467 172.3 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.35 -33.93 77.13 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.36 1.064 . . . . 0.0 113.138 174.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -69.52 -46.28 66.88 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 126.451 1.9 . . . . 0.0 111.485 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -57.36 -30.64 65.03 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 174.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -64.72 -45.75 85.21 Favored 'General case' 0 N--CA 1.485 1.275 0 CA-C-N 114.406 -1.27 . . . . 0.0 111.132 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -61.51 -50.12 73.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 118.035 -0.983 . . . . 0.0 112.763 177.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.427 ' HA ' HD23 ' A' ' 28' ' ' LEU . 71.9 t -44.14 -39.55 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 C-N-CA 125.46 1.504 . . . . 0.0 112.002 171.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.455 ' O ' ' HD3' ' A' ' 30' ' ' LYS . . . -65.55 -68.3 0.38 Allowed 'General case' 0 N--CA 1.482 1.157 0 CA-C-O 118.2 -0.905 . . . . 0.0 112.073 174.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.1 ttt180 -51.01 -34.3 28.68 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 176.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 25' ' ' VAL . 11.5 tp -61.76 -57.63 11.14 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.651 1.981 . . . . 0.0 112.544 171.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -63.16 -24.34 67.84 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HD3' ' O ' ' A' ' 26' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.023 0 C-N-CA 124.607 1.163 . . . . 0.0 113.581 169.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.553 1.085 0 CA-C-O 120.608 0.242 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -76.49 -25.09 53.91 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.454 1.502 . . . . 0.0 112.77 173.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.7 tp -72.88 -48.16 39.79 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.91 1.684 . . . . 0.0 111.506 -178.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.14 -30.73 62.55 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 123.666 0.604 . . . . 0.0 111.436 175.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.8 -41.77 91.53 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.801 174.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.408 ' HA ' ' HG2' ' A' ' 27' ' ' ARG . 1.2 mm-40 -61.5 -52.8 63.0 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.314 1.009 . . . . 0.0 113.27 173.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.2 t -46.31 -37.78 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 C-N-CA 124.248 1.019 . . . . 0.0 112.062 173.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.13 -64.16 0.91 Allowed 'General case' 0 N--CA 1.484 1.255 0 O-C-N 123.746 0.654 . . . . 0.0 112.374 175.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.425 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 11.0 ptp85 -53.25 -31.23 42.44 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 175.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.9 tp -67.98 -55.59 12.1 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.982 1.713 . . . . 0.0 112.009 172.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -62.81 -24.27 67.67 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' A' ' 27' ' ' ARG . 32.1 tttt . . . . . 0 N--CA 1.479 0.998 0 C-N-CA 125.619 1.568 . . . . 0.0 113.415 169.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -79.09 -10.93 59.96 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 174.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -70.41 -52.69 20.52 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 125.273 1.429 . . . . 0.0 111.757 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -56.2 -28.71 59.24 Favored 'General case' 0 CA--C 1.553 1.086 0 O-C-N 124.564 1.165 . . . . 0.0 111.554 174.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.7 -46.2 90.72 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.807 176.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -50.0 75.46 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.894 0.478 . . . . 0.0 111.679 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.401 ' O ' ' HB2' ' A' ' 29' ' ' LYS . 83.7 t -43.05 -40.53 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.192 -1.931 0 O-C-N 124.882 1.364 . . . . 0.0 111.648 171.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.96 -54.83 18.08 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 117.934 -1.031 . . . . 0.0 113.208 175.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.1 -38.7 58.17 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-N 118.527 0.603 . . . . 0.0 111.851 173.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.1 tp -67.79 -55.46 12.92 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.868 1.267 . . . . 0.0 112.027 172.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 25' ' ' VAL . 1.3 tmtm? -58.39 -31.17 67.42 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 126.339 1.856 . . . . 0.0 109.937 -178.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.561 1.374 0 CA-C-N 118.99 0.814 . . . . 0.0 111.586 173.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 . . . . . 0 N--CA 1.483 1.19 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -80.1 -16.21 55.48 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 172.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.4 tp -76.76 -46.19 26.17 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.159 1.384 . . . . 0.0 112.483 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -51.02 -31.85 19.61 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 174.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -58.59 -53.75 54.85 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.599 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -60.28 -55.26 35.91 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 116.818 -1.563 . . . . 0.0 110.314 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.9 t -42.97 -40.03 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 124.837 1.255 . . . . 0.0 112.333 174.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.97 -66.0 0.61 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.958 0.903 . . . . 0.0 112.865 175.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.406 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 4.3 mmm-85 -53.19 -31.71 44.24 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 174.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.7 tp -64.67 -58.97 4.84 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.28 1.832 . . . . 0.0 111.998 170.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -62.68 -21.18 65.55 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 122.956 0.502 . . . . 0.0 112.181 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.033 0 C-N-CA 123.826 0.85 . . . . 0.0 112.766 168.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 119.022 -0.513 . . . . 0.0 110.729 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -76.87 -12.8 60.01 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 123.81 0.694 . . . . 0.0 112.854 173.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.662 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 19.9 tp -76.76 -55.89 5.09 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.943 1.697 . . . . 0.0 110.789 -176.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.15 -25.58 33.12 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 124.728 1.268 . . . . 0.0 113.201 173.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -82.2 -50.85 8.55 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 124.595 1.184 . . . . 0.0 112.04 174.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.662 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 13.1 pt-20 -61.49 -45.77 92.81 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 118.837 -0.602 . . . . 0.0 112.251 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.435 ' HA ' HD23 ' A' ' 28' ' ' LEU . 82.6 t -51.26 -34.59 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.752 1.621 . . . . 0.0 111.065 174.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.31 -68.35 0.32 Allowed 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 118.056 -0.973 . . . . 0.0 111.138 173.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.0 tpp85 -50.87 -38.85 51.85 Favored 'General case' 0 CA--C 1.559 1.322 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 174.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.3 tp -60.91 -65.39 0.7 Allowed 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.933 1.293 . . . . 0.0 111.734 174.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . 0.256 0.0 OUTLIER -65.71 -20.43 66.28 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.292 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.312 0 C-N-CA 124.808 1.243 . . . . 0.0 112.181 172.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 113.604 0.965 . . . . 0.0 113.604 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -75.61 -19.44 59.24 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 172.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.6 tp -70.77 -48.81 52.33 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.939 1.296 . . . . 0.0 112.016 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -52.59 -32.32 40.79 Favored 'General case' 0 CA--C 1.555 1.17 0 O-C-N 123.999 0.812 . . . . 0.0 112.439 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.03 -48.79 62.08 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.111 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -58.21 -54.94 41.3 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 117.373 -1.298 . . . . 0.0 112.532 175.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 78.4 t -43.87 -39.63 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 125.679 1.592 . . . . 0.0 112.228 173.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.485 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -65.53 -69.14 0.31 Allowed 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.772 175.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -48.45 -36.5 15.09 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 174.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.9 tp -59.52 -62.21 2.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 126.714 2.006 . . . . 0.0 111.46 171.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -60.28 -24.23 64.78 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 0.9 OUTLIER . . . . . 0 CA--C 1.55 0.968 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.484 173.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 . . . . . 0 N--CA 1.493 1.697 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -89.21 5.24 45.67 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 125.976 1.71 . . . . 0.0 114.433 174.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.7 tp -110.95 -50.24 2.96 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.525 0.73 . . . . 0.0 110.439 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -67.85 -24.31 65.24 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.281 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -71.79 -33.88 68.94 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 174.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -78.62 -50.41 11.54 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.987 1.315 . . . . 0.0 111.894 -178.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.42 ' HA ' HD23 ' A' ' 28' ' ' LEU . 85.7 t -46.85 -32.72 1.94 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-O 117.798 -1.096 . . . . 0.0 111.482 169.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.431 ' O ' ' HD3' ' A' ' 30' ' ' LYS . . . -58.72 -63.73 1.18 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 172.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.0 ptm180 -55.19 -29.92 58.87 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 175.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 25' ' ' VAL . 5.3 tp -68.92 -57.28 5.73 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.028 1.331 . . . . 0.0 111.665 173.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -59.98 -18.77 48.22 Favored 'General case' 0 C--O 1.216 -0.685 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 26' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 113.739 1.015 . . . . 0.0 113.739 167.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 119.028 -0.51 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -77.76 -14.57 59.56 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 175.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.6 tp -78.63 -45.08 22.36 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.807 1.643 . . . . 0.0 111.025 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.41 -29.93 64.52 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 124.646 1.216 . . . . 0.0 111.552 176.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.441 HD22 ' C ' ' A' ' 23' ' ' ASN . 0.2 OUTLIER -60.13 -49.59 77.03 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.529 0.732 . . . . 0.0 111.076 175.283 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.01 -56.04 15.46 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 117.411 -1.281 . . . . 0.0 110.887 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.498 ' HA ' HD23 ' A' ' 28' ' ' LEU . 47.9 t -42.86 -39.09 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 125.214 1.571 . . . . 0.0 111.444 174.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.443 ' O ' ' HD2' ' A' ' 30' ' ' LYS . . . -62.09 -72.76 0.12 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 117.922 -1.037 . . . . 0.0 112.782 172.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -47.92 -36.69 12.79 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.395 1.078 . . . . 0.0 112.715 177.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 25' ' ' VAL . 8.7 tp -60.99 -60.14 4.26 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.897 2.079 . . . . 0.0 113.461 172.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -62.9 -25.43 68.31 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 178.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.443 ' HD2' ' O ' ' A' ' 26' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.14 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 168.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 . . . . . 0 CA--C 1.551 0.981 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.602 ' HA ' HD22 ' A' ' 23' ' ' ASN . 6.3 t60 -89.87 5.04 47.98 Favored 'General case' 0 CA--C 1.564 1.509 0 C-N-CA 125.917 1.687 . . . . 0.0 114.475 173.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 33.4 tp -108.1 -42.84 4.54 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.174 -0.954 . . . . 0.0 111.421 177.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -58.88 -32.77 69.78 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 175.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.602 HD22 ' HA ' ' A' ' 20' ' ' HIS . 3.7 p30 -64.78 -40.88 95.97 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.7 177.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -72.21 -49.6 34.04 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-O 116.342 -1.789 . . . . 0.0 110.361 -175.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.6 t -43.55 -40.95 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 124.399 1.062 . . . . 0.0 112.131 169.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.54 -64.56 0.84 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.821 0.849 . . . . 0.0 112.818 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.4 mtm105 -54.35 -27.44 36.15 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 174.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.3 tp -65.05 -60.31 3.17 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.148 1.779 . . . . 0.0 110.695 170.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . 0.3 0.1 OUTLIER -62.95 -19.13 63.98 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 178.698 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.913 0 C-N-CA 123.01 0.524 . . . . 0.0 111.354 173.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 . . . . . 0 N--CA 1.483 1.192 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.06 -18.52 61.93 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 175.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 20.5 tp -69.01 -44.41 72.84 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.097 1.359 . . . . 0.0 111.832 179.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -57.21 -31.15 65.19 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.432 1.083 . . . . 0.0 112.743 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -64.65 -48.64 74.08 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.811 172.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -61.68 -57.87 10.29 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 116.842 -1.551 . . . . 0.0 112.059 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 82.0 t -42.47 -38.61 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 125.628 1.571 . . . . 0.0 112.791 173.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.28 -66.53 0.55 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.767 0.827 . . . . 0.0 112.76 174.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -51.82 -37.6 52.4 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.119 0.967 . . . . 0.0 112.581 175.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 14.6 tp -57.51 -59.01 5.81 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 126.518 1.927 . . . . 0.0 112.286 171.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -61.23 -21.75 64.15 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.2 mtpt . . . . . 0 N--CA 1.483 1.193 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 172.078 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.501 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 2.6 m-30 . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.99 -18.64 61.97 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.659 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 24.3 tp -66.01 -47.45 74.42 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.283 1.433 . . . . 0.0 111.571 178.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 23.3 pt-20 -60.53 -25.96 66.52 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 175.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -82.08 -47.52 12.48 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.309 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.659 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 9.1 pt-20 -63.72 -46.58 84.74 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 117.82 -1.086 . . . . 0.0 112.511 176.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.455 ' HA ' HD23 ' A' ' 28' ' ' LEU . 68.7 t -50.94 -34.71 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 126.062 1.745 . . . . 0.0 111.489 175.414 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.38 -71.52 0.15 Allowed 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.284 173.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -49.88 -36.43 27.19 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 176.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.2 tp -56.14 -62.54 1.64 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.53 1.532 . . . . 0.0 112.567 171.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -22.45 66.97 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 178.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 171.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.514 2.773 0 CA-C-O 122.142 0.972 . . . . 0.0 113.225 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.94 133.55 37.97 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.095 177.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.403 ' HG3' ' CB ' ' A' ' 8' ' ' GLU . 12.9 ttp85 60.73 79.72 0.24 Allowed 'General case' 0 N--CA 1.5 2.058 0 CA-C-O 123.935 1.826 . . . . 0.0 112.08 -171.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -108.64 -22.53 12.21 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 112.558 -2.11 . . . . 0.0 114.977 178.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 165.04 -32.16 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 129.551 3.14 . . . . 0.0 113.807 -173.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -90.98 -62.93 1.34 Allowed 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 35.1 mt -63.34 -16.5 60.6 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.174 174.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.403 ' CB ' ' HG3' ' A' ' 3' ' ' ARG . 0.1 OUTLIER -58.46 -44.68 89.35 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 117.543 -1.217 . . . . 0.0 111.942 171.027 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.7 -34.54 78.08 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 123.675 0.609 . . . . 0.0 112.065 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -72.53 -54.29 9.63 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.741 176.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.5 t -63.97 -41.44 92.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 124.571 1.148 . . . . 0.0 112.265 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -62.05 -45.68 92.49 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 118.595 -0.717 . . . . 0.0 110.865 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -52.04 -26.75 11.61 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 124.368 1.043 . . . . 0.0 113.538 174.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.3 mt -64.91 -62.72 1.39 Allowed 'General case' 0 C--O 1.21 -1.001 0 CA-C-O 116.532 -1.699 . . . . 0.0 108.781 175.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.2 mt -54.78 -46.45 74.43 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-O 117.503 -1.237 . . . . 0.0 111.767 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.3 m -45.0 -34.94 2.66 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 174.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 19.8 ttpp -100.4 -54.0 2.97 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 173.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -54.65 -47.76 73.15 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.417 1.487 . . . . 0.0 112.695 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.3 -33.96 76.65 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 124.476 1.111 . . . . 0.0 111.345 175.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -76.29 -23.25 54.37 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.858 1.263 . . . . 0.0 113.773 173.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.3 tp -71.76 -46.57 58.04 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.245 1.818 . . . . 0.0 111.073 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -56.18 -34.57 66.35 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 123.78 0.675 . . . . 0.0 110.936 173.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.35 -42.13 90.81 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.088 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -65.36 -52.44 53.64 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 124.607 1.192 . . . . 0.0 111.813 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.7 t -45.05 -40.53 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 124.714 1.205 . . . . 0.0 111.975 173.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.71 -61.38 2.0 Allowed 'General case' 0 CA--C 1.549 0.937 0 O-C-N 123.907 0.754 . . . . 0.0 112.147 175.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 22.3 mtp85 -52.83 -37.95 60.7 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 174.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.7 tp -61.84 -57.95 9.83 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.617 1.967 . . . . 0.0 112.763 173.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -61.95 -32.43 72.85 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.135 0.574 . . . . 0.0 111.454 -178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.49 ' HG3' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -75.96 -31.53 59.09 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 172.79 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.3 mt -65.2 -22.82 66.94 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.639 0.776 . . . . 0.0 112.688 174.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.4 t -86.01 5.91 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.351 173.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -112.2 -13.26 12.29 Favored Glycine 0 CA--C 1.54 1.595 0 C-N-CA 124.402 1.001 . . . . 0.0 114.029 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -173.41 87.64 0.06 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.626 1.571 . . . . 0.0 110.362 -178.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.7 ptt180 . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 116.849 -1.548 . . . . 0.0 114.266 175.896 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.9 tp . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 122.598 1.189 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 6' ' ' GLN . 15.4 mm100 -114.57 161.56 17.89 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.983 -175.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -114.9 136.84 52.67 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 114.467 -1.242 . . . . 0.0 109.923 -179.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.437 ' H ' HD12 ' A' ' 7' ' ' LEU . 0.0 OUTLIER 65.55 1.92 1.87 Allowed 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -173.144 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 tptt -119.6 -50.15 2.32 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 114.526 -1.215 . . . . 0.0 110.906 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 2' ' ' GLN . 0.5 OUTLIER -72.18 -31.8 66.25 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.754 175.712 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.437 HD12 ' H ' ' A' ' 4' ' ' MET . 38.4 mt -58.9 -39.96 83.04 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 118.256 -0.878 . . . . 0.0 112.078 173.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -66.61 -23.68 66.21 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 174.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.36 -25.04 29.45 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.692 0.797 . . . . 0.0 112.635 175.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.83 -34.59 13.09 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.9 t -59.63 -36.97 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 125.261 1.425 . . . . 0.0 111.138 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -59.38 -45.13 92.31 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 118.624 -0.703 . . . . 0.0 112.849 173.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -60.19 -34.92 74.28 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.155 0.582 . . . . 0.0 112.458 173.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.6 mt -63.55 -58.24 7.61 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 119.292 -0.385 . . . . 0.0 110.519 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.6 mt -59.39 -50.62 73.26 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.94 0.496 . . . . 0.0 111.568 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.0 m -53.26 -31.1 41.95 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 173.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -83.68 -46.92 11.77 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 173.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -45.45 93.14 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.813 0.845 . . . . 0.0 112.55 178.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -58.31 -38.24 76.7 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.204 1.001 . . . . 0.0 112.607 172.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -73.24 -31.32 64.06 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.343 1.457 . . . . 0.0 112.963 173.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.715 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 21.9 tp -68.24 -45.23 73.78 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.918 1.687 . . . . 0.0 111.138 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.39 -24.8 57.61 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 173.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.49 -49.61 8.48 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 115.238 -0.892 . . . . 0.0 113.04 173.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.715 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 9.7 pt-20 -59.87 -44.25 94.29 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 118.595 -0.717 . . . . 0.0 112.041 176.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.464 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.8 t -50.47 -35.18 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 126.094 1.758 . . . . 0.0 111.301 174.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.9 -62.7 1.35 Allowed 'General case' 0 CA--C 1.545 0.774 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.862 175.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -56.97 -27.27 61.2 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 174.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' A' ' 25' ' ' VAL . 8.4 tp -72.8 -56.87 4.6 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.085 1.754 . . . . 0.0 113.103 171.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -60.9 -25.06 66.45 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.099 0.96 . . . . 0.0 111.702 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -51.59 -36.53 45.89 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.649 1.58 . . . . 0.0 113.38 166.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.478 ' O ' ' HG2' ' A' ' 35' ' ' ARG . 3.9 mp -54.39 -40.65 68.41 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.288 1.035 . . . . 0.0 111.35 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.2 t -95.8 16.99 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.446 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.374 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.96 -28.5 2.87 Favored Glycine 0 N--CA 1.482 1.732 0 C-N-CA 125.457 1.504 . . . . 0.0 113.371 177.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.67 60.12 1.38 Allowed 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 123.323 1.535 . . . . 0.0 113.293 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 31' ' ' LEU . 7.3 mtm105 . . . . . 0 C--O 1.259 1.569 0 CA-C-N 113.938 -1.483 . . . . 0.0 112.998 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 115.815 1.783 . . . . 0.0 115.815 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 11.8 mt-30 56.29 51.81 11.06 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 123.665 1.698 . . . . 0.0 113.707 -175.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -130.33 14.52 5.58 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 113.471 -1.695 . . . . 0.0 113.639 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 35.8 mmt -77.45 5.19 9.33 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -178.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -106.18 -27.29 11.16 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.086 1.354 . . . . 0.0 113.138 174.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -100.56 -45.78 5.42 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.542 0.737 . . . . 0.0 111.966 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.444 ' O ' HG23 ' A' ' 11' ' ' VAL . 89.2 mt -60.97 -34.77 75.28 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 119.19 -0.433 . . . . 0.0 111.679 174.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.69 -37.6 68.55 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 116.956 -1.497 . . . . 0.0 112.024 174.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -56.41 -33.46 65.81 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.227 1.011 . . . . 0.0 112.128 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -89.27 -49.7 6.57 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.8 1.24 . . . . 0.0 111.408 177.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 7' ' ' LEU . 21.7 t -57.42 -42.23 80.25 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 124.41 1.084 . . . . 0.0 112.835 177.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -68.26 -39.64 82.16 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.576 1.15 . . . . 0.0 111.194 174.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.67 -31.2 71.31 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-O 117.793 -1.099 . . . . 0.0 110.209 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 mt -61.79 -58.62 7.29 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 119.206 -0.425 . . . . 0.0 110.476 177.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.6 mt -59.04 -52.0 67.65 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 118.748 -0.644 . . . . 0.0 111.859 177.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -49.89 -33.79 18.27 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 172.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 40.6 mttm -83.12 -47.27 11.81 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 174.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.47 -44.82 95.49 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.703 0.801 . . . . 0.0 111.743 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -58.32 -39.64 79.95 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.729 0.811 . . . . 0.0 112.325 171.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.505 ' O ' ' HB2' ' A' ' 23' ' ' ASN . 5.9 t60 -71.1 -30.8 66.99 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.02 0.928 . . . . 0.0 113.488 173.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.1 tp -67.63 -49.61 62.1 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.077 1.751 . . . . 0.0 111.543 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -59.4 -29.41 67.71 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.453 175.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' A' ' 20' ' ' HIS . 10.8 m120 -60.18 -47.62 85.18 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.907 0.883 . . . . 0.0 112.075 172.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.95 -62.86 1.55 Allowed 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.447 1.092 . . . . 0.0 111.289 174.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.436 ' HA ' HD23 ' A' ' 28' ' ' LEU . 24.5 t -42.09 -36.66 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 125.119 1.368 . . . . 0.0 111.708 177.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.64 -71.98 0.17 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.624 1.17 . . . . 0.0 113.703 173.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.85 -34.17 26.82 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 176.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.8 tp -60.37 -60.78 3.26 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 126.711 2.004 . . . . 0.0 111.309 172.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -62.11 -28.5 69.67 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -72.08 -29.07 63.75 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 170.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.0 5.6 48.62 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.589 0.756 . . . . 0.0 112.979 174.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 70.9 t -124.5 4.51 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 124.762 1.225 . . . . 0.0 111.801 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.39 -14.89 8.61 Favored Glycine 0 N--CA 1.483 1.796 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.616 177.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -175.74 81.69 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 125.952 1.701 . . . . 0.0 112.175 -174.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 116.519 -1.705 . . . . 0.0 115.268 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 29.0 tp . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 119.471 -0.3 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.499 ' HB3' ' HG2' ' A' ' 6' ' ' GLN . 0.0 OUTLIER 46.69 -164.81 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 O-C-N 124.971 1.42 . . . . 0.0 111.157 -174.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.489 ' HB3' ' H ' ' A' ' 4' ' ' MET . 5.0 mtm105 -146.49 -145.75 0.18 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.979 0.511 . . . . 0.0 110.961 -176.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.489 ' H ' ' HB3' ' A' ' 3' ' ' ARG . 37.8 mmt -40.88 -28.03 0.07 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.748 1.619 . . . . 0.0 113.13 168.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -62.06 -49.45 75.92 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 175.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.499 ' HG2' ' HB3' ' A' ' 2' ' ' GLN . 10.5 pt20 -80.95 -42.82 20.67 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.907 -0.496 . . . . 0.0 111.67 173.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.411 ' N ' ' HG3' ' A' ' 6' ' ' GLN . 43.5 mt -64.39 -16.96 63.28 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 124.815 1.246 . . . . 0.0 111.485 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.63 -49.56 76.05 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 116.213 -1.851 . . . . 0.0 109.747 170.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -59.83 -35.2 74.23 Favored 'General case' 0 CA--C 1.553 1.076 0 O-C-N 124.112 0.883 . . . . 0.0 111.652 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -72.72 -53.24 12.21 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 175.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.5 t -65.87 -47.18 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 125.462 1.505 . . . . 0.0 112.432 178.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -62.75 -29.93 71.06 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.018 0.527 . . . . 0.0 111.425 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.55 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 2.1 mt-10 -58.91 -23.42 61.22 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 123.898 0.749 . . . . 0.0 112.453 172.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 37.5 mt -74.39 -60.93 2.05 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 117.445 -1.264 . . . . 0.0 109.362 173.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.1 mt -53.09 -44.13 67.34 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.386 0.994 . . . . 0.0 113.07 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 64.1 m -47.41 -41.4 20.01 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 173.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 5.8 ptmm? -92.97 -38.84 11.46 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 114.511 1.301 . . . . 0.0 114.511 175.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.63 -32.83 63.49 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 120.554 -1.341 . . . . 0.0 112.923 174.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -64.9 -46.48 81.53 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.957 1.303 . . . . 0.0 113.041 171.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -74.91 -18.55 60.39 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 122.008 0.909 . . . . 0.0 113.351 175.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.717 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 27.8 tp -66.85 -45.39 78.33 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.887 1.275 . . . . 0.0 111.274 178.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -61.72 -24.17 66.62 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -81.79 -50.71 8.93 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.545 171.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.717 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 9.5 pt-20 -61.65 -44.14 97.54 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 123.983 0.802 . . . . 0.0 112.895 177.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.433 ' HA ' HD23 ' A' ' 28' ' ' LEU . 59.7 t -50.87 -34.39 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.54 1.136 . . . . 0.0 111.932 173.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.05 -62.38 1.59 Allowed 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.453 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.51 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -54.25 -34.05 59.87 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 174.493 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.433 HD23 ' HA ' ' A' ' 25' ' ' VAL . 10.5 tp -68.6 -54.95 13.3 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.267 1.827 . . . . 0.0 112.59 176.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -63.0 -27.79 69.66 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.302 0.641 . . . . 0.0 111.58 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 27' ' ' ARG . 0.8 OUTLIER -58.22 -30.18 66.3 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 124.448 1.099 . . . . 0.0 113.678 169.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.1 mt -69.49 -35.54 75.67 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.053 0.541 . . . . 0.0 111.227 176.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.7 t -89.02 15.86 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.565 1.542 0 C-N-CA 124.239 1.016 . . . . 0.0 110.848 175.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.88 -49.97 1.31 Allowed Glycine 0 CA--C 1.537 1.433 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.224 177.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -177.68 81.68 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 125.282 1.433 . . . . 0.0 112.095 -177.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.145 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.125 178.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.439 ' C ' HE21 ' A' ' 2' ' ' GLN . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.154 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.439 HE21 ' C ' ' A' ' 1' ' ' LEU . 0.5 OUTLIER 60.25 114.25 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 125.176 1.39 . . . . 0.0 111.117 178.212 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.8 mtm180 -85.95 15.16 5.19 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.446 ' HE2' HD12 ' A' ' 7' ' ' LEU . 35.4 mmt -80.17 8.99 6.17 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 113.61 -1.632 . . . . 0.0 113.253 -178.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -111.52 -30.7 7.27 Favored 'General case' 0 CA--C 1.554 1.124 0 O-C-N 124.586 1.179 . . . . 0.0 112.061 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -95.68 -47.06 6.36 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 114.968 -1.015 . . . . 0.0 112.975 175.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.446 HD12 ' HE2' ' A' ' 4' ' ' MET . 95.3 mt -60.67 -32.72 71.91 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.805 175.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -55.11 -41.72 72.03 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-O 116.996 -1.478 . . . . 0.0 113.366 170.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -68.41 -33.51 74.35 Favored 'General case' 0 CA--C 1.557 1.215 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 176.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.559 ' O ' ' HG3' ' A' ' 13' ' ' GLU . 15.2 tttm -70.88 -49.87 41.21 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.694 1.198 . . . . 0.0 112.293 174.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.0 t -69.87 -31.03 46.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.137 0.975 . . . . 0.0 112.031 177.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -55.83 -53.16 60.09 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-O 117.755 -1.117 . . . . 0.0 111.495 175.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 1.2 pp20? -60.98 -24.57 66.21 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 125.154 1.534 . . . . 0.0 113.18 176.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.4 mt -75.43 -62.19 1.65 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 117.117 -1.421 . . . . 0.0 109.553 173.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 19.0 mt -55.28 -48.28 74.28 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 118.138 -0.934 . . . . 0.0 112.602 -178.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.1 p -48.44 -36.2 14.44 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.445 1.098 . . . . 0.0 112.462 175.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.2 mtmp? -90.24 -45.97 8.72 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.753 1.221 . . . . 0.0 113.717 176.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.448 ' O ' ' HB3' ' A' ' 21' ' ' LEU . 0.2 OUTLIER -54.64 -32.43 59.02 Favored 'General case' 0 CA--C 1.553 1.093 0 O-C-N 120.608 -1.308 . . . . 0.0 112.333 174.713 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.484 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 16.9 m-85 -65.08 -51.13 63.16 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.064 1.345 . . . . 0.0 111.384 171.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.36 -15.09 63.24 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 175.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.448 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 19.4 tp -65.47 -35.79 81.95 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.012 0.925 . . . . 0.0 112.405 176.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 12.6 pt-20 -60.34 -27.41 67.34 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -55.33 -30.77 60.91 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.98 0.912 . . . . 0.0 111.392 175.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -73.83 -60.58 2.19 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.4 1.48 . . . . 0.0 109.303 -178.393 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.473 ' HA ' HD23 ' A' ' 28' ' ' LEU . 78.3 t -41.58 -39.5 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 124.369 1.068 . . . . 0.0 112.276 173.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.49 -66.53 0.53 Allowed 'General case' 0 CA--C 1.549 0.912 0 O-C-N 123.902 0.751 . . . . 0.0 112.887 175.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.533 ' HG2' ' O ' ' A' ' 24' ' ' GLU . 0.1 OUTLIER -52.3 -36.83 54.11 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 124.095 0.958 . . . . 0.0 113.424 176.625 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.587 ' HA ' HD12 ' A' ' 31' ' ' LEU . 8.9 tp -64.09 -53.74 44.88 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.375 2.27 . . . . 0.0 112.431 175.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.67 -26.08 67.8 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 123.695 0.622 . . . . 0.0 111.153 177.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -76.79 -24.87 52.84 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 171.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.587 HD12 ' HA ' ' A' ' 28' ' ' LEU . 27.9 mt -71.8 -32.34 67.5 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.571 0.749 . . . . 0.0 111.295 172.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.9 t -86.27 13.55 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.051 0.541 . . . . 0.0 111.704 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -94.3 -42.54 3.96 Favored Glycine 0 CA--C 1.539 1.581 0 C-N-CA 124.991 1.282 . . . . 0.0 112.557 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -143.68 17.66 1.82 Allowed 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 114.8 1.408 . . . . 0.0 114.8 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 116.06 -1.924 . . . . 0.0 112.785 -178.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 122.201 1.0 . . . . 0.0 113.101 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -162.39 173.45 14.09 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 113.652 -1.613 . . . . 0.0 111.347 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 26.2 mtt85 -89.9 12.66 16.71 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 113.969 -1.469 . . . . 0.0 114.333 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.25 -11.73 59.85 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 178.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.88 -25.49 26.16 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.733 0.813 . . . . 0.0 112.014 173.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.44 -39.37 7.99 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.329 0.652 . . . . 0.0 111.871 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.4 mt -62.73 -47.08 85.12 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 117.622 -1.18 . . . . 0.0 110.328 177.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.08 -29.61 70.5 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 174.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -72.51 -37.88 68.25 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.332 0.653 . . . . 0.0 112.309 174.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.4 -30.61 23.46 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 79.3 t -70.63 -37.55 69.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 125.155 1.382 . . . . 0.0 111.055 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.8 -39.47 91.85 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.491 0.923 . . . . 0.0 113.491 174.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.38 -28.02 67.88 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 115.355 -0.839 . . . . 0.0 112.621 173.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.9 mt -65.55 -62.15 1.69 Allowed 'General case' 0 C--O 1.205 -1.253 0 CA-C-O 117.806 -1.092 . . . . 0.0 109.083 176.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.4 mt -55.86 -47.06 78.0 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 117.942 -1.027 . . . . 0.0 111.829 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.5 m -45.52 -34.49 3.3 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -95.91 -58.87 1.98 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.709 1.204 . . . . 0.0 112.003 172.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.425 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 0.2 OUTLIER -56.74 -46.12 81.55 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.935 2.094 . . . . 0.0 114.175 -176.555 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -62.86 -34.98 78.49 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.801 1.241 . . . . 0.0 110.01 173.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.582 ' HA ' HD22 ' A' ' 23' ' ' ASN . 7.7 t60 -86.31 7.01 27.18 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 126.242 1.817 . . . . 0.0 113.34 172.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.425 ' HB3' ' HA ' ' A' ' 18' ' ' ASN . 28.8 tp -111.82 -42.29 3.84 Favored 'General case' 0 C--N 1.316 -0.88 0 O-C-N 120.592 -1.317 . . . . 0.0 110.934 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -29.8 68.09 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.969 172.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.582 HD22 ' HA ' ' A' ' 20' ' ' HIS . 2.1 p30 -66.42 -43.76 84.83 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 120.966 0.412 . . . . 0.0 111.675 174.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.407 ' O ' ' HB3' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -67.65 -52.75 34.45 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 117.939 -1.029 . . . . 0.0 111.812 -178.912 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.426 ' HA ' HD23 ' A' ' 28' ' ' LEU . 98.9 t -43.09 -41.21 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 O-C-N 124.748 1.28 . . . . 0.0 111.376 170.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.42 -67.64 0.43 Allowed 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 117.414 -1.279 . . . . 0.0 112.302 174.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.8 mtm-85 -51.71 -35.57 43.45 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 177.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 25' ' ' VAL . 6.4 tp -63.15 -60.32 3.58 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.889 2.075 . . . . 0.0 112.0 172.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -64.61 -19.58 65.77 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 119.019 -0.515 . . . . 0.0 112.359 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.9 mmtp -65.08 -20.26 66.39 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 169.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.4 mt -94.58 -26.06 16.54 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.173 0.989 . . . . 0.0 111.22 176.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.3 t -104.54 17.89 5.09 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 C-N-CA 124.925 1.29 . . . . 0.0 111.53 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.85 -39.15 0.72 Allowed Glycine 0 N--CA 1.479 1.55 0 C-N-CA 124.661 1.125 . . . . 0.0 112.012 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -107.46 34.59 3.44 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.652 0.781 . . . . 0.0 111.023 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 . . . . . 0 C--O 1.259 1.587 0 N-CA-C 114.332 1.234 . . . . 0.0 114.332 -178.774 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 37.73 41.27 0.31 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 125.129 1.372 . . . . 0.0 113.843 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.4 mpp_? -80.15 48.97 1.05 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.668 -175.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 34.5 mmt -62.08 -14.84 40.3 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.417 1.487 . . . . 0.0 112.581 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.18 -55.1 5.72 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.08 1.352 . . . . 0.0 111.364 168.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -79.63 -49.49 12.07 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 125.825 1.65 . . . . 0.0 113.937 -178.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.656 HD23 ' HE2' ' A' ' 10' ' ' LYS . 73.8 mt -52.11 -30.84 28.12 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.483 1.113 . . . . 0.0 110.823 174.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -65.97 -22.5 66.48 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 172.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.75 -38.7 70.37 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.193 0.997 . . . . 0.0 110.186 176.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.656 ' HE2' HD23 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -89.59 -23.26 22.0 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 174.591 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 7' ' ' LEU . 19.8 t -48.91 -41.22 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 172.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -71.22 -42.12 69.33 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.77 176.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -60.57 -20.49 60.59 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 65.3 mt -66.62 -62.54 1.4 Allowed 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 118.017 -0.992 . . . . 0.0 108.68 175.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.0 mt -55.95 -44.77 78.75 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-O 117.351 -1.309 . . . . 0.0 111.729 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.7 p -50.87 -27.72 8.05 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -103.08 -53.02 2.91 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.024 1.73 . . . . 0.0 112.554 175.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.493 ' O ' ' HB3' ' A' ' 21' ' ' LEU . 7.3 t-20 -60.15 -44.85 94.64 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.618 1.967 . . . . 0.0 114.085 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -65.91 -38.31 88.39 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.923 1.289 . . . . 0.0 111.337 174.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -68.4 -29.45 68.14 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.907 1.283 . . . . 0.0 112.31 171.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.77 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 14.1 tp -67.67 -46.52 72.13 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.545 1.938 . . . . 0.0 110.92 179.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -60.47 -24.3 65.15 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.949 0.781 . . . . 0.0 112.436 175.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -80.08 -56.9 3.91 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.103 0.961 . . . . 0.0 111.904 169.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.77 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 12.9 pt-20 -56.37 -44.33 80.05 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-O 118.371 -0.824 . . . . 0.0 112.796 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.536 ' HA ' HD23 ' A' ' 28' ' ' LEU . 38.4 t -49.82 -36.58 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 126.946 2.099 . . . . 0.0 111.63 173.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.31 -66.05 0.59 Allowed 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.736 175.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -51.19 -41.56 60.3 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.257 0.623 . . . . 0.0 111.843 175.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.536 HD23 ' HA ' ' A' ' 25' ' ' VAL . 10.2 tp -56.06 -64.07 0.98 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.345 1.858 . . . . 0.0 112.044 173.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -65.06 -18.0 64.93 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.3 mmtp -77.32 -30.02 53.83 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.969 0.908 . . . . 0.0 113.15 170.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.631 HD12 HG23 ' A' ' 32' ' ' VAL . 4.1 pp -100.36 -0.7 37.76 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.382 1.623 . . . . 0.0 115.382 174.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.631 HG23 HD12 ' A' ' 31' ' ' LEU . 70.4 t -124.97 4.13 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 125.441 1.496 . . . . 0.0 111.765 179.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.43 -41.61 2.17 Favored Glycine 0 N--CA 1.479 1.558 0 C-N-CA 124.035 0.826 . . . . 0.0 111.937 177.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -174.95 70.96 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 125.265 1.426 . . . . 0.0 113.53 -175.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 . . . . . 0 C--O 1.254 1.308 0 CA-C-O 117.393 -1.289 . . . . 0.0 113.732 175.611 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.511 2.591 0 CA-C-O 122.508 1.147 . . . . 0.0 113.26 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -113.41 88.29 2.8 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 123.525 1.631 . . . . 0.0 110.941 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -133.31 150.42 51.88 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 111.911 -2.404 . . . . 0.0 109.874 177.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 31.3 mmt 64.92 6.51 3.43 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 114.174 -1.376 . . . . 0.0 114.563 -177.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -108.57 -42.11 4.63 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.545 1.138 . . . . 0.0 113.529 173.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -92.3 -34.64 14.14 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 175.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.1 mt -65.49 -32.34 73.9 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.752 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.22 -34.88 73.43 Favored 'General case' 0 CA--C 1.552 1.056 0 CA-C-N 115.232 -0.895 . . . . 0.0 112.769 173.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -38.84 90.05 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.828 0.851 . . . . 0.0 112.366 175.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.53 -40.1 85.04 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.252 173.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.72 -45.27 95.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 C-N-CA 123.28 0.632 . . . . 0.0 112.337 177.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -67.43 -32.21 72.93 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.09 -20.0 63.57 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.808 0.843 . . . . 0.0 112.85 177.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.8 mt -66.95 -63.96 0.95 Allowed 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 117.19 -1.386 . . . . 0.0 108.795 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.8 mt -55.22 -46.74 75.95 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 117.667 -1.158 . . . . 0.0 111.731 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 m -46.11 -31.36 2.32 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 172.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.59 -50.1 3.66 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 172.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.402 ' O ' ' HB3' ' A' ' 21' ' ' LEU . 8.2 t-20 -58.99 -46.74 87.4 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.295 1.838 . . . . 0.0 113.131 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -65.98 -34.81 78.95 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.93 1.292 . . . . 0.0 110.753 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -72.38 -29.48 63.81 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.359 1.463 . . . . 0.0 112.968 172.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.402 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 13.1 tp -68.57 -43.19 77.1 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 126.305 1.842 . . . . 0.0 111.717 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -52.22 -31.47 32.24 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 124.37 1.044 . . . . 0.0 112.465 174.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.45 -46.27 77.0 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.53 0.732 . . . . 0.0 111.978 174.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -61.18 -48.39 81.76 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 174.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.1 t -46.67 -40.93 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 CA-C-O 117.301 -1.333 . . . . 0.0 109.938 171.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -62.31 -62.37 1.81 Allowed 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 116.21 -1.852 . . . . 0.0 112.057 173.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -47.38 -40.88 18.61 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 119.367 0.985 . . . . 0.0 113.296 176.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.6 tp -65.16 -60.3 3.16 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 126.992 2.117 . . . . 0.0 112.391 173.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -60.36 -28.94 68.58 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.915 1.286 . . . . 0.0 110.674 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.565 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 29.0 mmtm -49.47 -33.62 14.8 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 119.389 0.995 . . . . 0.0 111.707 172.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.8 mp -71.74 -47.78 51.46 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.09 0.956 . . . . 0.0 113.395 173.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.4 t -89.19 17.97 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 C-N-CA 124.056 0.942 . . . . 0.0 111.278 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -121.46 -41.42 0.5 Allowed Glycine 0 CA--C 1.533 1.205 0 C-N-CA 125.297 1.427 . . . . 0.0 111.52 -176.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.98 38.4 1.08 Allowed 'General case' 0 N--CA 1.485 1.29 0 CA-C-O 122.388 1.09 . . . . 0.0 111.018 174.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.306 0 CA-C-N 114.584 -1.189 . . . . 0.0 112.022 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -61.56 96.15 0.06 Allowed 'General case' 0 N--CA 1.488 1.455 0 CA-C-O 123.109 1.433 . . . . 0.0 112.31 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.96 151.04 42.21 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 112.932 -1.94 . . . . 0.0 112.627 -178.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.67 5.74 0.99 Allowed 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 112.512 -2.131 . . . . 0.0 114.305 -168.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.07 -23.5 8.47 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 125.127 1.371 . . . . 0.0 114.182 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -110.23 -26.99 9.33 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 165.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 49.0 mt -66.46 -40.5 89.44 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 121.769 -0.582 . . . . 0.0 111.581 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -62.7 -31.25 72.12 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-O 116.545 -1.693 . . . . 0.0 111.445 173.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -40.91 86.75 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 121.034 1.743 . . . . 0.0 111.476 177.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -80.53 -45.7 17.02 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 112.794 -2.003 . . . . 0.0 110.385 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.7 t -67.05 -18.35 24.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 124.333 1.053 . . . . 0.0 113.279 175.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 63.0 tt0 -71.68 -39.4 70.26 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 125.359 1.464 . . . . 0.0 111.49 174.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -58.74 -22.32 57.52 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 125.211 1.57 . . . . 0.0 110.797 175.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.7 mt -67.15 -64.68 0.8 Allowed 'General case' 0 C--O 1.215 -0.732 0 CA-C-O 116.713 -1.613 . . . . 0.0 109.543 175.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.7 mt -54.78 -47.39 74.02 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-O 117.739 -1.124 . . . . 0.0 112.097 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 62.3 m -45.28 -33.34 2.35 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 172.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.04 -52.95 3.4 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 170.099 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -57.61 -46.37 84.17 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 126.159 1.784 . . . . 0.0 113.203 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -63.31 -34.9 78.7 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.66 1.184 . . . . 0.0 110.828 175.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.443 ' HA ' ' OD1' ' A' ' 23' ' ' ASN . 2.9 t60 -81.82 -9.1 59.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.185 1.394 . . . . 0.0 114.071 173.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.709 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 22.2 tp -89.54 -44.56 10.02 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 125.668 1.587 . . . . 0.0 109.756 -177.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.16 -29.06 68.42 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 115.059 -0.973 . . . . 0.0 112.127 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.443 ' OD1' ' HA ' ' A' ' 20' ' ' HIS . 0.1 OUTLIER -80.5 -47.47 14.22 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 123.477 0.486 . . . . 0.0 111.705 172.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.709 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 21.8 pt-20 -64.51 -45.04 88.95 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.53 -0.748 . . . . 0.0 112.427 -177.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.499 ' HA ' HD23 ' A' ' 28' ' ' LEU . 62.8 t -50.65 -34.83 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.526 1.53 . . . . 0.0 111.064 172.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 23' ' ' ASN . . . -60.49 -71.98 0.12 Allowed 'General case' 0 CA--C 1.537 0.451 0 O-C-N 124.757 1.286 . . . . 0.0 111.339 171.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.552 ' H ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -53.65 -31.04 45.91 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 177.489 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.499 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.3 tp -64.47 -65.12 0.72 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 126.538 1.935 . . . . 0.0 112.768 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -22.02 65.06 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 121.919 -0.488 . . . . 0.0 111.574 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -64.59 -16.51 62.8 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.3 1.04 . . . . 0.0 113.467 172.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 28.3 mt -73.8 -17.37 61.09 Favored 'General case' 0 C--O 1.21 -1.02 0 O-C-N 125.039 1.462 . . . . 0.0 112.953 168.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 57.4 t -93.65 8.42 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 124.112 0.965 . . . . 0.0 111.309 176.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -88.74 -28.07 22.49 Favored Glycine 0 N--CA 1.485 1.965 0 C-N-CA 124.264 0.935 . . . . 0.0 113.608 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -121.1 35.74 4.8 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.775 1.63 . . . . 0.0 112.467 -176.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 116.675 -1.631 . . . . 0.0 114.128 176.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? 68.2 95.8 0.06 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 124.851 1.344 . . . . 0.0 111.407 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.73 137.45 0.6 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 127.023 2.129 . . . . 0.0 108.709 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.4 tpp 75.34 -29.49 0.19 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 126.046 1.738 . . . . 0.0 114.812 -178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -77.94 -34.83 51.02 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 113.826 -1.534 . . . . 0.0 111.615 178.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -89.46 -36.59 15.34 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 123.12 0.262 . . . . 0.0 111.502 169.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.5 mt -53.5 -34.02 56.52 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 116.813 -1.565 . . . . 0.0 112.164 -178.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -56.29 -51.87 66.58 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.73 1.382 . . . . 0.0 114.73 170.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.59 -23.14 53.47 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 178.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.89 -32.15 31.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.545 1.538 . . . . 0.0 112.552 174.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.1 t -67.27 -45.22 86.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 125.936 1.695 . . . . 0.0 111.419 177.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -66.43 -41.9 88.5 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 123.94 0.775 . . . . 0.0 111.448 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 1.9 tt0 -59.24 -22.14 60.65 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 114.902 -1.045 . . . . 0.0 112.96 177.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.3 -59.28 5.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.193 0.597 . . . . 0.0 111.393 177.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.3 mt -58.85 -49.99 75.68 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.323 0.649 . . . . 0.0 110.564 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.8 m -50.77 -36.93 39.25 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.8 1.24 . . . . 0.0 113.511 174.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 54.0 mttm -80.61 -49.07 11.76 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.918 0.887 . . . . 0.0 113.196 174.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -58.89 -42.07 88.65 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.174 0.99 . . . . 0.0 112.772 178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -58.79 -45.15 90.54 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.999 171.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.35 -33.93 77.13 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.36 1.064 . . . . 0.0 113.138 174.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.4 tp -69.52 -46.28 66.88 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 126.451 1.9 . . . . 0.0 111.485 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -57.36 -30.64 65.03 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 174.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -64.72 -45.75 85.21 Favored 'General case' 0 N--CA 1.485 1.275 0 CA-C-N 114.406 -1.27 . . . . 0.0 111.132 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -61.51 -50.12 73.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 118.035 -0.983 . . . . 0.0 112.763 177.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.427 ' HA ' HD23 ' A' ' 28' ' ' LEU . 71.9 t -44.14 -39.55 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 C-N-CA 125.46 1.504 . . . . 0.0 112.002 171.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.455 ' O ' ' HD3' ' A' ' 30' ' ' LYS . . . -65.55 -68.3 0.38 Allowed 'General case' 0 N--CA 1.482 1.157 0 CA-C-O 118.2 -0.905 . . . . 0.0 112.073 174.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.1 ttt180 -51.01 -34.3 28.68 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 176.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 25' ' ' VAL . 11.5 tp -61.76 -57.63 11.14 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.651 1.981 . . . . 0.0 112.544 171.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -63.16 -24.34 67.84 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HD3' ' O ' ' A' ' 26' ' ' ALA . 0.2 OUTLIER -69.39 -20.7 63.81 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.607 1.163 . . . . 0.0 113.581 169.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.6 mt -67.75 -26.34 66.08 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 120.884 -1.135 . . . . 0.0 111.791 175.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 42.5 t -85.08 12.81 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 CA-C-O 122.432 1.11 . . . . 0.0 111.478 173.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.54 -21.88 12.14 Favored Glycine 0 CA--C 1.549 2.173 0 C-N-CA 125.191 1.376 . . . . 0.0 113.15 175.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -104.92 -89.2 0.42 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.972 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.139 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -112.52 85.52 2.18 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-O 122.815 1.293 . . . . 0.0 109.53 176.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.24 -9.01 9.61 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 110.141 -3.209 . . . . 0.0 114.156 175.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.4 mpp? 50.69 25.97 2.3 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.606 1.163 . . . . 0.0 113.009 -173.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.9 12.38 4.78 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 126.735 2.014 . . . . 0.0 113.864 -175.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -120.44 -45.99 2.4 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.125 1.37 . . . . 0.0 113.509 -176.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.494 ' HA ' ' HG3' ' A' ' 10' ' ' LYS . 38.4 mt -61.61 -27.96 69.03 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.884 -0.51 . . . . 0.0 111.076 171.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -68.38 -46.12 70.89 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.202 171.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.56 -36.28 80.18 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 124.4 1.063 . . . . 0.0 111.875 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.494 ' HG3' ' HA ' ' A' ' 7' ' ' LEU 0.261 0.0 OUTLIER -75.36 -28.73 59.67 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 175.045 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 7' ' ' LEU . 12.9 t -57.94 -45.42 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 123.368 0.417 . . . . 0.0 111.328 177.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 19.5 mp0 -69.07 -33.62 73.84 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 176.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -59.91 -24.42 64.3 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 124.01 0.818 . . . . 0.0 111.892 175.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.8 mt -64.85 -64.44 0.87 Allowed 'General case' 0 N--CA 1.483 1.186 0 CA-C-O 117.342 -1.313 . . . . 0.0 109.414 174.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.9 mt -55.86 -44.56 78.19 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 118.031 -0.985 . . . . 0.0 111.568 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 t -49.53 -29.53 7.01 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 174.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.0 mmtp -101.28 -52.94 3.13 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 126.101 1.76 . . . . 0.0 113.666 173.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.422 ' O ' ' HB3' ' A' ' 21' ' ' LEU . 9.9 t-20 -59.49 -46.96 87.31 Favored 'General case' 0 CA--C 1.56 1.337 0 C-N-CA 126.742 2.017 . . . . 0.0 113.828 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.73 -32.21 73.79 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.64 1.176 . . . . 0.0 111.135 174.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -76.49 -25.09 53.91 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.454 1.502 . . . . 0.0 112.77 173.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.422 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 13.7 tp -72.88 -48.16 39.79 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.91 1.684 . . . . 0.0 111.506 -178.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.14 -30.73 62.55 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 123.666 0.604 . . . . 0.0 111.436 175.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.8 -41.77 91.53 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.801 174.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.408 ' HA ' ' HG2' ' A' ' 27' ' ' ARG . 1.2 mm-40 -61.5 -52.8 63.0 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.314 1.009 . . . . 0.0 113.27 173.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.2 t -46.31 -37.78 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 C-N-CA 124.248 1.019 . . . . 0.0 112.062 173.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.13 -64.16 0.91 Allowed 'General case' 0 N--CA 1.484 1.255 0 O-C-N 123.746 0.654 . . . . 0.0 112.374 175.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.425 ' HA ' ' HD3' ' A' ' 30' ' ' LYS . 11.0 ptp85 -53.25 -31.23 42.44 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 175.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.9 tp -67.98 -55.59 12.1 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.982 1.713 . . . . 0.0 112.009 172.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -62.81 -24.27 67.67 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' A' ' 27' ' ' ARG . 32.1 tttt -60.67 -29.65 69.43 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.619 1.568 . . . . 0.0 113.415 169.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.64 -28.38 66.84 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.484 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.6 t -88.28 15.39 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 124.364 1.066 . . . . 0.0 110.326 174.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.75 -45.71 1.74 Allowed Glycine 0 CA--C 1.541 1.705 0 C-N-CA 125.13 1.347 . . . . 0.0 111.809 177.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -85.64 20.73 2.03 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.208 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.415 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.03 58.61 0.22 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 126.658 1.983 . . . . 0.0 111.543 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 179.13 72.04 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 116.1 1.889 . . . . 0.0 116.1 -170.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -98.51 -25.69 14.68 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 177.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.5 tttm 172.54 -40.48 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 126.933 2.093 . . . . 0.0 111.463 -171.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -96.55 -55.48 2.9 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 113.676 -1.602 . . . . 0.0 113.038 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 36.6 mt -69.76 -24.11 63.47 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.348 176.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -63.7 -36.15 82.9 Favored 'General case' 0 C--O 1.204 -1.34 0 CA-C-O 117.254 -1.355 . . . . 0.0 111.964 173.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -56.14 -34.83 66.48 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 123.895 0.747 . . . . 0.0 112.567 177.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -81.76 -50.01 9.74 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 114.248 -1.342 . . . . 0.0 111.277 177.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.469 HG13 HD12 ' A' ' 14' ' ' LEU . 33.9 t -65.09 -15.71 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 124.316 1.047 . . . . 0.0 112.619 176.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.32 -44.91 96.41 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.437 1.495 . . . . 0.0 110.454 175.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.18 -28.6 69.25 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 125.593 1.808 . . . . 0.0 111.355 175.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.469 HD12 HG13 ' A' ' 11' ' ' VAL . 45.4 mt -71.33 -59.73 2.61 Favored 'General case' 0 C--O 1.195 -1.767 0 CA-C-O 118.718 -0.658 . . . . 0.0 110.412 175.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 15.3 mt -57.89 -49.12 77.79 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 124.24 0.962 . . . . 0.0 112.904 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.5 p -51.18 -35.1 34.55 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.734 0.813 . . . . 0.0 112.478 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.1 tmmm? -80.06 -55.86 4.64 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 170.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.404 ' O ' ' HB3' ' A' ' 21' ' ' LEU . 1.9 t-20 -48.77 -33.5 10.45 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 125.609 1.563 . . . . 0.0 111.823 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -69.36 -44.56 71.34 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 126.034 1.734 . . . . 0.0 112.668 173.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -79.09 -10.93 59.96 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 174.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.404 ' HB3' ' O ' ' A' ' 18' ' ' ASN . 19.4 tp -70.41 -52.69 20.52 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 125.273 1.429 . . . . 0.0 111.757 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -56.2 -28.71 59.24 Favored 'General case' 0 CA--C 1.553 1.086 0 O-C-N 124.564 1.165 . . . . 0.0 111.554 174.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.7 -46.2 90.72 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.807 176.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -50.0 75.46 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.894 0.478 . . . . 0.0 111.679 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.401 ' O ' ' HB2' ' A' ' 29' ' ' LYS . 83.7 t -43.05 -40.53 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.192 -1.931 0 O-C-N 124.882 1.364 . . . . 0.0 111.648 171.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.96 -54.83 18.08 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 117.934 -1.031 . . . . 0.0 113.208 175.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.1 -38.7 58.17 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-N 118.527 0.603 . . . . 0.0 111.851 173.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.1 tp -67.79 -55.46 12.92 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.868 1.267 . . . . 0.0 112.027 172.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 25' ' ' VAL . 1.3 tmtm? -58.39 -31.17 67.42 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 126.339 1.856 . . . . 0.0 109.937 -178.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -35.39 60.19 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-N 118.99 0.814 . . . . 0.0 111.586 173.631 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.1 mp -71.27 -41.16 70.38 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.23 174.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 57.4 t -82.7 6.67 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 C-N-CA 123.877 0.871 . . . . 0.0 111.524 175.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -90.31 -42.5 5.21 Favored Glycine 0 N--CA 1.484 1.888 0 C-N-CA 125.11 1.338 . . . . 0.0 111.104 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -129.41 12.6 5.98 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.302 1.964 . . . . 0.0 116.302 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.456 ' HG3' HH11 ' A' ' 35' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.266 1.933 0 CA-C-O 116.442 -1.742 . . . . 0.0 113.489 -179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.534 HD12 HD22 ' A' ' 7' ' ' LEU . 2.1 pt? . . . . . 0 CA--C 1.552 1.024 0 CA-C-O 121.88 0.848 . . . . 0.0 112.747 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.44 ' O ' ' HB2' ' A' ' 6' ' ' GLN . 8.2 tt0 -155.92 159.83 39.62 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 114.23 -1.35 . . . . 0.0 108.908 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 89.08 119.5 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 127.113 2.165 . . . . 0.0 109.374 170.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.6 mmt -57.27 -29.64 64.02 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 113.782 1.03 . . . . 0.0 113.782 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -73.63 -12.15 60.65 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 125.7 1.875 . . . . 0.0 114.046 171.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.44 ' HB2' ' O ' ' A' ' 2' ' ' GLN . 46.5 mt-30 -113.31 -36.75 4.9 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 175.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.534 HD22 HD12 ' A' ' 1' ' ' LEU . 19.7 mt -56.8 -44.01 81.5 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 175.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -66.53 -30.48 70.8 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 114.507 -1.224 . . . . 0.0 111.743 173.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -41.4 81.41 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.466 0.706 . . . . 0.0 110.264 177.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.438 ' HE2' HD13 ' A' ' 1' ' ' LEU . 5.2 tmtm? -66.12 -42.97 88.44 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 113.925 -1.489 . . . . 0.0 110.53 174.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 58.3 t -66.53 -34.15 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 121.698 -0.626 . . . . 0.0 112.25 175.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -59.73 -36.14 75.98 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 117.707 -1.14 . . . . 0.0 111.751 178.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -53.94 -36.05 62.38 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 124.382 1.051 . . . . 0.0 111.922 173.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.7 mt -69.76 -60.12 2.51 Favored 'General case' 0 C--O 1.207 -1.161 0 CA-C-N 114.81 -1.086 . . . . 0.0 108.906 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.1 mt -55.71 -47.38 76.96 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 118.332 -0.842 . . . . 0.0 112.215 178.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.0 t -49.02 -38.25 23.07 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.752 1.221 . . . . 0.0 112.624 174.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.74 -44.74 12.27 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 172.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -55.18 -33.47 63.03 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.572 1.549 . . . . 0.0 112.288 178.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -66.22 -39.92 89.94 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 125.568 1.547 . . . . 0.0 113.648 170.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -80.1 -16.21 55.48 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 172.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.4 tp -76.76 -46.19 26.17 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.159 1.384 . . . . 0.0 112.483 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -51.02 -31.85 19.61 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 174.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -58.59 -53.75 54.85 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.599 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -60.28 -55.26 35.91 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 116.818 -1.563 . . . . 0.0 110.314 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 93.9 t -42.97 -40.03 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 124.837 1.255 . . . . 0.0 112.333 174.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.97 -66.0 0.61 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.958 0.903 . . . . 0.0 112.865 175.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.406 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 4.3 mmm-85 -53.19 -31.71 44.24 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 174.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.7 tp -64.67 -58.97 4.84 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.28 1.832 . . . . 0.0 111.998 170.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -62.68 -21.18 65.55 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 122.956 0.502 . . . . 0.0 112.181 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -63.38 -34.49 77.83 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.826 0.85 . . . . 0.0 112.766 168.207 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.737 HD12 HG23 ' A' ' 32' ' ' VAL . 3.3 pp -104.97 8.15 34.39 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 176.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.737 HG23 HD12 ' A' ' 31' ' ' LEU . 69.4 t -128.06 4.13 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 125.338 1.455 . . . . 0.0 112.749 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.63 -32.25 1.96 Allowed Glycine 0 N--CA 1.487 2.063 0 C-N-CA 123.829 0.728 . . . . 0.0 113.761 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -118.88 -91.77 0.55 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.69 0.796 . . . . 0.0 111.882 -178.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.262 1.717 0 CA-C-O 115.83 -2.033 . . . . 0.0 113.336 177.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.653 ' HB3' HD13 ' A' ' 7' ' ' LEU . 75.2 mt-30 63.81 96.51 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.821 1.248 . . . . 0.0 112.387 -179.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.99 75.53 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 112.871 -1.968 . . . . 0.0 115.145 -174.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.462 ' CE ' HD12 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -94.53 -29.55 14.85 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 114.02 -1.446 . . . . 0.0 114.391 178.518 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.464 ' HB3' HE22 ' A' ' 6' ' ' GLN . 0.3 OUTLIER 167.99 -30.12 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 129.318 3.047 . . . . 0.0 113.677 -172.093 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.464 HE22 ' HB3' ' A' ' 5' ' ' LYS . 11.4 mp0 -100.72 -54.16 2.89 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.761 -178.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.653 HD13 ' HB3' ' A' ' 2' ' ' GLN . 30.3 mt -68.46 -21.83 64.6 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-N 114.077 -1.419 . . . . 0.0 112.167 176.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -67.29 -31.84 72.42 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 172.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -54.76 -35.49 63.83 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 123.805 0.691 . . . . 0.0 111.337 174.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.2 mmtt -76.16 -18.25 59.2 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 112.825 -1.989 . . . . 0.0 111.769 -178.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.8 t -90.93 -41.47 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 C-N-CA 125.325 1.45 . . . . 0.0 109.623 178.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -61.43 -37.15 82.49 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.026 0.53 . . . . 0.0 111.777 174.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -60.98 -26.83 67.85 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 124.453 1.095 . . . . 0.0 113.014 171.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.0 mt -73.59 -63.98 1.09 Allowed 'General case' 0 N--CA 1.481 1.106 0 CA-C-O 116.73 -1.605 . . . . 0.0 108.374 177.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.0 mt -52.36 -46.53 66.19 Favored 'General case' 0 N--CA 1.485 1.3 0 O-C-N 124.687 1.242 . . . . 0.0 112.73 -178.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.1 p -45.58 -33.41 2.79 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 16.1 mttt -103.26 -55.26 2.44 Favored 'General case' 0 C--O 1.213 -0.826 0 C-N-CA 125.821 1.648 . . . . 0.0 115.274 172.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.45 -38.13 58.56 Favored 'General case' 0 CA--C 1.568 1.639 0 C-N-CA 125.05 1.34 . . . . 0.0 113.175 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.46 -39.69 67.57 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 124.593 1.157 . . . . 0.0 110.729 176.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -76.87 -12.8 60.01 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 123.81 0.694 . . . . 0.0 112.854 173.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.662 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 19.9 tp -76.76 -55.89 5.09 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.943 1.697 . . . . 0.0 110.789 -176.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.15 -25.58 33.12 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 124.728 1.268 . . . . 0.0 113.201 173.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -82.2 -50.85 8.55 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 124.595 1.184 . . . . 0.0 112.04 174.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.662 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 13.1 pt-20 -61.49 -45.77 92.81 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 118.837 -0.602 . . . . 0.0 112.251 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.435 ' HA ' HD23 ' A' ' 28' ' ' LEU . 82.6 t -51.26 -34.59 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.752 1.621 . . . . 0.0 111.065 174.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.31 -68.35 0.32 Allowed 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 118.056 -0.973 . . . . 0.0 111.138 173.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.0 tpp85 -50.87 -38.85 51.85 Favored 'General case' 0 CA--C 1.559 1.322 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 174.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.3 tp -60.91 -65.39 0.7 Allowed 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.933 1.293 . . . . 0.0 111.734 174.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . 0.256 0.0 OUTLIER -65.71 -20.43 66.28 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.292 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.62 -33.45 66.28 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.808 1.243 . . . . 0.0 112.181 172.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.0 pp -103.56 13.31 33.64 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 175.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.6 t -118.1 -12.71 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.871 175.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.31 -46.7 6.03 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.066 1.317 . . . . 0.0 111.738 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.03 18.31 9.41 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 . . . . . 0 C--O 1.263 1.775 0 C-N-CA 126.289 1.835 . . . . 0.0 113.355 -171.934 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.896 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.32 144.14 50.91 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 114.151 -1.386 . . . . 0.0 107.901 176.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 78.84 66.89 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 128.399 2.679 . . . . 0.0 110.632 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.587 ' HE2' HD12 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -50.11 -35.15 24.5 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp -59.62 -50.67 72.97 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 125.117 1.367 . . . . 0.0 110.969 176.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 38.5 tp60 -76.98 -44.15 32.17 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.461 1.104 . . . . 0.0 113.283 176.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.739 HD23 ' HE3' ' A' ' 10' ' ' LYS . 76.0 mt -54.0 -33.89 58.33 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 118.396 -0.811 . . . . 0.0 111.796 175.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.98 -21.73 66.33 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 173.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.84 -41.24 68.37 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.972 0.909 . . . . 0.0 110.284 175.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.739 ' HE3' HD23 ' A' ' 7' ' ' LEU 0.254 0.1 OUTLIER -89.2 -26.03 21.46 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.906 1.817 . . . . 0.0 115.906 176.054 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 24.1 t -45.97 -40.62 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 172.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.37 -48.54 67.13 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 174.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -55.98 -29.68 60.63 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.323 1.049 . . . . 0.0 111.602 173.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 10' ' ' LYS . 54.9 mt -66.71 -62.74 1.29 Allowed 'General case' 0 C--O 1.212 -0.872 0 CA-C-O 117.769 -1.11 . . . . 0.0 109.599 175.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.1 -45.72 75.49 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 118.38 -0.819 . . . . 0.0 113.116 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.5 p -51.45 -35.49 39.85 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.291 0.636 . . . . 0.0 112.312 176.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -91.19 -43.32 9.93 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 176.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -54.25 -31.86 54.61 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.298 1.039 . . . . 0.0 112.137 174.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -68.83 -41.86 77.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.989 1.715 . . . . 0.0 113.604 172.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -75.61 -19.44 59.24 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 172.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.6 tp -70.77 -48.81 52.33 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.939 1.296 . . . . 0.0 112.016 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -52.59 -32.32 40.79 Favored 'General case' 0 CA--C 1.555 1.17 0 O-C-N 123.999 0.812 . . . . 0.0 112.439 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.03 -48.79 62.08 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 114.736 -1.12 . . . . 0.0 111.111 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -58.21 -54.94 41.3 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 117.373 -1.298 . . . . 0.0 112.532 175.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 78.4 t -43.87 -39.63 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 125.679 1.592 . . . . 0.0 112.228 173.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.485 ' O ' ' HG2' ' A' ' 30' ' ' LYS . . . -65.53 -69.14 0.31 Allowed 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.772 175.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -48.45 -36.5 15.09 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 174.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.457 ' O ' HG23 ' A' ' 32' ' ' VAL . 14.9 tp -59.52 -62.21 2.05 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 126.714 2.006 . . . . 0.0 111.46 171.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -60.28 -24.23 64.78 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 26' ' ' ALA . 0.9 OUTLIER -78.8 -34.27 45.55 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.484 173.505 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.26 1.29 53.63 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 174.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 28' ' ' LEU . 44.2 t -114.1 4.71 7.83 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.229 0 C-N-CA 123.9 0.88 . . . . 0.0 111.88 177.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -92.3 -39.25 5.43 Favored Glycine 0 N--CA 1.481 1.69 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.955 175.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -144.68 20.7 1.66 Allowed 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 ttt-85 . . . . . 0 C--O 1.257 1.497 0 CA-C-O 115.837 -2.03 . . . . 0.0 114.479 -176.001 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.491 ' HG ' HD11 ' A' ' 7' ' ' LEU . 10.0 mp . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.59 46.99 0.5 Allowed 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 115.24 -0.891 . . . . 0.0 113.355 -177.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.601 ' HB3' ' HE3' ' A' ' 5' ' ' LYS . 5.5 mmt-85 74.75 140.87 0.07 Allowed 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 127.894 2.477 . . . . 0.0 110.647 -177.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.2 mmt -57.35 -46.77 82.99 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.601 ' HE3' ' HB3' ' A' ' 3' ' ' ARG . 0.4 OUTLIER -55.0 -24.11 22.7 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 172.894 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.625 HE22 ' NZ ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -98.43 -42.22 7.44 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 173.066 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.557 ' O ' HG23 ' A' ' 11' ' ' VAL . 58.8 mt -57.18 -42.4 81.1 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 172.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -55.93 -36.5 67.81 Favored 'General case' 0 N--CA 1.482 1.16 0 CA-C-O 117.198 -1.382 . . . . 0.0 112.127 175.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -59.75 -33.54 71.79 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 173.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.625 ' NZ ' HE22 ' A' ' 6' ' ' GLN . 13.4 mmtt -87.16 -30.16 21.24 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.915 1.286 . . . . 0.0 110.757 -177.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 7' ' ' LEU . 12.4 t -79.81 -28.49 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 125.45 1.5 . . . . 0.0 111.668 176.044 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -65.33 -47.13 77.6 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.997 1.319 . . . . 0.0 112.536 176.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -58.08 -30.31 66.13 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 114.229 -1.351 . . . . 0.0 111.375 173.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.9 mt -66.19 -61.89 1.78 Allowed 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.67 175.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.0 mt -53.2 -42.04 65.88 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.1 m -50.83 -44.73 59.39 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 173.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 16.1 pttm -86.09 -35.72 20.07 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 174.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.48 -43.94 97.98 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.724 1.21 . . . . 0.0 112.341 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -58.59 -35.46 72.46 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 124.62 1.2 . . . . 0.0 111.888 170.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -89.21 5.24 45.67 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 125.976 1.71 . . . . 0.0 114.433 174.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.7 tp -110.95 -50.24 2.96 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.525 0.73 . . . . 0.0 110.439 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -67.85 -24.31 65.24 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.281 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -71.79 -33.88 68.94 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 174.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -78.62 -50.41 11.54 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.987 1.315 . . . . 0.0 111.894 -178.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.42 ' HA ' HD23 ' A' ' 28' ' ' LEU . 85.7 t -46.85 -32.72 1.94 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-O 117.798 -1.096 . . . . 0.0 111.482 169.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.431 ' O ' ' HD3' ' A' ' 30' ' ' LYS . . . -58.72 -63.73 1.18 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 172.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.0 ptm180 -55.19 -29.92 58.87 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 175.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 25' ' ' VAL . 5.3 tp -68.92 -57.28 5.73 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.028 1.331 . . . . 0.0 111.665 173.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -59.98 -18.77 48.22 Favored 'General case' 0 C--O 1.216 -0.685 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 26' ' ' ALA . 0.5 OUTLIER -55.96 -37.64 69.29 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.739 1.015 . . . . 0.0 113.739 167.533 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -29.56 45.64 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.195 176.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 61.8 t -90.85 13.43 1.7 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.605 0 C-N-CA 124.985 1.314 . . . . 0.0 110.959 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.23 -41.64 3.19 Favored Glycine 0 N--CA 1.484 1.893 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -138.63 27.82 2.47 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -176.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 N--CA 1.485 1.293 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -74.92 90.06 2.4 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.859 0.864 . . . . 0.0 110.213 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -146.42 163.84 34.35 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 114.218 -1.355 . . . . 0.0 111.088 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.438 ' HE2' HD12 ' A' ' 7' ' ' LEU . 32.1 mmt -54.94 -27.66 45.24 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 118.061 -0.971 . . . . 0.0 113.615 176.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -72.54 -31.66 65.46 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 175.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -97.01 -46.21 6.28 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.46 ' O ' HG23 ' A' ' 11' ' ' VAL . 53.4 mt -56.88 -34.37 67.81 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 118.123 -0.941 . . . . 0.0 110.62 176.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 12' ' ' GLU . 21.5 mm-40 -57.13 -32.36 66.28 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 116.544 -1.693 . . . . 0.0 113.829 169.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -60.3 -36.3 77.57 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 119.964 1.256 . . . . 0.0 111.021 175.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.0 mttm -83.65 -49.56 9.04 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.726 1.21 . . . . 0.0 109.931 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.492 HG13 HD12 ' A' ' 14' ' ' LEU . 16.8 t -63.4 -15.41 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 124.329 1.052 . . . . 0.0 111.735 176.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -62.35 -39.54 93.47 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.306 1.442 . . . . 0.0 110.914 176.48 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -56.95 -29.76 63.44 Favored 'General case' 0 CA--C 1.554 1.119 0 O-C-N 125.014 1.446 . . . . 0.0 111.522 173.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.492 HD12 HG13 ' A' ' 11' ' ' VAL . 52.1 mt -77.83 -61.58 1.95 Allowed 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 116.573 -1.68 . . . . 0.0 107.769 177.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.39 -45.43 62.48 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 117.373 -1.298 . . . . 0.0 113.226 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.3 p -44.67 -36.09 2.95 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 175.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.45 -50.79 3.14 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 172.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.91 -38.85 65.27 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 125.467 1.507 . . . . 0.0 112.464 177.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -68.92 -40.74 78.9 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.902 1.281 . . . . 0.0 110.732 175.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -77.76 -14.57 59.56 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 175.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.6 tp -78.63 -45.08 22.36 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.807 1.643 . . . . 0.0 111.025 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.41 -29.93 64.52 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 124.646 1.216 . . . . 0.0 111.552 176.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.441 HD22 ' C ' ' A' ' 23' ' ' ASN . 0.2 OUTLIER -60.13 -49.59 77.03 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.529 0.732 . . . . 0.0 111.076 175.283 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.01 -56.04 15.46 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 117.411 -1.281 . . . . 0.0 110.887 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.498 ' HA ' HD23 ' A' ' 28' ' ' LEU . 47.9 t -42.86 -39.09 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 125.214 1.571 . . . . 0.0 111.444 174.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.443 ' O ' ' HD2' ' A' ' 30' ' ' LYS . . . -62.09 -72.76 0.12 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 117.922 -1.037 . . . . 0.0 112.782 172.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.405 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 0.6 OUTLIER -47.92 -36.69 12.79 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.395 1.078 . . . . 0.0 112.715 177.657 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 25' ' ' VAL . 8.7 tp -60.99 -60.14 4.26 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.897 2.079 . . . . 0.0 113.461 172.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -62.9 -25.43 68.31 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 178.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.443 ' HD2' ' O ' ' A' ' 26' ' ' ALA . 0.1 OUTLIER -64.88 -19.52 65.95 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 168.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 28' ' ' LEU . 16.6 mt -87.98 -42.07 12.7 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.289 1.036 . . . . 0.0 113.09 174.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 43.2 t -67.86 -14.65 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.143 0 CA-C-N 114.405 -1.27 . . . . 0.0 113.745 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -129.2 53.29 0.81 Allowed Glycine 0 N--CA 1.481 1.67 0 C-N-CA 124.25 0.929 . . . . 0.0 111.341 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 92.31 82.19 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 128.479 2.711 . . . . 0.0 111.94 176.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 . . . . . 0 N--CA 1.488 1.427 0 N-CA-C 117.449 2.389 . . . . 0.0 117.449 176.734 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.483 1.196 0 N-CA-C 116.344 1.979 . . . . 0.0 116.344 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 64.21 -166.39 0.23 Allowed 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.327 1.451 . . . . 0.0 108.75 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? 62.67 -148.17 0.36 Allowed 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.83 -1.169 . . . . 0.0 109.778 175.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.12 -32.15 2.76 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 117.22 -1.371 . . . . 0.0 114.439 173.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.6 tptt -62.38 -31.29 71.94 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 176.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -101.37 -37.37 8.5 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 171.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.9 mt -61.6 -30.0 70.4 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-O 118.295 -0.859 . . . . 0.0 111.767 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -62.43 -40.59 97.08 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 118.313 -0.851 . . . . 0.0 112.442 172.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.519 ' O ' ' HB2' ' A' ' 13' ' ' GLU . 0.1 OUTLIER -74.61 -26.69 60.07 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 174.925 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.5 tttm -78.82 -48.99 13.7 Favored 'General case' 0 CA--C 1.557 1.24 0 O-C-N 124.156 0.91 . . . . 0.0 111.957 173.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.0 t -69.6 -50.96 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 125.49 1.516 . . . . 0.0 112.119 178.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -60.5 -34.23 73.77 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 117.214 -1.374 . . . . 0.0 109.745 175.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.519 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 34.7 tt0 -53.73 -38.25 64.16 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-O 117.47 -1.252 . . . . 0.0 110.428 172.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.5 mt -64.28 -59.11 4.79 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.784 0.434 . . . . 0.0 110.942 -178.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 15.2 mt -59.76 -51.73 68.51 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.952 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.7 m -54.1 -33.07 56.7 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 124.549 1.14 . . . . 0.0 113.674 175.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.497 ' HD3' ' HD2' ' A' ' 20' ' ' HIS . 17.2 tppt? -77.79 -53.25 7.72 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.473 1.509 . . . . 0.0 111.895 174.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -59.69 -39.67 85.35 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.129 0.571 . . . . 0.0 111.709 178.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -57.39 -33.65 68.05 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.074 0.95 . . . . 0.0 112.716 170.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.602 ' HA ' HD22 ' A' ' 23' ' ' ASN . 6.3 t60 -89.87 5.04 47.98 Favored 'General case' 0 CA--C 1.564 1.509 0 C-N-CA 125.917 1.687 . . . . 0.0 114.475 173.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 33.4 tp -108.1 -42.84 4.54 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.174 -0.954 . . . . 0.0 111.421 177.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -58.88 -32.77 69.78 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 175.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.602 HD22 ' HA ' ' A' ' 20' ' ' HIS . 3.7 p30 -64.78 -40.88 95.97 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.7 177.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -72.21 -49.6 34.04 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-O 116.342 -1.789 . . . . 0.0 110.361 -175.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.6 t -43.55 -40.95 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 124.399 1.062 . . . . 0.0 112.131 169.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.54 -64.56 0.84 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.821 0.849 . . . . 0.0 112.818 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.4 mtm105 -54.35 -27.44 36.15 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 174.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.3 tp -65.05 -60.31 3.17 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.148 1.779 . . . . 0.0 110.695 170.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . 0.3 0.1 OUTLIER -62.95 -19.13 63.98 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 178.698 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.39 -33.09 58.58 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.01 0.524 . . . . 0.0 111.354 173.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.2 mt -80.76 -35.26 33.52 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.916 1.286 . . . . 0.0 110.182 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.4 t -58.72 -26.32 31.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 C-N-CA 124.833 1.253 . . . . 0.0 112.219 177.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.1 -36.54 61.52 Favored Glycine 0 CA--C 1.552 2.364 0 C-N-CA 124.788 1.185 . . . . 0.0 112.895 174.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -142.83 32.03 1.42 Allowed 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 178.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 115.918 -1.991 . . . . 0.0 113.92 -175.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.42 HD12 ' H ' ' A' ' 3' ' ' ARG . 1.5 pp . . . . . 0 N--CA 1.483 1.19 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.76 46.6 0.37 Allowed 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.401 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.42 ' H ' HD12 ' A' ' 1' ' ' LEU . 1.6 ttt85 -129.15 136.65 50.46 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 113.765 -1.561 . . . . 0.0 108.822 179.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.7 tpp 72.45 -14.42 0.56 Allowed 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 126.017 1.727 . . . . 0.0 114.927 -177.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.406 ' H ' ' C ' ' A' ' 3' ' ' ARG . 46.6 mtpt -94.37 -21.47 18.94 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.472 1.909 . . . . 0.0 113.876 178.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -111.84 -22.42 11.12 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 118.177 -0.916 . . . . 0.0 113.106 169.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 76.4 mt -56.37 -44.98 80.69 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 117.532 -1.223 . . . . 0.0 112.534 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.18 -28.69 64.42 Favored 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 174.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.59 -27.03 55.66 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.507 1.123 . . . . 0.0 111.735 177.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.486 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -94.8 -26.93 16.02 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.859 0.864 . . . . 0.0 112.823 176.409 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 37.4 t -71.62 -40.57 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.119 0.968 . . . . 0.0 109.971 173.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -64.78 -48.32 74.93 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 118.028 -0.986 . . . . 0.0 112.391 177.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -47.85 -36.64 12.35 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 124.818 1.324 . . . . 0.0 111.847 177.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 10' ' ' LYS . 57.2 mt -63.45 -61.57 2.25 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 117.356 -1.307 . . . . 0.0 109.952 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.3 mt -54.44 -49.66 69.49 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.966 0.906 . . . . 0.0 112.189 178.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.7 m -45.43 -39.31 6.93 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 124.837 1.255 . . . . 0.0 112.464 174.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -87.62 -47.8 8.4 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 113.898 -1.501 . . . . 0.0 114.138 177.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -53.52 -33.36 54.21 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.458 1.503 . . . . 0.0 112.427 175.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -64.08 -48.43 76.24 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 125.118 1.367 . . . . 0.0 112.618 171.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.06 -18.52 61.93 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 175.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 20.5 tp -69.01 -44.41 72.84 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.097 1.359 . . . . 0.0 111.832 179.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -57.21 -31.15 65.19 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.432 1.083 . . . . 0.0 112.743 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -64.65 -48.64 74.08 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.811 172.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -61.68 -57.87 10.29 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 116.842 -1.551 . . . . 0.0 112.059 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 82.0 t -42.47 -38.61 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 125.628 1.571 . . . . 0.0 112.791 173.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.28 -66.53 0.55 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.767 0.827 . . . . 0.0 112.76 174.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -51.82 -37.6 52.4 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.119 0.967 . . . . 0.0 112.581 175.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.452 ' HA ' HD23 ' A' ' 31' ' ' LEU . 14.6 tp -57.51 -59.01 5.81 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 126.518 1.927 . . . . 0.0 112.286 171.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -61.23 -21.75 64.15 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.2 mtpt -84.91 -27.88 26.3 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 172.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -88.31 -19.33 26.85 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.233 1.413 . . . . 0.0 113.673 173.923 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -64.94 -27.29 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 C-N-CA 126.394 1.878 . . . . 0.0 112.082 174.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -44.92 -39.77 6.52 Favored Glycine 0 CA--C 1.539 1.538 0 O-C-N 124.472 1.107 . . . . 0.0 111.96 175.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -122.38 -107.92 0.35 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 174.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.257 1.495 0 C-N-CA 128.58 2.752 . . . . 0.0 113.275 -175.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 123.7 1.714 . . . . 0.0 115.506 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -83.76 53.7 2.64 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 113.225 -1.807 . . . . 0.0 110.992 -179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.41 132.4 8.81 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 113.21 -1.813 . . . . 0.0 108.428 -178.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.3 tpp 74.83 -21.36 0.3 Allowed 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 -178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.52 -37.8 27.26 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 115.16 -0.927 . . . . 0.0 112.029 176.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.4 ' H ' ' NE2' ' A' ' 6' ' ' GLN . 0.0 OUTLIER -93.31 -26.8 17.14 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.776 174.225 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 70.8 mt -54.39 -42.33 70.29 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.61 177.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -63.87 -38.45 91.13 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 172.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -79.05 -16.09 57.31 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.804 0.842 . . . . 0.0 112.701 -179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.89 -32.63 10.9 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.185 0.994 . . . . 0.0 112.504 176.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 48.8 t -70.05 -45.14 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 125.237 1.415 . . . . 0.0 110.388 174.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -68.23 -34.46 76.29 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -61.44 -20.63 63.33 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.662 1.226 . . . . 0.0 112.889 174.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.8 mt -69.31 -59.62 2.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.477 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.6 mt -59.12 -49.59 77.29 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.539 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p -53.75 -33.53 56.06 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.4 ttpp -76.94 -58.69 3.14 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 171.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.469 ' O ' ' HB3' ' A' ' 21' ' ' LEU . 1.3 t-20 -51.76 -30.51 23.07 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.435 1.094 . . . . 0.0 112.827 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.501 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 2.6 m-30 -70.57 -44.9 66.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.207 1.403 . . . . 0.0 113.048 172.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.99 -18.64 61.97 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.659 ' HA ' ' HG2' ' A' ' 24' ' ' GLU . 24.3 tp -66.01 -47.45 74.42 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.283 1.433 . . . . 0.0 111.571 178.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 23.3 pt-20 -60.53 -25.96 66.52 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 175.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -82.08 -47.52 12.48 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.309 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.659 ' HG2' ' HA ' ' A' ' 21' ' ' LEU . 9.1 pt-20 -63.72 -46.58 84.74 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 117.82 -1.086 . . . . 0.0 112.511 176.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.455 ' HA ' HD23 ' A' ' 28' ' ' LEU . 68.7 t -50.94 -34.71 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 126.062 1.745 . . . . 0.0 111.489 175.414 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.38 -71.52 0.15 Allowed 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 118.097 -0.954 . . . . 0.0 110.284 173.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -49.88 -36.43 27.19 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 176.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' A' ' 25' ' ' VAL . 12.2 tp -56.14 -62.54 1.64 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.53 1.532 . . . . 0.0 112.567 171.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -22.45 66.97 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 178.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.52 -19.79 62.5 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 171.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.54 -19.86 65.14 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 170.176 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 54.9 t -88.45 7.8 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 C-N-CA 124.386 1.074 . . . . 0.0 111.579 173.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -95.52 -47.79 2.48 Favored Glycine 0 N--CA 1.486 1.992 0 N-CA-C 111.54 -0.624 . . . . 0.0 111.54 176.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -168.5 60.49 0.06 Allowed 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.869 1.268 . . . . 0.0 113.009 -175.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 42.5 ttt85 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.613 -1.184 . . . . 0.0 113.119 -179.176 . . . . . . . . 0 0 . 1 stop_ save_