data_2mlp_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 2mlp _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 7' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 . . . . . 0 N--CA 1.501 2.087 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.24 -26.65 61.21 Favored 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 124.239 1.015 . . . . 0.0 113.551 169.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.76 -36.37 29.22 Favored Glycine 1 CA--C 1.581 4.173 0 O-C-N 121.061 -1.024 . . . . 0.0 112.535 170.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -47.4 -33.46 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 120.805 -1.409 . . . . 0.0 111.294 156.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.6 t -76.21 -62.13 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 C-N-CA 125.006 1.322 . . . . 0.0 110.911 -174.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.1 mt -70.37 -28.42 65.1 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.598 -1.314 . . . . 0.0 113.583 -175.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 m -72.88 -26.46 61.45 Favored 'General case' 0 CA--C 1.58 2.106 0 O-C-N 120.368 -1.457 . . . . 0.0 114.486 162.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.464 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -65.16 -31.52 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.241 0 O-C-N 121.808 -0.557 . . . . 0.0 110.031 161.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -70.36 -36.93 74.48 Favored 'General case' 0 CA--C 1.581 2.163 0 C-N-CA 124.578 1.151 . . . . 0.0 111.823 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -50.78 -27.66 7.69 Favored 'General case' 0 CA--C 1.587 2.386 0 C-N-CA 124.98 1.312 . . . . 0.0 114.283 156.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.452 ' O ' ' CB ' ' A' ' 20' ' ' SER . 28.6 mt -87.28 -13.27 44.17 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 116.188 1.921 . . . . 0.0 116.188 164.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.56 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -69.9 -13.29 62.18 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 119.856 -1.778 . . . . 0.0 111.593 155.461 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 29.9 mt -85.51 -36.96 20.19 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 130.6 3.56 . . . . 0.0 113.36 154.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.452 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -38.29 -36.97 0.26 Allowed 'General case' 0 N--CA 1.515 2.776 0 CA-C-O 125.882 2.753 . . . . 0.0 108.424 158.525 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.582 2.174 1 C-N-CA 132.626 4.371 . . . . 0.0 111.992 173.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 . . . . . 0 N--CA 1.501 2.094 0 CA-C-O 121.251 0.548 . . . . 0.0 111.642 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -70.09 -30.58 67.83 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.39 -0.819 . . . . 0.0 112.865 157.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.69 -28.07 52.34 Favored Glycine 1 CA--C 1.584 4.355 0 CA-C-O 122.435 1.019 . . . . 0.0 111.79 171.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.1 t -56.67 -29.56 30.06 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 C-N-CA 125.24 1.416 . . . . 0.0 111.705 156.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 18.4 t -76.5 -45.3 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 C-N-CA 124.987 1.315 . . . . 0.0 110.581 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.0 mt -67.88 -27.52 66.74 Favored 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 123.208 1.48 . . . . 0.0 113.546 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.74 -27.51 62.08 Favored 'General case' 0 CA--C 1.582 2.177 0 O-C-N 120.226 -1.546 . . . . 0.0 114.546 163.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.485 ' CG1' ' CE ' ' A' ' 18' ' ' LYS . 2.2 t -65.35 -31.93 55.99 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 122.87 0.468 . . . . 0.0 110.318 161.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -68.08 -35.66 78.54 Favored 'General case' 0 CA--C 1.581 2.157 0 C-N-CA 124.837 1.255 . . . . 0.0 111.667 175.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.64 -28.5 55.68 Favored 'General case' 0 CA--C 1.584 2.269 0 C-N-CA 124.1 0.96 . . . . 0.0 113.521 156.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.458 ' O ' ' CG ' ' A' ' 21' ' ' ARG . 23.4 mt -89.08 -0.6 57.57 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 164.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.497 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.39 -29.68 61.64 Favored 'General case' 0 CA--C 1.592 2.574 0 CA-C-O 125.8 2.714 . . . . 0.0 110.818 153.734 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 35.2 mt -64.99 -40.12 94.48 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 128.704 2.802 . . . . 0.0 113.882 154.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.2 t -37.67 -43.18 0.61 Allowed 'General case' 0 CA--C 1.589 2.469 0 CA-C-O 124.971 2.319 . . . . 0.0 109.732 161.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.458 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.248 0 C-N-CA 127.268 2.227 . . . . 0.0 112.596 -168.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 . . . . . 0 N--CA 1.501 2.121 0 CA-C-O 121.021 0.438 . . . . 0.0 112.008 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -71.08 -27.83 63.9 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.263 -0.898 . . . . 0.0 113.136 164.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.28 -36.61 30.38 Favored Glycine 1 CA--C 1.584 4.396 0 CA-C-O 122.77 1.205 . . . . 0.0 111.939 169.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.8 t -50.25 -29.99 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 C-N-CA 125.158 1.383 . . . . 0.0 111.751 157.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.5 t -75.83 -61.7 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 C-N-CA 124.747 1.219 . . . . 0.0 111.005 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.0 mt -64.4 -24.9 67.79 Favored 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 123.118 1.437 . . . . 0.0 113.675 -174.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -73.17 -29.01 62.54 Favored 'General case' 0 CA--C 1.579 2.083 0 O-C-N 120.304 -1.498 . . . . 0.0 114.557 162.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.679 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -70.45 -19.32 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.586 2.342 0 CA-C-O 117.124 -1.417 . . . . 0.0 110.935 162.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -73.65 -38.46 64.97 Favored 'General case' 0 CA--C 1.581 2.148 0 O-C-N 124.372 1.045 . . . . 0.0 110.908 167.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -50.78 -28.84 10.11 Favored 'General case' 0 CA--C 1.59 2.51 0 C-N-CA 125.285 1.434 . . . . 0.0 112.465 151.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.539 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -88.94 -5.01 58.28 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 125.641 1.576 . . . . 0.0 114.981 168.131 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.679 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -77.6 -19.13 56.07 Favored 'General case' 0 CA--C 1.588 2.405 0 CA-C-O 124.683 2.182 . . . . 0.0 111.708 153.263 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.3 mt -76.08 -32.3 59.18 Favored 'General case' 0 CA--C 1.575 1.923 0 C-N-CA 129.073 2.949 . . . . 0.0 112.581 154.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -40.33 -40.73 1.22 Allowed 'General case' 0 N--CA 1.507 2.401 0 CA-C-O 124.563 2.125 . . . . 0.0 110.179 160.037 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.46 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.132 0 C-N-CA 127.176 2.19 . . . . 0.0 112.527 -160.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 . . . . . 0 N--CA 1.502 2.161 0 CA-C-O 121.096 0.474 . . . . 0.0 111.865 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -73.35 -29.3 62.57 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.93 -1.106 . . . . 0.0 113.028 170.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.55 -35.06 37.78 Favored Glycine 1 CA--C 1.584 4.385 0 CA-C-O 122.763 1.202 . . . . 0.0 111.925 170.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -49.05 -32.41 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 C-N-CA 125.306 1.442 . . . . 0.0 111.441 157.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.6 t -76.55 -58.26 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 C-N-CA 124.839 1.256 . . . . 0.0 110.971 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.2 mt -59.79 -28.4 67.4 Favored 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 125.274 1.43 . . . . 0.0 114.196 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.75 -27.53 62.08 Favored 'General case' 0 CA--C 1.582 2.179 0 O-C-N 120.378 -1.451 . . . . 0.0 114.664 163.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.657 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -70.62 -20.56 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.25 0 CA-C-O 117.487 -1.244 . . . . 0.0 111.164 161.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -74.96 -38.66 61.64 Favored 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 124.448 1.099 . . . . 0.0 111.398 171.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.41 -27.98 18.02 Favored 'General case' 0 CA--C 1.59 2.507 0 C-N-CA 124.902 1.281 . . . . 0.0 112.403 152.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.539 ' N ' ' CD1' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -86.71 -6.57 58.8 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 125.941 1.696 . . . . 0.0 114.623 167.413 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.657 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -77.39 -19.03 56.79 Favored 'General case' 0 CA--C 1.586 2.355 0 CA-C-O 124.445 2.069 . . . . 0.0 111.863 153.467 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 37.9 mt -77.2 -30.95 54.98 Favored 'General case' 0 CA--C 1.575 1.909 0 C-N-CA 128.721 2.808 . . . . 0.0 112.629 154.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -40.91 -39.31 1.12 Allowed 'General case' 0 CA--C 1.59 2.49 0 CA-C-O 124.783 2.23 . . . . 0.0 109.861 159.822 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 . . . . . 0 N--CA 1.504 2.227 0 C-N-CA 127.603 2.361 . . . . 0.0 112.498 -163.105 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 . . . . . 0 N--CA 1.501 2.109 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -73.68 -26.82 60.91 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.933 -1.104 . . . . 0.0 113.219 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.09 -34.62 32.82 Favored Glycine 1 CA--C 1.582 4.249 0 CA-C-O 122.303 0.946 . . . . 0.0 112.504 165.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.0 t -51.74 -31.63 13.28 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 O-C-N 120.884 -1.362 . . . . 0.0 111.422 158.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 41.5 t -77.09 -63.89 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 C-N-CA 125.152 1.381 . . . . 0.0 110.846 -176.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.18 -29.94 66.94 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 123.51 1.624 . . . . 0.0 113.601 -175.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 m -73.19 -24.77 60.58 Favored 'General case' 0 CA--C 1.581 2.153 0 O-C-N 119.739 -1.851 . . . . 0.0 114.422 162.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.469 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -66.37 -30.39 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.239 0 O-C-N 121.794 -0.566 . . . . 0.0 110.283 160.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -69.95 -35.34 74.43 Favored 'General case' 0 CA--C 1.581 2.17 0 C-N-CA 124.291 1.037 . . . . 0.0 111.55 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.03 -28.49 17.36 Favored 'General case' 0 CA--C 1.585 2.3 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 156.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.489 ' O ' ' CB ' ' A' ' 20' ' ' SER . 26.7 mt -88.16 -8.81 54.83 Favored 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 163.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.515 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.0 -18.47 62.6 Favored 'General case' 0 N--CA 1.508 2.452 0 CA-C-O 124.894 2.283 . . . . 0.0 111.268 154.654 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 42.9 mt -76.46 -41.34 47.67 Favored 'General case' 0 CA--C 1.575 1.932 0 C-N-CA 129.498 3.119 . . . . 0.0 113.124 154.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.86 -40.67 0.47 Allowed 'General case' 0 CA--C 1.59 2.498 0 CA-C-O 125.315 2.483 . . . . 0.0 109.343 158.786 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.579 2.079 0 C-N-CA 128.032 2.533 . . . . 0.0 112.508 -168.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 . . . . . 0 N--CA 1.502 2.161 0 CA-C-O 120.979 0.419 . . . . 0.0 111.829 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -73.28 -27.5 61.6 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.811 -1.181 . . . . 0.0 113.205 177.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.79 -38.03 28.46 Favored Glycine 1 CA--C 1.582 4.257 0 CA-C-O 122.71 1.172 . . . . 0.0 112.371 166.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 t -48.31 -31.09 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 120.732 -1.452 . . . . 0.0 111.298 158.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 42.3 t -77.07 -66.08 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 C-N-CA 125.08 1.352 . . . . 0.0 110.915 -178.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.4 mt -66.26 -28.47 68.74 Favored 'General case' 0 N--CA 1.503 2.206 0 CA-C-O 122.759 1.266 . . . . 0.0 113.588 -173.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.2 m -72.67 -24.97 61.1 Favored 'General case' 0 CA--C 1.582 2.174 0 O-C-N 120.334 -1.479 . . . . 0.0 114.366 162.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.65 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -72.39 -20.2 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.263 0 CA-C-O 117.38 -1.295 . . . . 0.0 111.088 161.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -74.92 -38.74 61.72 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 124.316 1.01 . . . . 0.0 111.363 170.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.78 -27.3 11.76 Favored 'General case' 0 CA--C 1.59 2.512 0 C-N-CA 125.072 1.349 . . . . 0.0 112.528 151.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.535 ' N ' ' CD1' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -87.86 -7.64 56.94 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 125.836 1.654 . . . . 0.0 114.814 167.007 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.65 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -76.09 -17.77 59.47 Favored 'General case' 0 CA--C 1.588 2.417 0 O-C-N 118.88 -2.387 . . . . 0.0 111.739 153.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 37.8 mt -78.43 -33.89 48.29 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 129.102 2.961 . . . . 0.0 112.744 154.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -39.72 -38.62 0.66 Allowed 'General case' 0 CA--C 1.591 2.54 0 CA-C-O 125.643 2.64 . . . . 0.0 109.591 158.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.58 2.12 0 C-N-CA 128.731 2.812 . . . . 0.0 112.206 -156.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 . . . . . 0 N--CA 1.501 2.125 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -73.33 -34.82 65.86 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.701 -1.249 . . . . 0.0 113.398 157.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.07 -41.82 98.36 Favored Glycine 1 CA--C 1.585 4.458 0 CA-C-O 122.414 1.008 . . . . 0.0 112.322 172.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.5 t -42.26 -37.67 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.25 0 C-N-CA 125.2 1.4 . . . . 0.0 111.243 159.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.2 t -76.82 -50.39 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 C-N-CA 125.439 1.496 . . . . 0.0 110.737 -172.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.8 mt -70.07 -19.71 63.26 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 120.408 -1.432 . . . . 0.0 113.081 -175.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -30.04 63.23 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 162.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.668 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -67.43 -26.76 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.322 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.619 162.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -70.39 -37.96 74.59 Favored 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 124.291 1.036 . . . . 0.0 111.553 169.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.5 -26.8 22.3 Favored 'General case' 0 CA--C 1.588 2.438 0 CA-C-O 122.847 1.308 . . . . 0.0 112.496 153.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.549 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -88.02 -6.67 57.85 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 126.883 2.073 . . . . 0.0 114.654 167.634 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.668 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -79.24 -20.32 48.49 Favored 'General case' 0 CA--C 1.584 2.264 0 O-C-N 119.552 -1.967 . . . . 0.0 112.014 154.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 28.8 mt -77.33 -29.38 53.48 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 128.632 2.773 . . . . 0.0 112.681 155.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.549 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.17 -37.97 0.19 Allowed 'General case' 0 CA--C 1.59 2.487 0 CA-C-O 125.289 2.471 . . . . 0.0 109.65 157.597 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.219 0 C-N-CA 128.014 2.525 . . . . 0.0 112.359 -158.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 . . . . . 0 N--CA 1.502 2.138 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -72.36 -25.3 61.48 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 124.107 0.963 . . . . 0.0 113.166 170.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.09 -36.25 25.15 Favored Glycine 1 CA--C 1.581 4.206 0 CA-C-O 122.212 0.895 . . . . 0.0 112.444 166.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 t -51.13 -29.39 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 O-C-N 120.827 -1.396 . . . . 0.0 111.712 157.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.4 t -76.16 -64.47 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 C-N-CA 125.056 1.342 . . . . 0.0 110.93 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.4 mt -70.29 -29.4 66.15 Favored 'General case' 0 N--CA 1.502 2.152 0 CA-C-O 122.934 1.35 . . . . 0.0 113.515 -174.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.7 m -73.0 -26.48 61.34 Favored 'General case' 0 CA--C 1.58 2.134 0 O-C-N 120.338 -1.476 . . . . 0.0 114.538 162.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.472 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -65.19 -30.16 49.46 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.259 0 O-C-N 121.759 -0.588 . . . . 0.0 110.192 160.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -71.91 -35.8 69.79 Favored 'General case' 0 CA--C 1.582 2.174 0 C-N-CA 124.589 1.155 . . . . 0.0 111.548 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.17 -28.4 18.03 Favored 'General case' 0 CA--C 1.585 2.296 0 C-N-CA 124.765 1.226 . . . . 0.0 113.823 155.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.476 ' O ' ' CB ' ' A' ' 20' ' ' SER . 27.7 mt -86.27 -11.29 52.7 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 163.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.574 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.08 -14.95 62.49 Favored 'General case' 0 N--CA 1.508 2.473 0 CA-C-O 124.317 2.008 . . . . 0.0 111.606 154.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.9 mt -81.15 -39.06 26.12 Favored 'General case' 0 CA--C 1.574 1.9 0 C-N-CA 128.857 2.863 . . . . 0.0 113.079 154.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -37.02 -39.91 0.26 Allowed 'General case' 0 CA--C 1.59 2.496 0 CA-C-O 124.806 2.241 . . . . 0.0 109.261 161.022 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.25 0 C-N-CA 127.327 2.251 . . . . 0.0 112.349 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 . . . . . 0 N--CA 1.502 2.154 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -73.2 -24.42 60.52 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.416 1.086 . . . . 0.0 113.087 175.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.43 -35.48 22.99 Favored Glycine 1 CA--C 1.579 4.046 0 O-C-N 121.513 -0.742 . . . . 0.0 113.057 165.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -49.81 -30.94 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 O-C-N 120.851 -1.382 . . . . 0.0 111.197 157.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.7 t -77.07 -67.18 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 C-N-CA 125.25 1.42 . . . . 0.0 110.924 -177.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.1 mt -70.18 -27.69 64.72 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-O 123.227 1.489 . . . . 0.0 113.344 -174.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.8 m -72.94 -24.16 60.77 Favored 'General case' 0 CA--C 1.581 2.136 0 O-C-N 120.169 -1.582 . . . . 0.0 114.401 161.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.656 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -70.56 -23.59 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.276 0 CA-C-O 117.233 -1.365 . . . . 0.0 110.868 160.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.92 -39.62 66.13 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 124.485 1.116 . . . . 0.0 111.535 172.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.66 -27.94 19.47 Favored 'General case' 0 CA--C 1.59 2.5 0 C-N-CA 124.781 1.232 . . . . 0.0 112.454 152.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.505 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.19 -6.08 59.06 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 125.719 1.608 . . . . 0.0 115.151 166.275 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.656 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.1 OUTLIER -77.12 -17.45 58.64 Favored 'General case' 0 CA--C 1.588 2.407 0 CA-C-O 124.519 2.104 . . . . 0.0 111.819 152.661 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 38.4 mt -78.38 -32.02 48.68 Favored 'General case' 0 CA--C 1.574 1.894 0 C-N-CA 128.692 2.797 . . . . 0.0 112.593 154.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -41.01 -39.87 1.29 Allowed 'General case' 0 CA--C 1.59 2.481 0 CA-C-O 124.7 2.19 . . . . 0.0 109.957 160.499 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.437 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.127 0 C-N-CA 127.466 2.307 . . . . 0.0 112.557 -164.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 . . . . . 0 N--CA 1.503 2.212 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -72.97 -25.95 61.19 Favored 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 124.221 1.008 . . . . 0.0 113.25 170.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.25 -35.94 32.41 Favored Glycine 1 CA--C 1.582 4.279 0 CA-C-O 122.484 1.047 . . . . 0.0 112.439 166.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -51.99 -31.12 13.48 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.904 -1.35 . . . . 0.0 111.93 158.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 41.6 t -75.9 -62.64 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 C-N-CA 125.103 1.361 . . . . 0.0 111.061 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.5 mt -70.6 -27.2 63.91 Favored 'General case' 0 N--CA 1.502 2.161 0 CA-C-O 122.801 1.286 . . . . 0.0 113.493 -174.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.4 t -73.39 -30.44 63.27 Favored 'General case' 0 CA--C 1.579 2.073 0 O-C-N 120.507 -1.371 . . . . 0.0 114.643 162.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.498 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -61.16 -32.11 51.94 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.29 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 161.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -71.57 -31.73 67.3 Favored 'General case' 0 CA--C 1.582 2.21 0 C-N-CA 125.007 1.323 . . . . 0.0 111.101 174.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.08 -25.7 59.17 Favored 'General case' 0 CA--C 1.581 2.16 0 C-N-CA 124.67 1.188 . . . . 0.0 113.59 156.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.422 ' CA ' ' CB ' ' A' ' 20' ' ' SER . 23.9 mt -91.36 -4.68 55.51 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 117.363 2.357 . . . . 0.0 117.363 163.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.519 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.34 -26.88 58.94 Favored 'General case' 0 CA--C 1.587 2.39 0 CA-C-O 124.674 2.178 . . . . 0.0 111.418 154.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -18.11 50.45 Favored 'General case' 0 CA--C 1.586 2.357 0 C-N-CA 129.691 3.196 . . . . 0.0 112.595 157.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.422 ' CB ' ' CA ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -52.36 -43.31 64.59 Favored 'General case' 0 CA--C 1.592 2.565 0 CA-C-O 125.425 2.536 . . . . 0.0 109.651 156.322 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.408 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER . . . . . 0 CA--C 1.58 2.108 0 C-N-CA 128.101 2.561 . . . . 0.0 112.0 -168.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 . . . . . 0 N--CA 1.501 2.1 0 CA-C-O 121.138 0.494 . . . . 0.0 111.987 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -73.06 -23.77 60.61 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.111 -0.993 . . . . 0.0 113.144 164.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.21 -38.62 25.37 Favored Glycine 1 CA--C 1.581 4.192 0 O-C-N 121.357 -0.839 . . . . 0.0 112.799 163.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.5 t -50.03 -29.47 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.334 0 O-C-N 120.852 -1.381 . . . . 0.0 111.742 158.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 42.0 t -76.09 -68.32 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 C-N-CA 125.035 1.334 . . . . 0.0 111.26 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.9 mt -68.65 -27.27 65.85 Favored 'General case' 0 N--CA 1.503 2.218 0 CA-C-O 123.642 1.687 . . . . 0.0 113.432 -173.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.5 m -72.48 -25.0 61.26 Favored 'General case' 0 CA--C 1.581 2.144 0 O-C-N 119.902 -1.749 . . . . 0.0 114.192 161.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.657 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -71.99 -20.22 20.24 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.3 0 CA-C-O 117.132 -1.413 . . . . 0.0 111.203 161.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -74.05 -39.76 63.28 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 124.423 1.077 . . . . 0.0 111.547 170.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.26 -25.4 14.33 Favored 'General case' 0 CA--C 1.59 2.507 0 C-N-CA 125.18 1.392 . . . . 0.0 113.059 152.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.465 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.5 -10.34 54.31 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 164.559 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.657 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -74.52 -13.78 60.72 Favored 'General case' 0 CA--C 1.587 2.391 0 O-C-N 119.461 -2.024 . . . . 0.0 111.695 154.299 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 33.2 mt -84.27 -33.95 23.9 Favored 'General case' 0 CA--C 1.573 1.858 0 C-N-CA 129.519 3.128 . . . . 0.0 112.922 154.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -41.38 -38.97 1.33 Allowed 'General case' 0 CA--C 1.602 2.954 0 CA-C-O 126.762 3.172 . . . . 0.0 108.075 156.624 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.588 2.408 1 C-N-CA 134.502 5.121 . . . . 0.0 110.898 -177.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 . . . . . 0 N--CA 1.503 2.221 0 CA-C-O 120.834 0.349 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -72.65 -30.58 64.41 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.26 1.024 . . . . 0.0 112.819 169.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.34 -23.54 58.52 Favored Glycine 1 CA--C 1.583 4.296 0 CA-C-O 122.139 0.855 . . . . 0.0 112.237 170.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 t -60.83 -29.77 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.188 0 C-N-CA 125.073 1.349 . . . . 0.0 111.444 156.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.8 t -76.67 -47.87 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 CA-C-O 123.39 1.567 . . . . 0.0 110.781 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.01 -24.72 64.24 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 119.979 -1.701 . . . . 0.0 113.228 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 m -73.04 -24.85 60.76 Favored 'General case' 0 CA--C 1.58 2.116 0 O-C-N 120.121 -1.612 . . . . 0.0 114.558 162.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.454 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -66.42 -33.41 63.27 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.266 0 O-C-N 121.658 -0.651 . . . . 0.0 110.202 160.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.81 -36.93 84.89 Favored 'General case' 0 CA--C 1.58 2.126 0 C-N-CA 124.488 1.115 . . . . 0.0 112.073 174.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.37 -28.14 18.38 Favored 'General case' 0 CA--C 1.586 2.338 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 157.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.484 ' O ' ' CB ' ' A' ' 20' ' ' SER . 26.9 mt -87.79 -8.41 55.99 Favored 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 163.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.533 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.16 -18.84 62.48 Favored 'General case' 0 N--CA 1.509 2.51 0 CA-C-O 124.814 2.245 . . . . 0.0 111.241 154.764 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 42.3 mt -76.13 -41.68 49.32 Favored 'General case' 0 CA--C 1.574 1.89 0 C-N-CA 129.502 3.121 . . . . 0.0 113.099 154.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.484 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.94 -41.47 0.55 Allowed 'General case' 0 N--CA 1.51 2.557 0 CA-C-O 125.399 2.523 . . . . 0.0 109.043 158.589 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.58 2.114 0 C-N-CA 128.22 2.608 . . . . 0.0 112.194 -173.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 . . . . . 0 CA--C 1.58 2.129 0 CA-C-O 121.369 0.604 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -71.47 -28.76 64.17 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.289 -1.507 . . . . 0.0 112.739 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.99 -27.42 45.55 Favored Glycine 1 CA--C 1.582 4.223 0 CA-C-O 122.188 0.882 . . . . 0.0 112.323 169.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.0 t -55.46 -31.08 27.08 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.188 0 O-C-N 120.945 -1.326 . . . . 0.0 110.846 156.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.4 t -77.2 -53.57 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 C-N-CA 125.504 1.521 . . . . 0.0 111.114 -177.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.2 mt -67.99 -26.77 66.07 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.223 -1.548 . . . . 0.0 113.412 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 m -72.67 -25.43 61.26 Favored 'General case' 0 CA--C 1.581 2.141 0 O-C-N 120.143 -1.598 . . . . 0.0 114.707 162.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.458 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -66.24 -32.21 57.08 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.265 0 O-C-N 121.721 -0.612 . . . . 0.0 110.163 160.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.77 -33.75 74.42 Favored 'General case' 0 CA--C 1.582 2.209 0 C-N-CA 124.595 1.158 . . . . 0.0 111.579 175.513 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.33 -28.46 53.91 Favored 'General case' 0 CA--C 1.583 2.221 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 157.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.486 ' O ' ' CB ' ' A' ' 20' ' ' SER . 27.5 mt -87.28 -5.14 59.04 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 163.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.1 -18.71 60.2 Favored 'General case' 0 CA--C 1.587 2.382 0 CA-C-O 123.877 1.799 . . . . 0.0 111.291 153.886 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.1 mt -77.15 -36.57 55.14 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 129.118 2.967 . . . . 0.0 113.155 154.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.5 t -38.12 -41.25 0.57 Allowed 'General case' 0 CA--C 1.59 2.493 0 CA-C-O 124.99 2.329 . . . . 0.0 109.475 160.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.405 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.503 2.194 0 C-N-CA 127.357 2.263 . . . . 0.0 112.664 -173.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 . . . . . 0 N--CA 1.501 2.092 0 CA-C-O 121.057 0.456 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -73.22 -26.63 61.22 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.825 -1.172 . . . . 0.0 113.148 167.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.93 -33.61 45.35 Favored Glycine 1 CA--C 1.581 4.2 0 CA-C-O 122.214 0.897 . . . . 0.0 112.548 166.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.9 t -53.21 -32.42 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 O-C-N 120.814 -1.404 . . . . 0.0 111.858 158.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.7 t -76.67 -60.08 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 C-N-CA 125.23 1.412 . . . . 0.0 111.27 -175.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.09 -26.69 64.11 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.076 -1.64 . . . . 0.0 113.528 -178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.8 m -73.15 -23.92 60.52 Favored 'General case' 0 CA--C 1.58 2.108 0 O-C-N 120.122 -1.611 . . . . 0.0 114.545 162.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.461 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -66.34 -32.3 57.46 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.26 0 O-C-N 121.598 -0.688 . . . . 0.0 110.182 160.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.88 -37.51 81.86 Favored 'General case' 0 CA--C 1.581 2.141 0 C-N-CA 124.538 1.135 . . . . 0.0 112.021 175.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.0 -28.21 16.13 Favored 'General case' 0 CA--C 1.585 2.316 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 156.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.477 ' O ' ' CB ' ' A' ' 20' ' ' SER . 29.1 mt -87.47 -8.73 56.1 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 164.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.512 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -70.64 -20.38 62.73 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 124.891 2.282 . . . . 0.0 111.117 155.123 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 38.2 mt -75.52 -40.72 56.66 Favored 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 129.416 3.086 . . . . 0.0 113.286 155.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.91 -38.71 0.32 Allowed 'General case' 0 CA--C 1.59 2.506 0 CA-C-O 125.253 2.454 . . . . 0.0 109.464 160.002 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.58 2.112 0 C-N-CA 127.91 2.484 . . . . 0.0 112.353 -159.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 . . . . . 0 N--CA 1.502 2.163 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -73.05 -24.35 60.69 Favored 'General case' 0 N--CA 1.502 2.152 0 C-N-CA 124.308 1.043 . . . . 0.0 113.609 161.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.97 -37.21 26.16 Favored Glycine 1 CA--C 1.58 4.101 0 O-C-N 121.326 -0.859 . . . . 0.0 113.174 167.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.3 t -48.52 -32.55 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 O-C-N 120.827 -1.396 . . . . 0.0 111.431 157.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.3 t -76.49 -64.5 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 C-N-CA 124.886 1.274 . . . . 0.0 111.121 -175.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mt -70.58 -28.85 65.2 Favored 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 122.942 1.353 . . . . 0.0 113.568 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.0 m -72.91 -24.92 60.89 Favored 'General case' 0 CA--C 1.581 2.149 0 O-C-N 120.174 -1.579 . . . . 0.0 114.523 162.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.466 ' CG1' ' CE ' ' A' ' 18' ' ' LYS . 2.1 t -65.86 -32.46 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.245 0 O-C-N 121.826 -0.546 . . . . 0.0 110.205 160.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -69.67 -34.08 73.47 Favored 'General case' 0 CA--C 1.583 2.237 0 C-N-CA 124.65 1.18 . . . . 0.0 111.515 177.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.47 -28.61 45.7 Favored 'General case' 0 CA--C 1.583 2.222 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 157.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.491 ' O ' ' CB ' ' A' ' 20' ' ' SER . 26.7 mt -86.7 -8.08 57.73 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 116.221 1.934 . . . . 0.0 116.221 163.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.52 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -73.2 -17.32 61.37 Favored 'General case' 0 CA--C 1.588 2.434 0 CA-C-O 124.604 2.145 . . . . 0.0 111.485 154.471 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 33.6 mt -79.02 -36.67 40.76 Favored 'General case' 0 CA--C 1.574 1.888 0 C-N-CA 128.98 2.912 . . . . 0.0 113.078 155.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.491 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.4 t -38.48 -42.28 0.74 Allowed 'General case' 0 CA--C 1.59 2.513 0 CA-C-O 124.946 2.307 . . . . 0.0 109.453 160.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.431 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.501 2.096 0 C-N-CA 127.317 2.247 . . . . 0.0 112.676 -173.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 . . . . . 0 N--CA 1.501 2.103 0 CA-C-O 120.98 0.419 . . . . 0.0 112.054 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -72.97 -27.64 61.93 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.025 -1.047 . . . . 0.0 113.132 165.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.9 -37.57 43.82 Favored Glycine 1 CA--C 1.584 4.406 0 CA-C-O 122.493 1.052 . . . . 0.0 112.123 167.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.0 t -49.74 -31.66 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 C-N-CA 125.19 1.396 . . . . 0.0 111.713 158.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 36.1 t -76.3 -58.21 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 C-N-CA 125.106 1.362 . . . . 0.0 111.07 -176.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.5 mt -68.19 -28.25 67.11 Favored 'General case' 0 N--CA 1.503 2.217 0 CA-C-O 123.11 1.433 . . . . 0.0 113.641 -176.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 m -72.77 -26.73 61.65 Favored 'General case' 0 CA--C 1.582 2.179 0 O-C-N 120.201 -1.562 . . . . 0.0 114.715 162.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.458 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -65.56 -30.96 51.75 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 O-C-N 121.872 -0.517 . . . . 0.0 110.192 160.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -70.02 -35.34 74.25 Favored 'General case' 0 CA--C 1.581 2.166 0 C-N-CA 124.547 1.139 . . . . 0.0 111.551 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.92 -28.91 25.62 Favored 'General case' 0 CA--C 1.584 2.268 0 C-N-CA 124.536 1.134 . . . . 0.0 114.033 156.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.481 ' O ' ' CB ' ' A' ' 20' ' ' SER . 25.9 mt -87.97 -5.29 58.61 Favored 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 163.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.58 -19.21 60.4 Favored 'General case' 0 CA--C 1.587 2.393 0 O-C-N 119.877 -1.764 . . . . 0.0 111.19 154.013 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 35.2 mt -76.3 -37.46 57.43 Favored 'General case' 0 CA--C 1.575 1.929 0 C-N-CA 129.124 2.969 . . . . 0.0 113.245 154.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.481 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -38.12 -41.91 0.62 Allowed 'General case' 0 CA--C 1.589 2.467 0 CA-C-O 124.789 2.233 . . . . 0.0 109.696 160.459 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.4 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.12 0 C-N-CA 127.24 2.216 . . . . 0.0 112.484 -173.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 . . . . . 0 N--CA 1.502 2.139 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -70.14 -29.36 66.26 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.182 -0.949 . . . . 0.0 112.66 157.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.83 -40.73 74.88 Favored Glycine 1 CA--C 1.585 4.433 0 CA-C-O 122.291 0.939 . . . . 0.0 111.893 166.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.0 t -51.83 -30.92 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.257 0 C-N-CA 125.487 1.515 . . . . 0.0 112.117 161.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.8 t -75.9 -57.44 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 C-N-CA 125.011 1.324 . . . . 0.0 111.356 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mt -58.28 -27.64 64.23 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.352 -1.467 . . . . 0.0 114.21 175.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 m -72.91 -27.67 62.01 Favored 'General case' 0 CA--C 1.58 2.127 0 O-C-N 120.045 -1.66 . . . . 0.0 114.911 163.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.474 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -65.08 -30.21 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.273 0 O-C-N 121.736 -0.602 . . . . 0.0 110.18 161.022 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -70.36 -35.05 73.31 Favored 'General case' 0 CA--C 1.582 2.177 0 C-N-CA 124.515 1.126 . . . . 0.0 111.328 176.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.49 -29.01 22.77 Favored 'General case' 0 CA--C 1.584 2.278 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 156.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.487 ' O ' ' CB ' ' A' ' 20' ' ' SER . 23.0 mt -88.29 -5.37 58.38 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 116.172 1.915 . . . . 0.0 116.172 163.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.563 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.91 -17.64 60.54 Favored 'General case' 0 CA--C 1.587 2.385 0 O-C-N 119.765 -1.834 . . . . 0.0 111.287 153.94 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 37.0 mt -77.49 -38.03 49.94 Favored 'General case' 0 CA--C 1.574 1.891 0 C-N-CA 129.163 2.985 . . . . 0.0 113.117 154.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.487 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -37.25 -41.87 0.42 Allowed 'General case' 0 CA--C 1.588 2.419 0 CA-C-O 124.788 2.232 . . . . 0.0 109.662 160.455 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.6 mmm180 . . . . . 0 N--CA 1.501 2.09 0 C-N-CA 127.365 2.266 . . . . 0.0 112.544 -173.581 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 . . . . . 0 N--CA 1.502 2.169 0 CA-C-O 120.929 0.395 . . . . 0.0 111.95 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -72.75 -26.03 61.41 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.799 -1.188 . . . . 0.0 113.162 172.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -83.87 -24.29 49.67 Favored Glycine 1 CA--C 1.582 4.263 0 CA-C-O 122.795 1.22 . . . . 0.0 112.443 167.537 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -61.17 -28.47 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 120.651 -1.499 . . . . 0.0 111.395 156.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.0 t -77.39 -63.08 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 C-N-CA 125.472 1.509 . . . . 0.0 111.456 -178.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.8 mt -61.91 -21.81 65.06 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 119.917 -1.739 . . . . 0.0 113.429 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.4 t -73.73 -29.91 62.52 Favored 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 161.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.541 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -63.18 -30.01 48.65 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.283 0 CA-C-O 119.043 -0.503 . . . . 0.0 109.777 162.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -70.6 -36.3 73.46 Favored 'General case' 0 CA--C 1.581 2.136 0 C-N-CA 124.95 1.3 . . . . 0.0 111.5 173.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.48 -29.16 23.42 Favored 'General case' 0 CA--C 1.584 2.251 0 C-N-CA 124.893 1.277 . . . . 0.0 113.592 155.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.491 ' O ' ' CG ' ' A' ' 21' ' ' ARG . 47.6 mt -90.0 -2.08 58.08 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 164.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.541 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -75.97 -20.61 57.77 Favored 'General case' 0 CA--C 1.589 2.466 0 CA-C-O 124.881 2.277 . . . . 0.0 111.22 153.034 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.3 mt -74.63 -37.43 62.81 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 129.347 3.059 . . . . 0.0 113.166 155.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.475 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.8 t -37.11 -40.06 0.29 Allowed 'General case' 0 CA--C 1.587 2.399 0 CA-C-O 124.672 2.177 . . . . 0.0 109.97 160.365 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.491 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 4.3 mmm-85 . . . . . 0 N--CA 1.502 2.156 0 C-N-CA 126.939 2.096 . . . . 0.0 112.701 -164.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 . . . . . 0 N--CA 1.501 2.096 0 CA-C-O 121.313 0.577 . . . . 0.0 111.544 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -67.68 -37.7 82.7 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.313 -0.867 . . . . 0.0 113.036 163.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.59 -29.49 71.39 Favored Glycine 1 CA--C 1.581 4.192 0 CA-C-O 123.101 1.389 . . . . 0.0 112.211 167.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 t -63.15 -25.72 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 O-C-N 120.752 -1.44 . . . . 0.0 111.937 161.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.4 t -76.8 -39.53 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 CA-C-O 123.275 1.512 . . . . 0.0 110.399 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.7 mt -70.15 -26.45 63.94 Favored 'General case' 0 N--CA 1.502 2.13 0 CA-C-O 124.173 1.94 . . . . 0.0 112.733 176.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -73.01 -27.23 61.66 Favored 'General case' 0 CA--C 1.58 2.123 0 O-C-N 119.916 -1.74 . . . . 0.0 114.378 160.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.487 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -64.94 -30.94 51.84 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.245 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.26 161.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.67 -37.08 79.34 Favored 'General case' 0 CA--C 1.582 2.178 0 C-N-CA 124.522 1.129 . . . . 0.0 111.725 175.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.5 -28.17 19.37 Favored 'General case' 0 CA--C 1.586 2.337 0 C-N-CA 124.696 1.198 . . . . 0.0 114.232 155.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.483 ' O ' ' CB ' ' A' ' 20' ' ' SER . 28.4 mt -87.16 -6.7 58.53 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 163.219 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.562 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -73.85 -16.96 61.12 Favored 'General case' 0 N--CA 1.507 2.417 0 CA-C-O 124.896 2.284 . . . . 0.0 111.365 154.502 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 45.8 mt -77.16 -40.47 45.38 Favored 'General case' 0 CA--C 1.575 1.913 0 C-N-CA 129.711 3.204 . . . . 0.0 112.842 153.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.483 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -39.15 -39.75 0.63 Allowed 'General case' 0 CA--C 1.589 2.472 0 CA-C-O 125.297 2.475 . . . . 0.0 109.508 158.685 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.579 2.087 0 C-N-CA 127.767 2.427 . . . . 0.0 112.369 -160.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 . . . . . 0 N--CA 1.501 2.117 0 CA-C-O 121.126 0.489 . . . . 0.0 111.789 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -69.49 -32.01 70.63 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.861 -1.149 . . . . 0.0 113.078 171.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -72.63 -35.23 59.27 Favored Glycine 1 CA--C 1.587 4.539 0 CA-C-O 122.878 1.265 . . . . 0.0 111.736 168.232 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.2 t -55.55 -28.43 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.252 0 C-N-CA 125.175 1.39 . . . . 0.0 111.76 160.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.0 t -77.03 -53.14 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 C-N-CA 125.11 1.364 . . . . 0.0 110.954 -177.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.4 mt -70.97 -33.85 70.84 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -174.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.9 t -75.18 -20.52 59.28 Favored 'General case' 0 CA--C 1.578 2.023 0 O-C-N 120.373 -1.455 . . . . 0.0 114.42 160.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.537 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -66.29 -29.11 45.61 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.251 0 O-C-N 121.631 -0.668 . . . . 0.0 110.186 157.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.85 -34.94 64.72 Favored 'General case' 0 CA--C 1.583 2.231 0 CA-C-O 122.462 1.125 . . . . 0.0 110.806 175.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.82 -28.83 24.5 Favored 'General case' 0 CA--C 1.584 2.272 0 C-N-CA 125.135 1.374 . . . . 0.0 113.59 154.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.488 ' O ' ' CB ' ' A' ' 20' ' ' SER . 27.0 mt -89.34 -4.04 58.24 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 163.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.49 -18.17 59.91 Favored 'General case' 0 CA--C 1.588 2.435 0 CA-C-O 123.938 1.828 . . . . 0.0 111.286 153.328 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.2 mt -76.62 -37.79 55.8 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 129.269 3.028 . . . . 0.0 113.112 154.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.488 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -37.26 -40.31 0.33 Allowed 'General case' 0 CA--C 1.587 2.397 0 CA-C-O 124.527 2.108 . . . . 0.0 109.768 160.009 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.444 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 2.4 mmt180 . . . . . 0 N--CA 1.502 2.127 0 C-N-CA 127.122 2.169 . . . . 0.0 112.733 -169.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 . . . . . 0 N--CA 1.501 2.099 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.19 -24.49 60.54 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.971 -1.08 . . . . 0.0 113.425 171.998 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.61 -35.41 36.5 Favored Glycine 1 CA--C 1.582 4.27 0 O-C-N 121.187 -0.946 . . . . 0.0 112.762 165.092 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -53.34 -31.97 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.277 0 O-C-N 120.977 -1.308 . . . . 0.0 111.582 159.47 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.9 t -76.91 -63.94 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 125.056 1.343 . . . . 0.0 111.025 -175.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.74 -27.25 63.81 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.727 -1.233 . . . . 0.0 114.03 -177.528 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -74.4 -25.54 59.54 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.513 -1.367 . . . . 0.0 114.614 162.223 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.5 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -63.54 -33.53 62.07 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.287 0 O-C-N 122.002 -0.436 . . . . 0.0 109.944 159.618 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -69.44 -33.99 73.76 Favored 'General case' 0 CA--C 1.583 2.216 0 C-N-CA 124.826 1.25 . . . . 0.0 111.377 174.093 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.45 -28.17 52.69 Favored 'General case' 0 CA--C 1.582 2.201 0 C-N-CA 124.236 1.014 . . . . 0.0 113.702 157.508 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.496 ' O ' ' CG ' ' A' ' 21' ' ' ARG . 44.4 mt -89.79 -2.59 58.27 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 116.295 1.961 . . . . 0.0 116.295 163.597 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.532 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -76.3 -18.67 58.85 Favored 'General case' 0 CA--C 1.587 2.395 0 CA-C-O 124.638 2.161 . . . . 0.0 111.463 153.072 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 33.4 mt -76.61 -36.87 57.21 Favored 'General case' 0 CA--C 1.575 1.907 0 C-N-CA 129.222 3.009 . . . . 0.0 112.996 155.097 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.483 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.3 t -37.43 -38.83 0.26 Allowed 'General case' 0 CA--C 1.587 2.378 0 CA-C-O 124.351 2.024 . . . . 0.0 109.897 160.069 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.496 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.503 2.211 0 C-N-CA 126.599 1.96 . . . . 0.0 112.803 -165.081 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 . . . . . 0 N--CA 1.502 2.135 0 CA-C-O 120.838 0.352 . . . . 0.0 111.902 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -72.92 -28.38 62.42 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 120.729 -1.232 . . . . 0.0 113.263 167.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.15 -35.19 57.48 Favored Glycine 1 CA--C 1.584 4.398 0 CA-C-O 122.697 1.165 . . . . 0.0 112.042 167.816 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -53.79 -33.83 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 C-N-CA 125.288 1.435 . . . . 0.0 111.753 160.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.3 t -76.56 -59.11 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 C-N-CA 125.129 1.372 . . . . 0.0 111.258 -173.316 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mt -67.59 -25.95 66.03 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 120.32 -1.488 . . . . 0.0 113.587 -177.337 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m -72.89 -26.46 61.44 Favored 'General case' 0 CA--C 1.581 2.161 0 O-C-N 120.233 -1.542 . . . . 0.0 114.626 162.269 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.467 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -66.13 -30.06 48.72 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.242 0 O-C-N 121.841 -0.537 . . . . 0.0 110.188 161.381 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -70.23 -37.26 74.96 Favored 'General case' 0 CA--C 1.581 2.144 0 C-N-CA 124.616 1.166 . . . . 0.0 111.859 176.119 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.17 -27.17 8.09 Favored 'General case' 0 CA--C 1.587 2.387 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 156.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.466 ' CA ' ' CB ' ' A' ' 20' ' ' SER . 25.5 mt -89.38 -10.62 45.92 Favored 'General case' 0 N--CA 1.505 2.276 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 164.199 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.524 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.59 -20.2 64.5 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 124.772 2.225 . . . . 0.0 111.218 155.119 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.2 mt -76.17 -42.71 45.62 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 129.123 2.969 . . . . 0.0 113.307 155.237 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.466 ' CB ' ' CA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -37.34 -40.85 0.38 Allowed 'General case' 0 N--CA 1.512 2.626 0 CA-C-O 125.225 2.44 . . . . 0.0 108.802 158.183 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.579 2.089 0 C-N-CA 128.032 2.533 . . . . 0.0 112.128 -176.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 . . . . . 0 N--CA 1.503 2.214 0 CA-C-O 121.422 0.63 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -73.82 -27.72 61.26 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.585 -1.322 . . . . 0.0 113.217 169.497 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.67 -34.69 38.49 Favored Glycine 1 CA--C 1.583 4.29 0 CA-C-O 122.51 1.061 . . . . 0.0 112.2 171.13 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 t -47.07 -35.69 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.152 0 O-C-N 120.823 -1.398 . . . . 0.0 110.959 156.665 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 23.5 t -76.86 -55.65 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 C-N-CA 125.329 1.451 . . . . 0.0 111.004 -173.013 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.3 mt -70.19 -28.37 65.26 Favored 'General case' 0 N--CA 1.502 2.17 0 CA-C-O 123.473 1.606 . . . . 0.0 113.321 -177.031 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.8 m -72.46 -25.58 61.5 Favored 'General case' 0 CA--C 1.582 2.184 0 O-C-N 120.076 -1.64 . . . . 0.0 114.516 163.259 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.446 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -66.34 -32.33 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.255 0 C-N-CA 123.091 0.556 . . . . 0.0 110.25 160.515 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.07 -32.52 72.02 Favored 'General case' 0 CA--C 1.583 2.24 0 C-N-CA 124.526 1.13 . . . . 0.0 111.436 176.136 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.41 -28.4 53.93 Favored 'General case' 0 CA--C 1.584 2.265 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 158.068 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.484 ' O ' ' CB ' ' A' ' 20' ' ' SER . 25.6 mt -88.63 -4.72 58.5 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 116.317 1.969 . . . . 0.0 116.317 163.156 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.25 -18.43 60.1 Favored 'General case' 0 CA--C 1.586 2.356 0 O-C-N 119.913 -1.742 . . . . 0.0 111.283 153.681 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 35.3 mt -77.0 -37.27 55.45 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 129.014 2.926 . . . . 0.0 113.123 154.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.484 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.5 t -36.97 -40.81 0.31 Allowed 'General case' 0 CA--C 1.588 2.426 0 CA-C-O 124.927 2.298 . . . . 0.0 109.786 160.608 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.437 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 6.4 mmm180 . . . . . 0 N--CA 1.502 2.142 0 C-N-CA 127.743 2.417 . . . . 0.0 112.689 -170.677 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 . . . . . 0 N--CA 1.501 2.098 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -73.44 -27.61 61.52 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.136 -0.977 . . . . 0.0 113.418 177.833 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.0 -31.97 41.44 Favored Glycine 1 CA--C 1.584 4.382 0 CA-C-O 122.872 1.262 . . . . 0.0 111.998 165.628 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 t -58.27 -27.7 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 C-N-CA 124.999 1.319 . . . . 0.0 111.779 159.187 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.3 t -76.2 -65.13 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 C-N-CA 125.268 1.427 . . . . 0.0 110.74 -179.632 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.0 mt -68.43 -26.16 65.39 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 123.283 1.516 . . . . 0.0 113.236 -175.757 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -39.56 70.12 Favored 'General case' 0 CA--C 1.583 2.228 0 O-C-N 120.516 -1.365 . . . . 0.0 114.227 162.0 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.516 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -56.47 -29.09 28.06 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.326 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.917 164.359 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -74.05 -34.76 64.17 Favored 'General case' 0 N--CA 1.502 2.172 0 C-N-CA 124.896 1.278 . . . . 0.0 111.241 176.403 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.87 -27.42 12.65 Favored 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 124.596 1.158 . . . . 0.0 114.099 156.454 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.492 ' O ' ' CB ' ' A' ' 20' ' ' SER . 24.0 mt -90.34 -11.79 39.61 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 163.307 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.52 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.48 -16.42 63.88 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-O 124.503 2.096 . . . . 0.0 111.215 155.068 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 41.9 mt -78.89 -43.46 24.88 Favored 'General case' 0 CA--C 1.575 1.941 0 C-N-CA 129.502 3.121 . . . . 0.0 113.154 155.555 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.492 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -35.39 -39.48 0.13 Allowed 'General case' 0 N--CA 1.509 2.482 0 CA-C-O 125.321 2.486 . . . . 0.0 109.506 158.331 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 . . . . . 0 CA--C 1.58 2.103 0 C-N-CA 128.34 2.656 . . . . 0.0 112.262 -157.569 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 . . . . . 0 N--CA 1.502 2.144 0 CA-C-O 121.103 0.478 . . . . 0.0 111.453 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -73.47 -26.36 60.88 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.113 -0.992 . . . . 0.0 113.186 173.95 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.16 -33.52 32.32 Favored Glycine 1 CA--C 1.583 4.295 0 CA-C-O 122.701 1.167 . . . . 0.0 112.203 166.157 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 t -53.38 -28.41 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.248 0 O-C-N 120.788 -1.419 . . . . 0.0 111.675 157.493 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 41.7 t -77.18 -62.94 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 C-N-CA 125.225 1.41 . . . . 0.0 110.956 -179.812 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mt -70.05 -29.26 66.23 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-O 123.074 1.416 . . . . 0.0 113.377 -173.83 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m -72.94 -25.91 61.2 Favored 'General case' 0 CA--C 1.581 2.164 0 O-C-N 120.302 -1.499 . . . . 0.0 114.672 162.618 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.464 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -65.74 -30.48 50.21 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.263 0 O-C-N 121.764 -0.585 . . . . 0.0 110.173 160.466 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -71.95 -34.35 68.95 Favored 'General case' 0 CA--C 1.582 2.197 0 C-N-CA 124.559 1.144 . . . . 0.0 111.399 177.884 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.39 -27.53 16.11 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 157.113 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.474 ' O ' ' CB ' ' A' ' 20' ' ' SER . 30.6 mt -88.22 -13.77 40.2 Favored 'General case' 0 N--CA 1.505 2.284 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 163.255 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.0 -14.55 63.05 Favored 'General case' 0 N--CA 1.512 2.646 0 CA-C-O 124.447 2.07 . . . . 0.0 111.382 155.049 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 48.0 mt -81.83 -43.13 18.69 Favored 'General case' 0 CA--C 1.575 1.905 0 C-N-CA 129.238 3.015 . . . . 0.0 113.086 155.6 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.474 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -35.37 -38.62 0.1 Allowed 'General case' 0 N--CA 1.511 2.617 0 CA-C-O 125.497 2.57 . . . . 0.0 109.225 158.015 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.58 2.115 0 C-N-CA 129.52 3.128 . . . . 0.0 111.756 -162.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 tmm? . . . . . 0 N--CA 1.499 2.018 0 CA-C-O 120.803 0.335 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -163.32 -102.8 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.931 -1.106 . . . . 0.0 112.531 -157.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 35.82 41.5 0.12 Allowed 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 125.381 1.473 . . . . 0.0 114.405 168.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -21.47 88.3 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.222 0 C-N-CA 125.045 1.338 . . . . 0.0 113.71 156.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -120.75 -27.09 5.13 Favored 'General case' 0 N--CA 1.509 2.485 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 164.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.37 7.32 0.46 Allowed 'General case' 0 CA--C 1.583 2.24 0 O-C-N 120.811 -1.18 . . . . 0.0 112.671 153.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -140.8 -2.09 1.37 Allowed 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 126.507 1.923 . . . . 0.0 112.64 170.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.24 -26.65 61.21 Favored 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 124.239 1.015 . . . . 0.0 113.551 169.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.76 -36.37 29.22 Favored Glycine 1 CA--C 1.581 4.173 0 O-C-N 121.061 -1.024 . . . . 0.0 112.535 170.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -47.4 -33.46 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 120.805 -1.409 . . . . 0.0 111.294 156.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.6 t -76.21 -62.13 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 C-N-CA 125.006 1.322 . . . . 0.0 110.911 -174.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.1 mt -70.37 -28.42 65.1 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.598 -1.314 . . . . 0.0 113.583 -175.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 m -72.88 -26.46 61.45 Favored 'General case' 0 CA--C 1.58 2.106 0 O-C-N 120.368 -1.457 . . . . 0.0 114.486 162.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.464 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -65.16 -31.52 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.241 0 O-C-N 121.808 -0.557 . . . . 0.0 110.031 161.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -70.36 -36.93 74.48 Favored 'General case' 0 CA--C 1.581 2.163 0 C-N-CA 124.578 1.151 . . . . 0.0 111.823 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -50.78 -27.66 7.69 Favored 'General case' 0 CA--C 1.587 2.386 0 C-N-CA 124.98 1.312 . . . . 0.0 114.283 156.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.452 ' O ' ' CB ' ' A' ' 20' ' ' SER . 28.6 mt -87.28 -13.27 44.17 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 116.188 1.921 . . . . 0.0 116.188 164.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.56 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -69.9 -13.29 62.18 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 119.856 -1.778 . . . . 0.0 111.593 155.461 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.58 ' O ' ' CG ' ' A' ' 22' ' ' GLN . 29.9 mt -85.51 -36.96 20.19 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 130.6 3.56 . . . . 0.0 113.36 154.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.452 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -38.29 -36.97 0.26 Allowed 'General case' 0 N--CA 1.515 2.776 0 CA-C-O 125.882 2.753 . . . . 0.0 108.424 158.525 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.96 -54.32 3.64 Favored 'General case' 0 CA--C 1.582 2.174 1 C-N-CA 132.626 4.371 . . . . 0.0 111.992 173.129 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.58 ' CG ' ' O ' ' A' ' 19' ' ' LEU . 9.0 mt-30 53.52 -28.04 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.525 1 C-N-CA 132.728 4.411 . . . . 0.0 117.211 -159.629 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 176.5 98.8 0.11 Allowed Pre-proline 0 CA--C 1.584 2.271 0 N-CA-C 116.647 2.091 . . . . 0.0 116.647 -160.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -5.27 66.19 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.255 1 C-N-CA 128.237 5.958 . . . . 0.0 117.922 172.418 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.474 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER 27.64 -157.4 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 127.024 2.13 . . . . 0.0 115.714 179.456 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -29.75 -98.73 0.01 OUTLIER Glycine 0 CA--C 1.572 3.625 0 O-C-N 120.322 -1.486 . . . . 0.0 115.519 164.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.351 0.662 0 O-C-N 120.717 -1.461 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.033 0 CA-C-O 120.741 0.305 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.471 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 4.3 pm0 -120.75 20.37 11.7 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.983 -1.073 . . . . 0.0 112.827 -168.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.471 ' CB ' ' O ' ' A' ' 2' ' ' GLU . 0.0 OUTLIER 142.74 51.69 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 127.321 2.248 . . . . 0.0 113.206 -175.176 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.4 mptt 52.61 59.04 4.76 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.634 -1.291 . . . . 0.0 113.354 157.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.26 -28.56 61.27 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.727 -1.233 . . . . 0.0 113.976 156.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.5 t -68.22 9.72 0.29 Allowed 'General case' 0 CA--C 1.583 2.234 0 O-C-N 120.709 -1.244 . . . . 0.0 112.735 154.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -145.22 21.2 1.56 Allowed 'General case' 0 N--CA 1.501 2.094 0 C-N-CA 126.468 1.907 . . . . 0.0 111.642 166.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -70.09 -30.58 67.83 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.39 -0.819 . . . . 0.0 112.865 157.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.69 -28.07 52.34 Favored Glycine 1 CA--C 1.584 4.355 0 CA-C-O 122.435 1.019 . . . . 0.0 111.79 171.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.1 t -56.67 -29.56 30.06 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 C-N-CA 125.24 1.416 . . . . 0.0 111.705 156.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 18.4 t -76.5 -45.3 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 C-N-CA 124.987 1.315 . . . . 0.0 110.581 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.0 mt -67.88 -27.52 66.74 Favored 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 123.208 1.48 . . . . 0.0 113.546 178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.74 -27.51 62.08 Favored 'General case' 0 CA--C 1.582 2.177 0 O-C-N 120.226 -1.546 . . . . 0.0 114.546 163.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.485 ' CG1' ' CE ' ' A' ' 18' ' ' LYS . 2.2 t -65.35 -31.93 55.99 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 122.87 0.468 . . . . 0.0 110.318 161.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -68.08 -35.66 78.54 Favored 'General case' 0 CA--C 1.581 2.157 0 C-N-CA 124.837 1.255 . . . . 0.0 111.667 175.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.64 -28.5 55.68 Favored 'General case' 0 CA--C 1.584 2.269 0 C-N-CA 124.1 0.96 . . . . 0.0 113.521 156.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.458 ' O ' ' CG ' ' A' ' 21' ' ' ARG . 23.4 mt -89.08 -0.6 57.57 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 164.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.497 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.39 -29.68 61.64 Favored 'General case' 0 CA--C 1.592 2.574 0 CA-C-O 125.8 2.714 . . . . 0.0 110.818 153.734 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 35.2 mt -64.99 -40.12 94.48 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 128.704 2.802 . . . . 0.0 113.882 154.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.2 t -37.67 -43.18 0.61 Allowed 'General case' 0 CA--C 1.589 2.469 0 CA-C-O 124.971 2.319 . . . . 0.0 109.732 161.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.458 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -81.73 -43.28 18.64 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 127.268 2.227 . . . . 0.0 112.596 -168.446 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -38.05 -77.48 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.276 0 CA-C-O 123.087 1.422 . . . . 0.0 111.41 157.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 84.7 p -47.09 92.38 0.05 OUTLIER Pre-proline 0 N--CA 1.502 2.151 0 C-N-CA 124.89 1.276 . . . . 0.0 113.385 173.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -64.54 -144.43 0.01 OUTLIER 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 124.105 3.203 . . . . 0.0 115.16 -174.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.43 ' N ' ' CD1' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -83.15 -177.48 6.77 Favored 'General case' 0 N--CA 1.502 2.16 0 C-N-CA 125.29 1.436 . . . . 0.0 114.043 -158.251 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 28.02 94.02 0.01 OUTLIER Glycine 0 CA--C 1.571 3.575 0 N-CA-C 117.091 1.597 . . . . 0.0 117.091 156.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.553 0 O-C-N 120.83 -1.394 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.499 2.015 0 CA-C-O 120.809 0.338 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 61.95 -136.07 0.52 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.002 -1.061 . . . . 0.0 112.514 -162.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER 61.4 67.39 0.79 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.598 -1.314 . . . . 0.0 113.124 -173.049 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 3' ' ' LEU . 0.2 OUTLIER 114.09 69.58 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 127.498 2.319 . . . . 0.0 112.391 -158.688 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.73 -30.77 26.43 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 156.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.95 5.83 0.6 Allowed 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.464 -1.398 . . . . 0.0 112.931 155.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -143.26 15.97 1.87 Allowed 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 126.064 1.745 . . . . 0.0 112.008 168.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -71.08 -27.83 63.9 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.263 -0.898 . . . . 0.0 113.136 164.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.28 -36.61 30.38 Favored Glycine 1 CA--C 1.584 4.396 0 CA-C-O 122.77 1.205 . . . . 0.0 111.939 169.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.8 t -50.25 -29.99 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 C-N-CA 125.158 1.383 . . . . 0.0 111.751 157.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.5 t -75.83 -61.7 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 C-N-CA 124.747 1.219 . . . . 0.0 111.005 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.0 mt -64.4 -24.9 67.79 Favored 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 123.118 1.437 . . . . 0.0 113.675 -174.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -73.17 -29.01 62.54 Favored 'General case' 0 CA--C 1.579 2.083 0 O-C-N 120.304 -1.498 . . . . 0.0 114.557 162.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.679 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -70.45 -19.32 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.586 2.342 0 CA-C-O 117.124 -1.417 . . . . 0.0 110.935 162.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -73.65 -38.46 64.97 Favored 'General case' 0 CA--C 1.581 2.148 0 O-C-N 124.372 1.045 . . . . 0.0 110.908 167.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -50.78 -28.84 10.11 Favored 'General case' 0 CA--C 1.59 2.51 0 C-N-CA 125.285 1.434 . . . . 0.0 112.465 151.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.539 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -88.94 -5.01 58.28 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 125.641 1.576 . . . . 0.0 114.981 168.131 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.679 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -77.6 -19.13 56.07 Favored 'General case' 0 CA--C 1.588 2.405 0 CA-C-O 124.683 2.182 . . . . 0.0 111.708 153.263 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.3 mt -76.08 -32.3 59.18 Favored 'General case' 0 CA--C 1.575 1.923 0 C-N-CA 129.073 2.949 . . . . 0.0 112.581 154.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -40.33 -40.73 1.22 Allowed 'General case' 0 N--CA 1.507 2.401 0 CA-C-O 124.563 2.125 . . . . 0.0 110.179 160.037 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.46 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -96.17 -53.99 3.45 Favored 'General case' 0 N--CA 1.502 2.132 0 C-N-CA 127.176 2.19 . . . . 0.0 112.527 -160.47 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -37.43 -81.25 0.01 OUTLIER 'General case' 0 CA--C 1.582 2.194 0 C-N-CA 124.345 1.058 . . . . 0.0 112.175 161.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t 13.97 98.82 0.02 OUTLIER Pre-proline 0 CA--C 1.581 2.17 0 C-N-CA 126.61 1.964 . . . . 0.0 114.96 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -62.11 -142.34 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.586 0 C-N-CA 124.535 3.49 . . . . 0.0 115.124 -176.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -83.96 24.6 0.9 Allowed 'General case' 0 CA--C 1.602 2.953 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -156.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -37.83 -59.39 1.38 Allowed Glycine 0 CA--C 1.577 3.957 0 CA-C-N 114.12 -1.4 . . . . 0.0 113.737 174.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.59 0 O-C-N 121.148 -1.207 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 120.65 0.262 . . . . 0.0 111.303 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -125.71 -156.56 0.74 Allowed 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.003 -1.06 . . . . 0.0 113.048 -178.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.7 mt -49.44 -4.23 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 125.426 1.49 . . . . 0.0 114.76 173.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp 91.43 66.64 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 125.382 1.473 . . . . 0.0 112.277 175.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -75.46 -28.86 59.44 Favored 'General case' 0 N--CA 1.504 2.256 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 159.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.7 m -68.42 7.31 0.63 Allowed 'General case' 0 CA--C 1.582 2.182 0 O-C-N 120.511 -1.368 . . . . 0.0 113.021 154.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -142.35 14.43 2.01 Favored 'General case' 0 N--CA 1.502 2.161 0 C-N-CA 126.694 1.998 . . . . 0.0 111.865 171.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -73.35 -29.3 62.57 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.93 -1.106 . . . . 0.0 113.028 170.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.55 -35.06 37.78 Favored Glycine 1 CA--C 1.584 4.385 0 CA-C-O 122.763 1.202 . . . . 0.0 111.925 170.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -49.05 -32.41 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 C-N-CA 125.306 1.442 . . . . 0.0 111.441 157.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.6 t -76.55 -58.26 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 C-N-CA 124.839 1.256 . . . . 0.0 110.971 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.2 mt -59.79 -28.4 67.4 Favored 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 125.274 1.43 . . . . 0.0 114.196 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.75 -27.53 62.08 Favored 'General case' 0 CA--C 1.582 2.179 0 O-C-N 120.378 -1.451 . . . . 0.0 114.664 163.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.657 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -70.62 -20.56 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.25 0 CA-C-O 117.487 -1.244 . . . . 0.0 111.164 161.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -74.96 -38.66 61.64 Favored 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 124.448 1.099 . . . . 0.0 111.398 171.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.41 -27.98 18.02 Favored 'General case' 0 CA--C 1.59 2.507 0 C-N-CA 124.902 1.281 . . . . 0.0 112.403 152.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.539 ' N ' ' CD1' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -86.71 -6.57 58.8 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 125.941 1.696 . . . . 0.0 114.623 167.413 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.657 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -77.39 -19.03 56.79 Favored 'General case' 0 CA--C 1.586 2.355 0 CA-C-O 124.445 2.069 . . . . 0.0 111.863 153.467 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 37.9 mt -77.2 -30.95 54.98 Favored 'General case' 0 CA--C 1.575 1.909 0 C-N-CA 128.721 2.808 . . . . 0.0 112.629 154.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -40.91 -39.31 1.12 Allowed 'General case' 0 CA--C 1.59 2.49 0 CA-C-O 124.783 2.23 . . . . 0.0 109.861 159.822 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -94.82 -54.41 3.49 Favored 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 127.603 2.361 . . . . 0.0 112.498 -163.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -42.14 -83.39 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.163 0 C-N-CA 124.37 1.068 . . . . 0.0 112.131 164.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.3 t -30.83 111.95 0.3 Allowed Pre-proline 0 CA--C 1.58 2.134 0 C-N-CA 125.694 1.598 . . . . 0.0 114.265 -172.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -1.41 61.3 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.231 1 C-N-CA 128.006 5.804 . . . . 0.0 117.857 177.812 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.463 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER 23.82 -161.43 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 127.051 2.14 . . . . 0.0 115.43 -166.739 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.08 107.53 3.26 Favored Glycine 0 CA--C 1.575 3.84 0 O-C-N 120.243 -1.536 . . . . 0.0 114.179 171.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.59 0 O-C-N 121.006 -1.29 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.0 0 CA-C-O 120.675 0.274 . . . . 0.0 111.342 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -120.2 61.26 0.86 Allowed 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.962 -1.087 . . . . 0.0 112.723 159.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -62.76 21.18 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.394 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.531 ' CB ' ' CB ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 84.31 97.18 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 119.754 -1.841 . . . . 0.0 112.502 167.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.39 -29.77 20.0 Favored 'General case' 0 N--CA 1.506 2.344 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 160.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.3 m -69.17 7.95 0.66 Allowed 'General case' 0 CA--C 1.582 2.174 0 O-C-N 120.475 -1.391 . . . . 0.0 112.98 154.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.531 ' CB ' ' CB ' ' A' ' 4' ' ' LYS . 7.5 mt-10 -147.59 12.61 1.03 Allowed 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 126.46 1.904 . . . . 0.0 111.874 174.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -73.68 -26.82 60.91 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.933 -1.104 . . . . 0.0 113.219 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.09 -34.62 32.82 Favored Glycine 1 CA--C 1.582 4.249 0 CA-C-O 122.303 0.946 . . . . 0.0 112.504 165.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.0 t -51.74 -31.63 13.28 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 O-C-N 120.884 -1.362 . . . . 0.0 111.422 158.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 41.5 t -77.09 -63.89 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 C-N-CA 125.152 1.381 . . . . 0.0 110.846 -176.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.18 -29.94 66.94 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 123.51 1.624 . . . . 0.0 113.601 -175.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 m -73.19 -24.77 60.58 Favored 'General case' 0 CA--C 1.581 2.153 0 O-C-N 119.739 -1.851 . . . . 0.0 114.422 162.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.469 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -66.37 -30.39 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.239 0 O-C-N 121.794 -0.566 . . . . 0.0 110.283 160.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -69.95 -35.34 74.43 Favored 'General case' 0 CA--C 1.581 2.17 0 C-N-CA 124.291 1.037 . . . . 0.0 111.55 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.03 -28.49 17.36 Favored 'General case' 0 CA--C 1.585 2.3 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 156.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.489 ' O ' ' CB ' ' A' ' 20' ' ' SER . 26.7 mt -88.16 -8.81 54.83 Favored 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 163.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.515 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.0 -18.47 62.6 Favored 'General case' 0 N--CA 1.508 2.452 0 CA-C-O 124.894 2.283 . . . . 0.0 111.268 154.654 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 42.9 mt -76.46 -41.34 47.67 Favored 'General case' 0 CA--C 1.575 1.932 0 C-N-CA 129.498 3.119 . . . . 0.0 113.124 154.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.86 -40.67 0.47 Allowed 'General case' 0 CA--C 1.59 2.498 0 CA-C-O 125.315 2.483 . . . . 0.0 109.343 158.786 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.18 -45.23 13.16 Favored 'General case' 0 CA--C 1.579 2.079 0 C-N-CA 128.032 2.533 . . . . 0.0 112.508 -168.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -54.32 -80.09 0.02 OUTLIER 'General case' 0 CA--C 1.581 2.137 0 C-N-CA 125.548 1.539 . . . . 0.0 112.414 166.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.9 t -26.07 93.31 0.05 OUTLIER Pre-proline 0 CA--C 1.581 2.137 0 C-N-CA 125.28 1.432 . . . . 0.0 113.449 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -6.72 61.76 0.0 OUTLIER 'Trans proline' 0 CA--C 1.57 2.303 1 C-N-CA 127.764 5.643 . . . . 0.0 118.207 -175.721 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.452 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER 26.4 -157.47 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 127.977 2.511 . . . . 0.0 116.57 173.749 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.8 -131.23 3.05 Favored Glycine 0 CA--C 1.576 3.847 0 O-C-N 119.961 -1.712 . . . . 0.0 114.056 165.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.624 0 O-C-N 121.014 -1.286 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.018 0 CA-C-O 120.844 0.354 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -11.84 61.17 Favored 'General case' 0 N--CA 1.501 2.093 0 C-N-CA 124.196 0.998 . . . . 0.0 112.72 -172.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 57.41 14.33 2.16 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 124.453 1.101 . . . . 0.0 113.621 -164.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 39.98 67.34 0.49 Allowed 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 124.863 1.265 . . . . 0.0 113.732 163.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -82.13 -30.94 30.84 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 161.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.3 t -68.87 6.66 0.83 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.324 -1.485 . . . . 0.0 113.316 155.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -144.25 16.5 1.7 Allowed 'General case' 0 N--CA 1.502 2.161 0 C-N-CA 126.131 1.772 . . . . 0.0 111.829 172.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -73.28 -27.5 61.6 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.811 -1.181 . . . . 0.0 113.205 177.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.79 -38.03 28.46 Favored Glycine 1 CA--C 1.582 4.257 0 CA-C-O 122.71 1.172 . . . . 0.0 112.371 166.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 t -48.31 -31.09 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 120.732 -1.452 . . . . 0.0 111.298 158.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 42.3 t -77.07 -66.08 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 C-N-CA 125.08 1.352 . . . . 0.0 110.915 -178.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.4 mt -66.26 -28.47 68.74 Favored 'General case' 0 N--CA 1.503 2.206 0 CA-C-O 122.759 1.266 . . . . 0.0 113.588 -173.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.2 m -72.67 -24.97 61.1 Favored 'General case' 0 CA--C 1.582 2.174 0 O-C-N 120.334 -1.479 . . . . 0.0 114.366 162.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.65 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -72.39 -20.2 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.263 0 CA-C-O 117.38 -1.295 . . . . 0.0 111.088 161.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -74.92 -38.74 61.72 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 124.316 1.01 . . . . 0.0 111.363 170.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.78 -27.3 11.76 Favored 'General case' 0 CA--C 1.59 2.512 0 C-N-CA 125.072 1.349 . . . . 0.0 112.528 151.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.535 ' N ' ' CD1' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -87.86 -7.64 56.94 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 125.836 1.654 . . . . 0.0 114.814 167.007 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.65 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -76.09 -17.77 59.47 Favored 'General case' 0 CA--C 1.588 2.417 0 O-C-N 118.88 -2.387 . . . . 0.0 111.739 153.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 37.8 mt -78.43 -33.89 48.29 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 129.102 2.961 . . . . 0.0 112.744 154.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -39.72 -38.62 0.66 Allowed 'General case' 0 CA--C 1.591 2.54 0 CA-C-O 125.643 2.64 . . . . 0.0 109.591 158.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.5 -44.69 6.07 Favored 'General case' 0 CA--C 1.58 2.12 0 C-N-CA 128.731 2.812 . . . . 0.0 112.206 -156.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -58.92 -92.83 0.0 OUTLIER 'General case' 0 CA--C 1.578 2.046 0 C-N-CA 126.073 1.749 . . . . 0.0 112.539 177.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -31.73 94.74 0.07 OUTLIER Pre-proline 0 CA--C 1.581 2.166 0 C-N-CA 125.976 1.71 . . . . 0.0 114.665 -159.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -7.16 69.39 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.268 1 C-N-CA 127.464 5.443 . . . . 0.0 117.442 174.378 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.446 ' N ' ' CD1' ' A' ' 25' ' ' LEU . 2.3 mp 48.82 126.85 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 155.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.07 -147.35 0.65 Allowed Glycine 0 CA--C 1.575 3.841 0 O-C-N 119.188 -2.195 . . . . 0.0 114.114 -164.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.578 0 O-C-N 120.937 -1.331 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.035 0 CA-C-O 120.861 0.362 . . . . 0.0 111.302 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 68.27 46.1 1.14 Allowed 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 124.283 1.033 . . . . 0.0 112.891 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 70.57 -2.33 2.25 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.967 -1.083 . . . . 0.0 113.493 168.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp 40.15 72.05 0.16 Allowed 'General case' 0 N--CA 1.504 2.254 0 C-N-CA 124.847 1.259 . . . . 0.0 113.663 169.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.56 -26.52 14.77 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 157.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.4 m -66.52 7.34 0.34 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.875 -1.141 . . . . 0.0 112.402 154.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -145.5 2.12 0.95 Allowed 'General case' 0 N--CA 1.501 2.125 0 C-N-CA 125.633 1.573 . . . . 0.0 113.105 168.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -73.33 -34.82 65.86 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.701 -1.249 . . . . 0.0 113.398 157.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.07 -41.82 98.36 Favored Glycine 1 CA--C 1.585 4.458 0 CA-C-O 122.414 1.008 . . . . 0.0 112.322 172.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.5 t -42.26 -37.67 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.25 0 C-N-CA 125.2 1.4 . . . . 0.0 111.243 159.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.2 t -76.82 -50.39 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 C-N-CA 125.439 1.496 . . . . 0.0 110.737 -172.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.8 mt -70.07 -19.71 63.26 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 120.408 -1.432 . . . . 0.0 113.081 -175.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -30.04 63.23 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 162.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.668 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -67.43 -26.76 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.322 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.619 162.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -70.39 -37.96 74.59 Favored 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 124.291 1.036 . . . . 0.0 111.553 169.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.5 -26.8 22.3 Favored 'General case' 0 CA--C 1.588 2.438 0 CA-C-O 122.847 1.308 . . . . 0.0 112.496 153.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.549 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -88.02 -6.67 57.85 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 126.883 2.073 . . . . 0.0 114.654 167.634 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.668 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -79.24 -20.32 48.49 Favored 'General case' 0 CA--C 1.584 2.264 0 O-C-N 119.552 -1.967 . . . . 0.0 112.014 154.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 28.8 mt -77.33 -29.38 53.48 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 128.632 2.773 . . . . 0.0 112.681 155.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.549 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.17 -37.97 0.19 Allowed 'General case' 0 CA--C 1.59 2.487 0 CA-C-O 125.289 2.471 . . . . 0.0 109.65 157.597 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.58 -55.82 2.37 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 128.014 2.525 . . . . 0.0 112.359 -158.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -47.61 -37.45 12.6 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 125.383 1.473 . . . . 0.0 112.844 176.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.6 t 35.52 79.69 0.29 Allowed Pre-proline 0 CA--C 1.582 2.199 0 CA-C-O 117.556 -1.211 . . . . 0.0 113.948 177.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -7.32 70.94 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.268 1 C-N-CA 127.409 5.406 . . . . 0.0 117.52 175.837 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.476 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -28.0 149.75 0.0 OUTLIER 'General case' 0 CA--C 1.577 2.019 0 C-N-CA 124.808 1.243 . . . . 0.0 113.676 168.843 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 82.57 101.6 0.47 Allowed Glycine 0 CA--C 1.575 3.803 0 O-C-N 120.956 -1.09 . . . . 0.0 113.936 170.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.581 0 O-C-N 120.98 -1.306 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.577 2.0 0 CA-C-O 120.705 0.288 . . . . 0.0 111.277 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 75.23 85.94 0.09 Allowed 'General case' 0 N--CA 1.501 2.116 0 C-N-CA 124.155 0.982 . . . . 0.0 112.87 -171.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 152.14 -79.01 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 126.34 1.856 . . . . 0.0 113.0 -168.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 25.05 50.4 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 125.747 1.619 . . . . 0.0 114.4 -177.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -82.53 -31.53 29.11 Favored 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 159.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.54 9.53 0.34 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.256 -1.528 . . . . 0.0 113.035 155.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -142.93 12.67 1.85 Allowed 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 125.953 1.701 . . . . 0.0 112.098 167.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -72.36 -25.3 61.48 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 124.107 0.963 . . . . 0.0 113.166 170.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.09 -36.25 25.15 Favored Glycine 1 CA--C 1.581 4.206 0 CA-C-O 122.212 0.895 . . . . 0.0 112.444 166.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 t -51.13 -29.39 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 O-C-N 120.827 -1.396 . . . . 0.0 111.712 157.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.4 t -76.16 -64.47 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 C-N-CA 125.056 1.342 . . . . 0.0 110.93 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.4 mt -70.29 -29.4 66.15 Favored 'General case' 0 N--CA 1.502 2.152 0 CA-C-O 122.934 1.35 . . . . 0.0 113.515 -174.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.7 m -73.0 -26.48 61.34 Favored 'General case' 0 CA--C 1.58 2.134 0 O-C-N 120.338 -1.476 . . . . 0.0 114.538 162.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.472 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -65.19 -30.16 49.46 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.259 0 O-C-N 121.759 -0.588 . . . . 0.0 110.192 160.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -71.91 -35.8 69.79 Favored 'General case' 0 CA--C 1.582 2.174 0 C-N-CA 124.589 1.155 . . . . 0.0 111.548 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.17 -28.4 18.03 Favored 'General case' 0 CA--C 1.585 2.296 0 C-N-CA 124.765 1.226 . . . . 0.0 113.823 155.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.476 ' O ' ' CB ' ' A' ' 20' ' ' SER . 27.7 mt -86.27 -11.29 52.7 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 163.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.574 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.08 -14.95 62.49 Favored 'General case' 0 N--CA 1.508 2.473 0 CA-C-O 124.317 2.008 . . . . 0.0 111.606 154.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.9 mt -81.15 -39.06 26.12 Favored 'General case' 0 CA--C 1.574 1.9 0 C-N-CA 128.857 2.863 . . . . 0.0 113.079 154.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -37.02 -39.91 0.26 Allowed 'General case' 0 CA--C 1.59 2.496 0 CA-C-O 124.806 2.241 . . . . 0.0 109.261 161.022 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -83.23 -48.32 10.6 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 127.327 2.251 . . . . 0.0 112.349 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -74.34 -95.42 0.02 OUTLIER 'General case' 0 CA--C 1.576 1.98 0 C-N-CA 126.069 1.748 . . . . 0.0 113.154 168.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.4 p 4.25 110.18 0.0 OUTLIER Pre-proline 0 CA--C 1.581 2.156 0 C-N-CA 128.114 2.566 . . . . 0.0 115.545 -167.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -59.34 -143.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.577 2.66 0 C-N-CA 124.927 3.751 . . . . 0.0 115.076 174.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.421 ' N ' ' CD1' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -80.18 156.07 27.11 Favored 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 125.303 1.441 . . . . 0.0 114.279 -156.641 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 43.42 78.58 0.07 OUTLIER Glycine 0 CA--C 1.575 3.831 0 O-C-N 120.821 -1.174 . . . . 0.0 113.884 -171.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.603 0 O-C-N 121.019 -1.283 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 120.8 0.333 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -117.83 41.75 2.8 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.035 -1.04 . . . . 0.0 112.828 171.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -47.34 -59.45 3.19 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.039 -1.038 . . . . 0.0 112.881 -168.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -54.76 -19.8 7.1 Favored 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 176.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.81 -30.16 61.32 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 119.877 -1.765 . . . . 0.0 113.789 159.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 t -68.89 13.2 0.11 Allowed 'General case' 0 CA--C 1.584 2.264 0 O-C-N 120.93 -1.106 . . . . 0.0 112.747 153.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -136.64 1.32 2.56 Favored 'General case' 0 N--CA 1.502 2.154 0 C-N-CA 126.187 1.795 . . . . 0.0 112.586 164.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -73.2 -24.42 60.52 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.416 1.086 . . . . 0.0 113.087 175.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.43 -35.48 22.99 Favored Glycine 1 CA--C 1.579 4.046 0 O-C-N 121.513 -0.742 . . . . 0.0 113.057 165.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -49.81 -30.94 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 O-C-N 120.851 -1.382 . . . . 0.0 111.197 157.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.7 t -77.07 -67.18 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 C-N-CA 125.25 1.42 . . . . 0.0 110.924 -177.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.1 mt -70.18 -27.69 64.72 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-O 123.227 1.489 . . . . 0.0 113.344 -174.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.8 m -72.94 -24.16 60.77 Favored 'General case' 0 CA--C 1.581 2.136 0 O-C-N 120.169 -1.582 . . . . 0.0 114.401 161.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.656 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -70.56 -23.59 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.276 0 CA-C-O 117.233 -1.365 . . . . 0.0 110.868 160.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.92 -39.62 66.13 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 124.485 1.116 . . . . 0.0 111.535 172.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.66 -27.94 19.47 Favored 'General case' 0 CA--C 1.59 2.5 0 C-N-CA 124.781 1.232 . . . . 0.0 112.454 152.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.505 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.19 -6.08 59.06 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 125.719 1.608 . . . . 0.0 115.151 166.275 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.656 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.1 OUTLIER -77.12 -17.45 58.64 Favored 'General case' 0 CA--C 1.588 2.407 0 CA-C-O 124.519 2.104 . . . . 0.0 111.819 152.661 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 38.4 mt -78.38 -32.02 48.68 Favored 'General case' 0 CA--C 1.574 1.894 0 C-N-CA 128.692 2.797 . . . . 0.0 112.593 154.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -41.01 -39.87 1.29 Allowed 'General case' 0 CA--C 1.59 2.481 0 CA-C-O 124.7 2.19 . . . . 0.0 109.957 160.499 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.437 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -94.52 -55.44 3.15 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 127.466 2.307 . . . . 0.0 112.557 -164.107 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -42.33 -86.95 0.0 OUTLIER 'General case' 0 CA--C 1.578 2.053 0 CA-C-O 123.342 1.544 . . . . 0.0 112.394 165.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.18 159.54 21.27 Favored Pre-proline 0 CA--C 1.587 2.369 0 C-N-CA 126.1 1.76 . . . . 0.0 115.356 -178.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -71.67 48.71 1.08 Allowed 'Trans proline' 0 CA--C 1.575 2.537 1 C-N-CA 126.187 4.591 . . . . 0.0 118.323 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.521 ' N ' ' CD1' ' A' ' 25' ' ' LEU . 2.1 mp 54.91 -169.4 0.07 Allowed 'General case' 0 N--CA 1.505 2.313 0 O-C-N 119.247 -2.158 . . . . 0.0 114.33 155.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.67 -141.08 34.38 Favored Glycine 0 CA--C 1.575 3.793 0 O-C-N 120.734 -1.229 . . . . 0.0 114.166 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.587 0 O-C-N 120.901 -1.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 120.58 0.229 . . . . 0.0 111.218 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -158.6 108.77 2.05 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.02 -1.05 . . . . 0.0 113.177 -176.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.431 ' O ' ' CB ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -41.19 -39.54 1.34 Allowed 'General case' 0 N--CA 1.504 2.234 0 C-N-CA 125.104 1.362 . . . . 0.0 114.284 179.27 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 85.76 45.85 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 125.813 1.645 . . . . 0.0 113.064 -156.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.19 -30.07 54.64 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 157.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.0 t -68.5 11.93 0.15 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.325 -1.484 . . . . 0.0 113.02 155.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -142.17 10.16 1.91 Allowed 'General case' 0 N--CA 1.503 2.212 0 C-N-CA 125.847 1.659 . . . . 0.0 112.187 164.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -72.97 -25.95 61.19 Favored 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 124.221 1.008 . . . . 0.0 113.25 170.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.25 -35.94 32.41 Favored Glycine 1 CA--C 1.582 4.279 0 CA-C-O 122.484 1.047 . . . . 0.0 112.439 166.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -51.99 -31.12 13.48 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.904 -1.35 . . . . 0.0 111.93 158.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 41.6 t -75.9 -62.64 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 C-N-CA 125.103 1.361 . . . . 0.0 111.061 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.5 mt -70.6 -27.2 63.91 Favored 'General case' 0 N--CA 1.502 2.161 0 CA-C-O 122.801 1.286 . . . . 0.0 113.493 -174.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.4 t -73.39 -30.44 63.27 Favored 'General case' 0 CA--C 1.579 2.073 0 O-C-N 120.507 -1.371 . . . . 0.0 114.643 162.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.498 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -61.16 -32.11 51.94 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.29 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 161.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -71.57 -31.73 67.3 Favored 'General case' 0 CA--C 1.582 2.21 0 C-N-CA 125.007 1.323 . . . . 0.0 111.101 174.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.08 -25.7 59.17 Favored 'General case' 0 CA--C 1.581 2.16 0 C-N-CA 124.67 1.188 . . . . 0.0 113.59 156.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.422 ' CA ' ' CB ' ' A' ' 20' ' ' SER . 23.9 mt -91.36 -4.68 55.51 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 117.363 2.357 . . . . 0.0 117.363 163.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.519 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.34 -26.88 58.94 Favored 'General case' 0 CA--C 1.587 2.39 0 CA-C-O 124.674 2.178 . . . . 0.0 111.418 154.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -18.11 50.45 Favored 'General case' 0 CA--C 1.586 2.357 0 C-N-CA 129.691 3.196 . . . . 0.0 112.595 157.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.422 ' CB ' ' CA ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -52.36 -43.31 64.59 Favored 'General case' 0 CA--C 1.592 2.565 0 CA-C-O 125.425 2.536 . . . . 0.0 109.651 156.322 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.408 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -80.11 -60.16 2.44 Favored 'General case' 0 CA--C 1.58 2.108 0 C-N-CA 128.101 2.561 . . . . 0.0 112.0 -168.422 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -45.03 -86.28 0.0 OUTLIER 'General case' 0 CA--C 1.577 2.007 0 CA-C-N 114.204 -1.362 . . . . 0.0 112.441 168.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -37.83 104.83 0.3 Allowed Pre-proline 0 N--CA 1.502 2.128 0 C-N-CA 125.555 1.542 . . . . 0.0 114.096 -170.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -7.45 73.03 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.249 1 C-N-CA 127.322 5.348 . . . . 0.0 117.165 174.657 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.466 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -24.06 133.09 0.02 OUTLIER 'General case' 0 CA--C 1.577 1.982 0 C-N-CA 124.684 1.194 . . . . 0.0 113.465 165.228 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.75 94.17 0.07 OUTLIER Glycine 0 CA--C 1.575 3.801 0 O-C-N 121.141 -0.974 . . . . 0.0 113.911 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.613 0 O-C-N 120.955 -1.321 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 ttt . . . . . 0 N--CA 1.499 2.017 0 N-CA-C 111.1 0.037 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 72.19 140.67 0.06 Allowed 'General case' 0 N--CA 1.503 2.221 0 O-C-N 120.656 -1.277 . . . . 0.0 113.095 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.61 -6.82 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 124.958 1.303 . . . . 0.0 114.181 166.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 75.61 82.42 0.1 Allowed 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.078 -1.639 . . . . 0.0 112.955 164.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -94.03 -31.22 14.32 Favored 'General case' 0 N--CA 1.505 2.31 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 157.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 t -67.92 7.05 0.58 Allowed 'General case' 0 N--CA 1.503 2.217 0 O-C-N 120.399 -1.438 . . . . 0.0 112.985 155.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -148.43 15.55 1.01 Allowed 'General case' 0 N--CA 1.501 2.1 0 C-N-CA 125.994 1.718 . . . . 0.0 111.987 167.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -73.06 -23.77 60.61 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.111 -0.993 . . . . 0.0 113.144 164.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.21 -38.62 25.37 Favored Glycine 1 CA--C 1.581 4.192 0 O-C-N 121.357 -0.839 . . . . 0.0 112.799 163.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.5 t -50.03 -29.47 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.334 0 O-C-N 120.852 -1.381 . . . . 0.0 111.742 158.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 42.0 t -76.09 -68.32 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 C-N-CA 125.035 1.334 . . . . 0.0 111.26 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.9 mt -68.65 -27.27 65.85 Favored 'General case' 0 N--CA 1.503 2.218 0 CA-C-O 123.642 1.687 . . . . 0.0 113.432 -173.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.5 m -72.48 -25.0 61.26 Favored 'General case' 0 CA--C 1.581 2.144 0 O-C-N 119.902 -1.749 . . . . 0.0 114.192 161.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.657 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -71.99 -20.22 20.24 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.3 0 CA-C-O 117.132 -1.413 . . . . 0.0 111.203 161.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -74.05 -39.76 63.28 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 124.423 1.077 . . . . 0.0 111.547 170.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.26 -25.4 14.33 Favored 'General case' 0 CA--C 1.59 2.507 0 C-N-CA 125.18 1.392 . . . . 0.0 113.059 152.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.465 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.5 -10.34 54.31 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 164.559 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.657 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -74.52 -13.78 60.72 Favored 'General case' 0 CA--C 1.587 2.391 0 O-C-N 119.461 -2.024 . . . . 0.0 111.695 154.299 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.5 ' O ' ' CG ' ' A' ' 22' ' ' GLN . 33.2 mt -84.27 -33.95 23.9 Favored 'General case' 0 CA--C 1.573 1.858 0 C-N-CA 129.519 3.128 . . . . 0.0 112.922 154.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -41.38 -38.97 1.33 Allowed 'General case' 0 CA--C 1.602 2.954 0 CA-C-O 126.762 3.172 . . . . 0.0 108.075 156.624 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.56 -35.19 11.74 Favored 'General case' 0 CA--C 1.588 2.408 1 C-N-CA 134.502 5.121 . . . . 0.0 110.898 -177.447 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.5 ' CG ' ' O ' ' A' ' 19' ' ' LEU . 51.6 mt-30 31.31 105.02 0.0 OUTLIER 'General case' 0 CA--C 1.573 1.842 0 C-N-CA 129.466 3.106 . . . . 0.0 112.917 -155.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 16.15 97.21 0.03 OUTLIER Pre-proline 0 CA--C 1.582 2.178 0 C-N-CA 128.302 2.641 . . . . 0.0 115.638 164.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -9.66 75.25 0.0 OUTLIER 'Trans proline' 0 CA--C 1.57 2.278 1 C-N-CA 127.557 5.505 . . . . 0.0 116.78 172.0 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.489 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -11.28 125.17 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 C-N-CA 126.174 1.789 . . . . 0.0 114.344 165.372 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.95 -94.55 0.01 OUTLIER Glycine 0 CA--C 1.576 3.851 0 O-C-N 120.953 -1.092 . . . . 0.0 113.857 -166.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.529 0 O-C-N 121.098 -1.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 119.462 -0.304 . . . . 0.0 110.997 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -155.87 46.69 0.48 Allowed 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.266 -1.521 . . . . 0.0 113.253 171.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mt -42.6 -66.05 0.4 Allowed 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.515 -1.365 . . . . 0.0 112.79 159.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.757 ' CB ' ' CB ' ' A' ' 7' ' ' GLU . 0.7 OUTLIER 60.93 150.36 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 125.015 1.326 . . . . 0.0 113.177 177.949 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -92.38 -30.77 15.62 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.575 -1.328 . . . . 0.0 114.12 162.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.1 m -68.99 10.52 0.28 Allowed 'General case' 0 CA--C 1.585 2.322 0 O-C-N 120.419 -1.425 . . . . 0.0 112.543 151.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.757 ' CB ' ' CB ' ' A' ' 4' ' ' LYS . 4.9 mt-10 -147.87 9.87 0.9 Allowed 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 127.57 2.348 . . . . 0.0 111.867 176.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -72.65 -30.58 64.41 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.26 1.024 . . . . 0.0 112.819 169.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.34 -23.54 58.52 Favored Glycine 1 CA--C 1.583 4.296 0 CA-C-O 122.139 0.855 . . . . 0.0 112.237 170.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 t -60.83 -29.77 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.188 0 C-N-CA 125.073 1.349 . . . . 0.0 111.444 156.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.8 t -76.67 -47.87 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 CA-C-O 123.39 1.567 . . . . 0.0 110.781 -177.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.01 -24.72 64.24 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 119.979 -1.701 . . . . 0.0 113.228 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.7 m -73.04 -24.85 60.76 Favored 'General case' 0 CA--C 1.58 2.116 0 O-C-N 120.121 -1.612 . . . . 0.0 114.558 162.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.454 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -66.42 -33.41 63.27 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.266 0 O-C-N 121.658 -0.651 . . . . 0.0 110.202 160.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.81 -36.93 84.89 Favored 'General case' 0 CA--C 1.58 2.126 0 C-N-CA 124.488 1.115 . . . . 0.0 112.073 174.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.37 -28.14 18.38 Favored 'General case' 0 CA--C 1.586 2.338 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 157.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.484 ' O ' ' CB ' ' A' ' 20' ' ' SER . 26.9 mt -87.79 -8.41 55.99 Favored 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 163.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.533 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.16 -18.84 62.48 Favored 'General case' 0 N--CA 1.509 2.51 0 CA-C-O 124.814 2.245 . . . . 0.0 111.241 154.764 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 42.3 mt -76.13 -41.68 49.32 Favored 'General case' 0 CA--C 1.574 1.89 0 C-N-CA 129.502 3.121 . . . . 0.0 113.099 154.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.484 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.94 -41.47 0.55 Allowed 'General case' 0 N--CA 1.51 2.557 0 CA-C-O 125.399 2.523 . . . . 0.0 109.043 158.589 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.54 -42.02 30.56 Favored 'General case' 0 CA--C 1.58 2.114 0 C-N-CA 128.22 2.608 . . . . 0.0 112.194 -173.068 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -73.75 -88.12 0.03 OUTLIER 'General case' 0 CA--C 1.578 2.047 0 C-N-CA 125.928 1.691 . . . . 0.0 112.526 165.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -30.47 110.86 0.28 Allowed Pre-proline 0 CA--C 1.582 2.21 0 C-N-CA 125.822 1.649 . . . . 0.0 114.32 -177.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.411 ' C ' ' CD2' ' A' ' 25' ' ' LEU . 52.5 Cg_exo -70.75 29.57 0.21 Allowed 'Trans proline' 0 CA--C 1.573 2.474 1 C-N-CA 125.83 4.353 . . . . 0.0 117.806 179.084 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.475 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER 31.28 -176.7 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 126.444 1.898 . . . . 0.0 115.141 -162.922 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 29.58 -95.4 0.01 OUTLIER Glycine 0 CA--C 1.575 3.831 0 O-C-N 120.307 -1.496 . . . . 0.0 114.011 -157.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.608 0 O-C-N 121.008 -1.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 2.019 0 CA-C-O 120.907 0.384 . . . . 0.0 111.345 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -121.19 -127.16 0.27 Allowed 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.139 -0.976 . . . . 0.0 112.48 -162.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mp 42.36 48.42 4.4 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 120.538 -1.352 . . . . 0.0 113.164 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt 57.99 -163.34 0.2 Allowed 'General case' 0 N--CA 1.501 2.122 0 CA-C-O 122.609 1.195 . . . . 0.0 113.074 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 61.25 -9.41 0.07 Allowed 'General case' 0 N--CA 1.529 3.501 0 C-N-CA 127.93 2.492 . . . . 0.0 113.66 -158.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.5 m -70.35 -4.84 24.18 Favored 'General case' 0 CA--C 1.584 2.287 0 CA-C-O 122.846 1.308 . . . . 0.0 112.468 153.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -146.25 9.52 1.1 Allowed 'General case' 0 CA--C 1.58 2.129 0 C-N-CA 129.44 3.096 . . . . 0.0 111.114 -164.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -71.47 -28.76 64.17 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.289 -1.507 . . . . 0.0 112.739 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.99 -27.42 45.55 Favored Glycine 1 CA--C 1.582 4.223 0 CA-C-O 122.188 0.882 . . . . 0.0 112.323 169.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.0 t -55.46 -31.08 27.08 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.188 0 O-C-N 120.945 -1.326 . . . . 0.0 110.846 156.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.4 t -77.2 -53.57 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 C-N-CA 125.504 1.521 . . . . 0.0 111.114 -177.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.2 mt -67.99 -26.77 66.07 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.223 -1.548 . . . . 0.0 113.412 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 m -72.67 -25.43 61.26 Favored 'General case' 0 CA--C 1.581 2.141 0 O-C-N 120.143 -1.598 . . . . 0.0 114.707 162.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.458 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -66.24 -32.21 57.08 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.265 0 O-C-N 121.721 -0.612 . . . . 0.0 110.163 160.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.77 -33.75 74.42 Favored 'General case' 0 CA--C 1.582 2.209 0 C-N-CA 124.595 1.158 . . . . 0.0 111.579 175.513 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.33 -28.46 53.91 Favored 'General case' 0 CA--C 1.583 2.221 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 157.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.486 ' O ' ' CB ' ' A' ' 20' ' ' SER . 27.5 mt -87.28 -5.14 59.04 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 163.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.1 -18.71 60.2 Favored 'General case' 0 CA--C 1.587 2.382 0 CA-C-O 123.877 1.799 . . . . 0.0 111.291 153.886 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.1 mt -77.15 -36.57 55.14 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 129.118 2.967 . . . . 0.0 113.155 154.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.5 t -38.12 -41.25 0.57 Allowed 'General case' 0 CA--C 1.59 2.493 0 CA-C-O 124.99 2.329 . . . . 0.0 109.475 160.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.405 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -84.33 -53.22 5.62 Favored 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 127.357 2.263 . . . . 0.0 112.664 -173.203 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -50.57 -31.52 16.0 Favored 'General case' 0 N--CA 1.507 2.405 0 CA-C-O 121.634 0.731 . . . . 0.0 111.952 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.6 t 29.88 96.88 0.03 OUTLIER Pre-proline 0 CA--C 1.583 2.237 0 C-N-CA 125.775 1.63 . . . . 0.0 114.531 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -6.96 72.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.57 2.296 1 C-N-CA 127.139 5.226 . . . . 0.0 116.918 175.04 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.497 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -16.32 129.63 0.01 OUTLIER 'General case' 0 CA--C 1.577 1.994 0 C-N-CA 126.437 1.895 . . . . 0.0 114.242 169.23 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.34 145.39 18.7 Favored Glycine 0 CA--C 1.575 3.794 0 O-C-N 120.928 -1.108 . . . . 0.0 113.936 -157.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.551 0 O-C-N 120.969 -1.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.023 0 CA-C-O 120.825 0.345 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.46 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 9.2 mp0 68.27 136.89 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.032 -1.042 . . . . 0.0 112.759 -175.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.46 ' CB ' ' O ' ' A' ' 2' ' ' GLU . 0.3 OUTLIER 149.15 38.19 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 127.303 2.241 . . . . 0.0 112.787 159.363 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.78 66.74 0.28 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.21 -0.931 . . . . 0.0 113.166 -169.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -92.18 -28.26 17.17 Favored 'General case' 0 N--CA 1.505 2.283 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 156.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.45 1.22 2.41 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.63 -1.294 . . . . 0.0 113.042 155.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -141.96 11.82 2.02 Favored 'General case' 0 N--CA 1.501 2.092 0 C-N-CA 126.308 1.843 . . . . 0.0 112.09 171.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -73.22 -26.63 61.22 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.825 -1.172 . . . . 0.0 113.148 167.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.93 -33.61 45.35 Favored Glycine 1 CA--C 1.581 4.2 0 CA-C-O 122.214 0.897 . . . . 0.0 112.548 166.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.9 t -53.21 -32.42 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 O-C-N 120.814 -1.404 . . . . 0.0 111.858 158.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.7 t -76.67 -60.08 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 C-N-CA 125.23 1.412 . . . . 0.0 111.27 -175.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.09 -26.69 64.11 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.076 -1.64 . . . . 0.0 113.528 -178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.8 m -73.15 -23.92 60.52 Favored 'General case' 0 CA--C 1.58 2.108 0 O-C-N 120.122 -1.611 . . . . 0.0 114.545 162.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.461 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -66.34 -32.3 57.46 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.26 0 O-C-N 121.598 -0.688 . . . . 0.0 110.182 160.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.88 -37.51 81.86 Favored 'General case' 0 CA--C 1.581 2.141 0 C-N-CA 124.538 1.135 . . . . 0.0 112.021 175.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.0 -28.21 16.13 Favored 'General case' 0 CA--C 1.585 2.316 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 156.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.477 ' O ' ' CB ' ' A' ' 20' ' ' SER . 29.1 mt -87.47 -8.73 56.1 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 164.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.512 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -70.64 -20.38 62.73 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 124.891 2.282 . . . . 0.0 111.117 155.123 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 38.2 mt -75.52 -40.72 56.66 Favored 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 129.416 3.086 . . . . 0.0 113.286 155.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.91 -38.71 0.32 Allowed 'General case' 0 CA--C 1.59 2.506 0 CA-C-O 125.253 2.454 . . . . 0.0 109.464 160.002 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.32 -45.14 7.27 Favored 'General case' 0 CA--C 1.58 2.112 0 C-N-CA 127.91 2.484 . . . . 0.0 112.353 -159.194 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -49.24 -95.83 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 125.709 1.603 . . . . 0.0 112.5 166.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.4 t 43.87 98.64 0.03 OUTLIER Pre-proline 0 CA--C 1.585 2.319 0 C-N-CA 125.869 1.668 . . . . 0.0 114.965 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -70.79 31.74 0.22 Allowed 'Trans proline' 0 CA--C 1.575 2.527 1 C-N-CA 125.877 4.385 . . . . 0.0 118.617 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.478 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER 28.83 -165.43 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 126.621 1.969 . . . . 0.0 115.783 -169.198 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 104.25 -64.71 0.34 Allowed Glycine 0 CA--C 1.574 3.754 0 O-C-N 120.461 -1.399 . . . . 0.0 114.08 170.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.604 0 O-C-N 120.881 -1.364 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 120.862 0.363 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -84.87 -43.05 14.47 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.108 -0.995 . . . . 0.0 112.737 -173.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.3 mp -46.97 -60.88 2.15 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 124.387 1.075 . . . . 0.0 113.25 -176.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.51 9.3 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.545 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -177.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -74.55 -26.05 59.7 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 119.691 -1.88 . . . . 0.0 113.96 162.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.1 t -66.37 14.04 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.226 0 CA-C-O 122.093 0.949 . . . . 0.0 112.741 154.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -138.27 -0.39 2.03 Favored 'General case' 0 N--CA 1.502 2.163 0 C-N-CA 125.361 1.464 . . . . 0.0 112.861 158.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -73.05 -24.35 60.69 Favored 'General case' 0 N--CA 1.502 2.152 0 C-N-CA 124.308 1.043 . . . . 0.0 113.609 161.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.97 -37.21 26.16 Favored Glycine 1 CA--C 1.58 4.101 0 O-C-N 121.326 -0.859 . . . . 0.0 113.174 167.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.3 t -48.52 -32.55 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 O-C-N 120.827 -1.396 . . . . 0.0 111.431 157.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.3 t -76.49 -64.5 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 C-N-CA 124.886 1.274 . . . . 0.0 111.121 -175.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mt -70.58 -28.85 65.2 Favored 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 122.942 1.353 . . . . 0.0 113.568 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.0 m -72.91 -24.92 60.89 Favored 'General case' 0 CA--C 1.581 2.149 0 O-C-N 120.174 -1.579 . . . . 0.0 114.523 162.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.466 ' CG1' ' CE ' ' A' ' 18' ' ' LYS . 2.1 t -65.86 -32.46 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.245 0 O-C-N 121.826 -0.546 . . . . 0.0 110.205 160.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -69.67 -34.08 73.47 Favored 'General case' 0 CA--C 1.583 2.237 0 C-N-CA 124.65 1.18 . . . . 0.0 111.515 177.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.47 -28.61 45.7 Favored 'General case' 0 CA--C 1.583 2.222 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 157.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.491 ' O ' ' CB ' ' A' ' 20' ' ' SER . 26.7 mt -86.7 -8.08 57.73 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 116.221 1.934 . . . . 0.0 116.221 163.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.52 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -73.2 -17.32 61.37 Favored 'General case' 0 CA--C 1.588 2.434 0 CA-C-O 124.604 2.145 . . . . 0.0 111.485 154.471 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 33.6 mt -79.02 -36.67 40.76 Favored 'General case' 0 CA--C 1.574 1.888 0 C-N-CA 128.98 2.912 . . . . 0.0 113.078 155.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.491 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.4 t -38.48 -42.28 0.74 Allowed 'General case' 0 CA--C 1.59 2.513 0 CA-C-O 124.946 2.307 . . . . 0.0 109.453 160.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.431 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -82.62 -58.75 2.77 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 127.317 2.247 . . . . 0.0 112.676 -173.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -48.82 -85.55 0.0 OUTLIER 'General case' 0 CA--C 1.58 2.11 0 C-N-CA 124.59 1.156 . . . . 0.0 112.364 172.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.8 t 24.69 101.08 0.02 OUTLIER Pre-proline 0 CA--C 1.582 2.194 0 C-N-CA 126.446 1.898 . . . . 0.0 114.97 167.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -6.95 71.54 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.271 1 C-N-CA 127.233 5.288 . . . . 0.0 117.173 177.015 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.49 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -13.22 129.81 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 126.22 1.808 . . . . 0.0 114.269 163.734 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.21 72.19 0.84 Allowed Glycine 0 CA--C 1.575 3.829 0 O-C-N 121.108 -0.995 . . . . 0.0 113.878 -172.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.566 0 O-C-N 121.021 -1.282 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 2.025 0 CA-C-O 120.773 0.32 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -177.94 159.25 1.34 Allowed 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.096 -1.002 . . . . 0.0 112.713 174.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.458 ' CD1' ' N ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER 175.26 -27.75 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 124.563 1.145 . . . . 0.0 113.582 163.772 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.458 ' N ' ' CD1' ' A' ' 3' ' ' LEU . 2.0 mtmp? 56.17 67.44 1.0 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.77 -1.206 . . . . 0.0 113.017 160.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -93.03 -34.44 13.71 Favored 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 159.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 m -68.45 7.91 0.55 Allowed 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.174 -1.579 . . . . 0.0 112.999 155.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -143.74 12.92 1.69 Allowed 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 126.298 1.839 . . . . 0.0 112.054 165.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -72.97 -27.64 61.93 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.025 -1.047 . . . . 0.0 113.132 165.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.9 -37.57 43.82 Favored Glycine 1 CA--C 1.584 4.406 0 CA-C-O 122.493 1.052 . . . . 0.0 112.123 167.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.0 t -49.74 -31.66 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 C-N-CA 125.19 1.396 . . . . 0.0 111.713 158.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 36.1 t -76.3 -58.21 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 C-N-CA 125.106 1.362 . . . . 0.0 111.07 -176.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.5 mt -68.19 -28.25 67.11 Favored 'General case' 0 N--CA 1.503 2.217 0 CA-C-O 123.11 1.433 . . . . 0.0 113.641 -176.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 m -72.77 -26.73 61.65 Favored 'General case' 0 CA--C 1.582 2.179 0 O-C-N 120.201 -1.562 . . . . 0.0 114.715 162.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.458 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -65.56 -30.96 51.75 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 O-C-N 121.872 -0.517 . . . . 0.0 110.192 160.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -70.02 -35.34 74.25 Favored 'General case' 0 CA--C 1.581 2.166 0 C-N-CA 124.547 1.139 . . . . 0.0 111.551 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.92 -28.91 25.62 Favored 'General case' 0 CA--C 1.584 2.268 0 C-N-CA 124.536 1.134 . . . . 0.0 114.033 156.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.481 ' O ' ' CB ' ' A' ' 20' ' ' SER . 25.9 mt -87.97 -5.29 58.61 Favored 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 163.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.58 -19.21 60.4 Favored 'General case' 0 CA--C 1.587 2.393 0 O-C-N 119.877 -1.764 . . . . 0.0 111.19 154.013 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 35.2 mt -76.3 -37.46 57.43 Favored 'General case' 0 CA--C 1.575 1.929 0 C-N-CA 129.124 2.969 . . . . 0.0 113.245 154.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.481 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -38.12 -41.91 0.62 Allowed 'General case' 0 CA--C 1.589 2.467 0 CA-C-O 124.789 2.233 . . . . 0.0 109.696 160.459 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.4 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -82.44 -57.91 3.15 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 127.24 2.216 . . . . 0.0 112.484 -173.312 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -44.87 -27.6 0.54 Allowed 'General case' 0 N--CA 1.507 2.406 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.009 -176.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t 34.56 88.37 0.1 OUTLIER Pre-proline 0 CA--C 1.582 2.197 0 C-N-CA 124.938 1.295 . . . . 0.0 113.763 172.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -62.69 -144.11 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.58 0 C-N-CA 124.59 3.527 . . . . 0.0 115.359 -174.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.426 ' N ' ' CD1' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -79.92 154.69 28.13 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.243 -1.536 . . . . 0.0 114.486 -156.069 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.8 60.54 8.28 Favored Glycine 0 CA--C 1.574 3.748 0 O-C-N 120.821 -1.174 . . . . 0.0 113.827 159.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.352 0.689 0 O-C-N 121.078 -1.248 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.024 0 CA-C-O 120.687 0.279 . . . . 0.0 111.383 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -47.3 -59.56 3.1 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.007 -1.058 . . . . 0.0 112.907 173.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 47.82 19.46 0.17 Allowed 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.428 1.091 . . . . 0.0 113.459 -165.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.3 mtpp 39.71 44.53 1.3 Allowed 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 124.664 1.186 . . . . 0.0 113.459 173.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -92.9 -32.77 14.46 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.741 -1.225 . . . . 0.0 114.072 156.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.1 t -67.82 5.01 0.95 Allowed 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.464 -1.398 . . . . 0.0 112.8 154.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -140.89 13.56 2.27 Favored 'General case' 0 N--CA 1.502 2.139 0 C-N-CA 126.085 1.754 . . . . 0.0 112.047 165.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -70.14 -29.36 66.26 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.182 -0.949 . . . . 0.0 112.66 157.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.83 -40.73 74.88 Favored Glycine 1 CA--C 1.585 4.433 0 CA-C-O 122.291 0.939 . . . . 0.0 111.893 166.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.0 t -51.83 -30.92 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.257 0 C-N-CA 125.487 1.515 . . . . 0.0 112.117 161.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.8 t -75.9 -57.44 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 C-N-CA 125.011 1.324 . . . . 0.0 111.356 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mt -58.28 -27.64 64.23 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.352 -1.467 . . . . 0.0 114.21 175.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 m -72.91 -27.67 62.01 Favored 'General case' 0 CA--C 1.58 2.127 0 O-C-N 120.045 -1.66 . . . . 0.0 114.911 163.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.474 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -65.08 -30.21 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.273 0 O-C-N 121.736 -0.602 . . . . 0.0 110.18 161.022 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -70.36 -35.05 73.31 Favored 'General case' 0 CA--C 1.582 2.177 0 C-N-CA 124.515 1.126 . . . . 0.0 111.328 176.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.49 -29.01 22.77 Favored 'General case' 0 CA--C 1.584 2.278 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 156.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.487 ' O ' ' CB ' ' A' ' 20' ' ' SER . 23.0 mt -88.29 -5.37 58.38 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 116.172 1.915 . . . . 0.0 116.172 163.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.563 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.91 -17.64 60.54 Favored 'General case' 0 CA--C 1.587 2.385 0 O-C-N 119.765 -1.834 . . . . 0.0 111.287 153.94 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 37.0 mt -77.49 -38.03 49.94 Favored 'General case' 0 CA--C 1.574 1.891 0 C-N-CA 129.163 2.985 . . . . 0.0 113.117 154.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.487 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -37.25 -41.87 0.42 Allowed 'General case' 0 CA--C 1.588 2.419 0 CA-C-O 124.788 2.232 . . . . 0.0 109.662 160.455 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.6 mmm180 -83.59 -59.39 2.45 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 127.365 2.266 . . . . 0.0 112.544 -173.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -44.05 -59.66 2.21 Favored 'General case' 0 CA--C 1.584 2.266 0 CA-C-O 122.484 1.135 . . . . 0.0 112.543 -175.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t 41.24 80.41 0.28 Allowed Pre-proline 0 CA--C 1.582 2.18 0 C-N-CA 124.427 1.091 . . . . 0.0 113.44 -166.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -62.13 -143.05 0.01 OUTLIER 'Trans proline' 0 CA--C 1.577 2.64 0 C-N-CA 124.325 3.35 . . . . 0.0 115.136 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.441 ' N ' ' CD1' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -80.19 173.92 12.11 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 125.327 1.451 . . . . 0.0 114.289 -156.627 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.06 94.81 0.02 OUTLIER Glycine 0 CA--C 1.574 3.773 0 O-C-N 120.86 -1.15 . . . . 0.0 113.831 -170.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.544 0 O-C-N 121.042 -1.269 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tpp . . . . . 0 CA--C 1.578 2.036 0 CA-C-O 120.863 0.363 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 76.44 169.82 0.25 Allowed 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 124.494 1.118 . . . . 0.0 113.004 -173.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.02 1.3 11.25 Favored 'General case' 0 N--CA 1.506 2.372 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -158.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.83 54.58 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 125.376 1.47 . . . . 0.0 113.759 -157.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -93.56 -28.17 16.2 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 120.538 -1.351 . . . . 0.0 114.506 156.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -68.82 8.48 0.51 Allowed 'General case' 0 CA--C 1.581 2.16 0 O-C-N 120.534 -1.354 . . . . 0.0 112.991 155.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -143.11 12.14 1.79 Allowed 'General case' 0 N--CA 1.502 2.169 0 C-N-CA 126.225 1.81 . . . . 0.0 111.95 169.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -72.75 -26.03 61.41 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.799 -1.188 . . . . 0.0 113.162 172.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -83.87 -24.29 49.67 Favored Glycine 1 CA--C 1.582 4.263 0 CA-C-O 122.795 1.22 . . . . 0.0 112.443 167.537 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -61.17 -28.47 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 120.651 -1.499 . . . . 0.0 111.395 156.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.0 t -77.39 -63.08 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 C-N-CA 125.472 1.509 . . . . 0.0 111.456 -178.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.8 mt -61.91 -21.81 65.06 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 119.917 -1.739 . . . . 0.0 113.429 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.4 t -73.73 -29.91 62.52 Favored 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 161.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.541 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -63.18 -30.01 48.65 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.283 0 CA-C-O 119.043 -0.503 . . . . 0.0 109.777 162.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -70.6 -36.3 73.46 Favored 'General case' 0 CA--C 1.581 2.136 0 C-N-CA 124.95 1.3 . . . . 0.0 111.5 173.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.48 -29.16 23.42 Favored 'General case' 0 CA--C 1.584 2.251 0 C-N-CA 124.893 1.277 . . . . 0.0 113.592 155.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.491 ' O ' ' CG ' ' A' ' 21' ' ' ARG . 47.6 mt -90.0 -2.08 58.08 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 164.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.541 ' CD ' ' O ' ' A' ' 14' ' ' VAL . 0.0 OUTLIER -75.97 -20.61 57.77 Favored 'General case' 0 CA--C 1.589 2.466 0 CA-C-O 124.881 2.277 . . . . 0.0 111.22 153.034 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.3 mt -74.63 -37.43 62.81 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 129.347 3.059 . . . . 0.0 113.166 155.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.475 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.8 t -37.11 -40.06 0.29 Allowed 'General case' 0 CA--C 1.587 2.399 0 CA-C-O 124.672 2.177 . . . . 0.0 109.97 160.365 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.491 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 4.3 mmm-85 -92.43 -54.89 3.61 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 126.939 2.096 . . . . 0.0 112.701 -164.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -37.81 -86.6 0.0 OUTLIER 'General case' 0 CA--C 1.583 2.22 0 CA-C-O 122.125 0.964 . . . . 0.0 111.904 168.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 56.14 161.64 0.07 OUTLIER Pre-proline 0 CA--C 1.585 2.316 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 176.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -8.02 74.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.234 1 C-N-CA 127.491 5.461 . . . . 0.0 117.021 173.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.464 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -24.59 148.64 0.0 OUTLIER 'General case' 0 CA--C 1.577 1.999 0 C-N-CA 124.442 1.097 . . . . 0.0 113.615 164.234 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.48 -77.77 0.57 Allowed Glycine 0 CA--C 1.574 3.763 0 O-C-N 121.081 -1.012 . . . . 0.0 114.414 -177.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.56 0 O-C-N 120.829 -1.395 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.576 1.978 0 CA-C-O 120.865 0.364 . . . . 0.0 111.282 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.58 77.74 1.14 Allowed 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.128 -0.983 . . . . 0.0 112.855 165.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 mp 41.77 36.75 0.65 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.639 -1.288 . . . . 0.0 112.969 -163.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -20.66 87.63 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 126.392 1.877 . . . . 0.0 115.238 -158.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -90.91 -32.75 15.89 Favored 'General case' 0 N--CA 1.505 2.312 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 156.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p -68.27 5.09 1.05 Allowed 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.334 -1.479 . . . . 0.0 113.102 155.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -145.22 25.23 1.4 Allowed 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 126.18 1.792 . . . . 0.0 111.544 169.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -67.68 -37.7 82.7 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.313 -0.867 . . . . 0.0 113.036 163.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.59 -29.49 71.39 Favored Glycine 1 CA--C 1.581 4.192 0 CA-C-O 123.101 1.389 . . . . 0.0 112.211 167.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 t -63.15 -25.72 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 O-C-N 120.752 -1.44 . . . . 0.0 111.937 161.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.4 t -76.8 -39.53 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 CA-C-O 123.275 1.512 . . . . 0.0 110.399 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.7 mt -70.15 -26.45 63.94 Favored 'General case' 0 N--CA 1.502 2.13 0 CA-C-O 124.173 1.94 . . . . 0.0 112.733 176.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -73.01 -27.23 61.66 Favored 'General case' 0 CA--C 1.58 2.123 0 O-C-N 119.916 -1.74 . . . . 0.0 114.378 160.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.487 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -64.94 -30.94 51.84 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.245 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.26 161.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.67 -37.08 79.34 Favored 'General case' 0 CA--C 1.582 2.178 0 C-N-CA 124.522 1.129 . . . . 0.0 111.725 175.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.5 -28.17 19.37 Favored 'General case' 0 CA--C 1.586 2.337 0 C-N-CA 124.696 1.198 . . . . 0.0 114.232 155.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.483 ' O ' ' CB ' ' A' ' 20' ' ' SER . 28.4 mt -87.16 -6.7 58.53 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 163.219 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.562 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -73.85 -16.96 61.12 Favored 'General case' 0 N--CA 1.507 2.417 0 CA-C-O 124.896 2.284 . . . . 0.0 111.365 154.502 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 45.8 mt -77.16 -40.47 45.38 Favored 'General case' 0 CA--C 1.575 1.913 0 C-N-CA 129.711 3.204 . . . . 0.0 112.842 153.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.483 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -39.15 -39.75 0.63 Allowed 'General case' 0 CA--C 1.589 2.472 0 CA-C-O 125.297 2.475 . . . . 0.0 109.508 158.685 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.32 -45.33 8.65 Favored 'General case' 0 CA--C 1.579 2.087 0 C-N-CA 127.767 2.427 . . . . 0.0 112.369 -160.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -37.03 -83.74 0.01 OUTLIER 'General case' 0 CA--C 1.58 2.133 0 C-N-CA 125.411 1.484 . . . . 0.0 112.413 161.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 0.96 88.41 0.03 OUTLIER Pre-proline 0 CA--C 1.582 2.179 0 C-N-CA 127.225 2.21 . . . . 0.0 115.326 -178.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -64.8 -144.11 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.615 0 C-N-CA 124.73 3.62 . . . . 0.0 115.286 -178.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.477 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -92.47 157.12 16.73 Favored 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 125.746 1.618 . . . . 0.0 113.934 -156.5 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 54.84 -105.18 0.33 Allowed Glycine 0 CA--C 1.575 3.822 0 O-C-N 120.599 -1.313 . . . . 0.0 113.994 -175.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.583 0 O-C-N 120.871 -1.37 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.8 mmt . . . . . 0 CA--C 1.577 2.011 0 CA-C-O 120.798 0.333 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 86.07 -63.23 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.943 1.297 . . . . 0.0 112.719 173.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 65.03 9.7 5.69 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.574 -1.329 . . . . 0.0 113.459 159.369 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 43.34 82.75 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.829 -1.17 . . . . 0.0 113.86 157.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.51 -40.9 8.44 Favored 'General case' 0 N--CA 1.507 2.421 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 157.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.68 3.0 1.56 Allowed 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.083 -1.635 . . . . 0.0 112.985 155.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -137.31 14.75 3.01 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 126.82 2.048 . . . . 0.0 111.789 170.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -69.49 -32.01 70.63 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.861 -1.149 . . . . 0.0 113.078 171.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -72.63 -35.23 59.27 Favored Glycine 1 CA--C 1.587 4.539 0 CA-C-O 122.878 1.265 . . . . 0.0 111.736 168.232 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.2 t -55.55 -28.43 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.252 0 C-N-CA 125.175 1.39 . . . . 0.0 111.76 160.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.0 t -77.03 -53.14 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 C-N-CA 125.11 1.364 . . . . 0.0 110.954 -177.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.4 mt -70.97 -33.85 70.84 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -174.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.9 t -75.18 -20.52 59.28 Favored 'General case' 0 CA--C 1.578 2.023 0 O-C-N 120.373 -1.455 . . . . 0.0 114.42 160.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.537 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -66.29 -29.11 45.61 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.251 0 O-C-N 121.631 -0.668 . . . . 0.0 110.186 157.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.85 -34.94 64.72 Favored 'General case' 0 CA--C 1.583 2.231 0 CA-C-O 122.462 1.125 . . . . 0.0 110.806 175.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.82 -28.83 24.5 Favored 'General case' 0 CA--C 1.584 2.272 0 C-N-CA 125.135 1.374 . . . . 0.0 113.59 154.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.488 ' O ' ' CB ' ' A' ' 20' ' ' SER . 27.0 mt -89.34 -4.04 58.24 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 163.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.49 -18.17 59.91 Favored 'General case' 0 CA--C 1.588 2.435 0 CA-C-O 123.938 1.828 . . . . 0.0 111.286 153.328 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.2 mt -76.62 -37.79 55.8 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 129.269 3.028 . . . . 0.0 113.112 154.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.488 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -37.26 -40.31 0.33 Allowed 'General case' 0 CA--C 1.587 2.397 0 CA-C-O 124.527 2.108 . . . . 0.0 109.768 160.009 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.444 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 2.4 mmt180 -88.84 -53.54 4.56 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 127.122 2.169 . . . . 0.0 112.733 -169.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -39.75 -44.35 1.56 Allowed 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 123.628 0.771 . . . . 0.0 112.259 -177.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.7 t 49.24 103.42 0.03 OUTLIER Pre-proline 0 CA--C 1.582 2.209 0 C-N-CA 124.663 1.185 . . . . 0.0 113.935 177.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -5.04 69.99 0.0 OUTLIER 'Trans proline' 0 CA--C 1.571 2.326 1 C-N-CA 127.073 5.182 . . . . 0.0 117.007 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.456 ' N ' ' CD1' ' A' ' 25' ' ' LEU . 2.6 mp 54.98 -176.92 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.262 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 157.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 44.48 38.5 5.31 Favored Glycine 0 CA--C 1.575 3.825 0 O-C-N 120.634 -1.291 . . . . 0.0 114.179 176.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.584 0 O-C-N 120.908 -1.348 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.019 0 CA-C-O 120.295 0.093 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -76.64 -104.79 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.583 -1.323 . . . . 0.0 112.603 -168.64 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.0 mp -45.65 -56.96 4.6 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 120.785 -1.197 . . . . 0.0 113.229 -165.667 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -19.04 85.66 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 126.259 1.824 . . . . 0.0 114.39 173.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -119.14 -27.3 5.72 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.687 -1.258 . . . . 0.0 114.33 159.671 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.6 p -68.45 10.85 0.21 Allowed 'General case' 0 CA--C 1.583 2.221 0 O-C-N 120.82 -1.175 . . . . 0.0 112.706 154.427 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -143.0 1.67 1.28 Allowed 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 126.007 1.723 . . . . 0.0 112.536 166.554 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.19 -24.49 60.54 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.971 -1.08 . . . . 0.0 113.425 171.998 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.61 -35.41 36.5 Favored Glycine 1 CA--C 1.582 4.27 0 O-C-N 121.187 -0.946 . . . . 0.0 112.762 165.092 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -53.34 -31.97 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.277 0 O-C-N 120.977 -1.308 . . . . 0.0 111.582 159.47 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.9 t -76.91 -63.94 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 125.056 1.343 . . . . 0.0 111.025 -175.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.74 -27.25 63.81 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.727 -1.233 . . . . 0.0 114.03 -177.528 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -74.4 -25.54 59.54 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.513 -1.367 . . . . 0.0 114.614 162.223 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.5 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -63.54 -33.53 62.07 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.287 0 O-C-N 122.002 -0.436 . . . . 0.0 109.944 159.618 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -69.44 -33.99 73.76 Favored 'General case' 0 CA--C 1.583 2.216 0 C-N-CA 124.826 1.25 . . . . 0.0 111.377 174.093 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.45 -28.17 52.69 Favored 'General case' 0 CA--C 1.582 2.201 0 C-N-CA 124.236 1.014 . . . . 0.0 113.702 157.508 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.496 ' O ' ' CG ' ' A' ' 21' ' ' ARG . 44.4 mt -89.79 -2.59 58.27 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 116.295 1.961 . . . . 0.0 116.295 163.597 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.532 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -76.3 -18.67 58.85 Favored 'General case' 0 CA--C 1.587 2.395 0 CA-C-O 124.638 2.161 . . . . 0.0 111.463 153.072 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 33.4 mt -76.61 -36.87 57.21 Favored 'General case' 0 CA--C 1.575 1.907 0 C-N-CA 129.222 3.009 . . . . 0.0 112.996 155.097 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.483 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.3 t -37.43 -38.83 0.26 Allowed 'General case' 0 CA--C 1.587 2.378 0 CA-C-O 124.351 2.024 . . . . 0.0 109.897 160.069 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.496 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -96.11 -57.36 2.36 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 126.599 1.96 . . . . 0.0 112.803 -165.081 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -36.24 -89.65 0.0 OUTLIER 'General case' 0 CA--C 1.582 2.19 0 CA-C-O 123.093 1.425 . . . . 0.0 112.315 179.603 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 49.75 164.39 0.04 OUTLIER Pre-proline 0 CA--C 1.583 2.234 0 C-N-CA 124.92 1.288 . . . . 0.0 114.37 -170.926 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -65.27 -141.06 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.6 0 C-N-CA 124.085 3.19 . . . . 0.0 114.797 177.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.471 ' N ' ' CD1' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.05 127.31 37.47 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 125.645 1.578 . . . . 0.0 114.126 -166.923 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -107.24 105.17 2.25 Favored Glycine 0 CA--C 1.574 3.74 0 O-C-N 120.813 -1.179 . . . . 0.0 114.111 -174.246 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.588 0 O-C-N 120.795 -1.415 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mtm . . . . . 0 N--CA 1.499 2.018 0 CA-C-O 120.794 0.33 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 49.38 40.96 19.82 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.992 -1.068 . . . . 0.0 112.834 162.619 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -40.17 -48.68 2.58 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 124.627 1.171 . . . . 0.0 113.876 -161.364 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 28.79 65.36 0.11 Allowed 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 125.638 1.575 . . . . 0.0 114.641 158.093 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -92.89 -28.53 16.43 Favored 'General case' 0 N--CA 1.507 2.409 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 163.226 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 t -67.69 6.37 0.67 Allowed 'General case' 0 N--CA 1.504 2.256 0 O-C-N 120.515 -1.366 . . . . 0.0 113.061 155.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -145.04 9.8 1.29 Allowed 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 126.424 1.89 . . . . 0.0 111.902 169.844 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -72.92 -28.38 62.42 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 120.729 -1.232 . . . . 0.0 113.263 167.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.15 -35.19 57.48 Favored Glycine 1 CA--C 1.584 4.398 0 CA-C-O 122.697 1.165 . . . . 0.0 112.042 167.816 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 t -53.79 -33.83 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 C-N-CA 125.288 1.435 . . . . 0.0 111.753 160.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.3 t -76.56 -59.11 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 C-N-CA 125.129 1.372 . . . . 0.0 111.258 -173.316 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mt -67.59 -25.95 66.03 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 120.32 -1.488 . . . . 0.0 113.587 -177.337 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m -72.89 -26.46 61.44 Favored 'General case' 0 CA--C 1.581 2.161 0 O-C-N 120.233 -1.542 . . . . 0.0 114.626 162.269 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.467 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.1 t -66.13 -30.06 48.72 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.242 0 O-C-N 121.841 -0.537 . . . . 0.0 110.188 161.381 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -70.23 -37.26 74.96 Favored 'General case' 0 CA--C 1.581 2.144 0 C-N-CA 124.616 1.166 . . . . 0.0 111.859 176.119 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.17 -27.17 8.09 Favored 'General case' 0 CA--C 1.587 2.387 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 156.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.466 ' CA ' ' CB ' ' A' ' 20' ' ' SER . 25.5 mt -89.38 -10.62 45.92 Favored 'General case' 0 N--CA 1.505 2.276 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 164.199 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.524 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.59 -20.2 64.5 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 124.772 2.225 . . . . 0.0 111.218 155.119 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.2 mt -76.17 -42.71 45.62 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 129.123 2.969 . . . . 0.0 113.307 155.237 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.466 ' CB ' ' CA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -37.34 -40.85 0.38 Allowed 'General case' 0 N--CA 1.512 2.626 0 CA-C-O 125.225 2.44 . . . . 0.0 108.802 158.183 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.8 -39.24 44.47 Favored 'General case' 0 CA--C 1.579 2.089 0 C-N-CA 128.032 2.533 . . . . 0.0 112.128 -176.527 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -94.51 -105.43 0.14 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 126.012 1.725 . . . . 0.0 112.888 172.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 34.3 t -56.08 93.42 0.04 OUTLIER Pre-proline 0 N--CA 1.504 2.23 0 C-N-CA 125.432 1.493 . . . . 0.0 114.409 -158.3 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -63.82 -142.12 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.597 0 C-N-CA 123.979 3.119 . . . . 0.0 114.803 177.577 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.434 ' N ' ' CD1' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -84.32 168.36 15.7 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 125.243 1.417 . . . . 0.0 113.983 -161.018 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.96 160.84 3.79 Favored Glycine 0 CA--C 1.575 3.835 0 O-C-N 120.547 -1.346 . . . . 0.0 113.873 -162.847 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.538 0 O-C-N 120.893 -1.357 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.998 0 CA-C-O 120.596 0.236 . . . . 0.0 111.017 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -53.21 -101.32 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 124.318 1.047 . . . . 0.0 113.585 -156.896 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.407 ' O ' ' CB ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -58.0 -23.45 54.14 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 120.577 -1.327 . . . . 0.0 113.494 -165.785 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.584 ' CB ' ' CB ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 85.76 107.42 0.05 OUTLIER 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 125.895 1.678 . . . . 0.0 112.52 -171.049 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -92.13 -32.59 15.08 Favored 'General case' 0 N--CA 1.508 2.467 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 166.217 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.93 7.98 0.46 Allowed 'General case' 0 CA--C 1.584 2.26 0 O-C-N 120.136 -1.602 . . . . 0.0 112.755 153.498 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.584 ' CB ' ' CB ' ' A' ' 4' ' ' LYS . 6.4 mt-10 -141.59 4.33 1.74 Allowed 'General case' 0 N--CA 1.503 2.214 0 C-N-CA 127.764 2.426 . . . . 0.0 112.08 173.047 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -73.82 -27.72 61.26 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.585 -1.322 . . . . 0.0 113.217 169.497 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.67 -34.69 38.49 Favored Glycine 1 CA--C 1.583 4.29 0 CA-C-O 122.51 1.061 . . . . 0.0 112.2 171.13 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 t -47.07 -35.69 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.152 0 O-C-N 120.823 -1.398 . . . . 0.0 110.959 156.665 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 23.5 t -76.86 -55.65 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 C-N-CA 125.329 1.451 . . . . 0.0 111.004 -173.013 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.3 mt -70.19 -28.37 65.26 Favored 'General case' 0 N--CA 1.502 2.17 0 CA-C-O 123.473 1.606 . . . . 0.0 113.321 -177.031 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.8 m -72.46 -25.58 61.5 Favored 'General case' 0 CA--C 1.582 2.184 0 O-C-N 120.076 -1.64 . . . . 0.0 114.516 163.259 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.446 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -66.34 -32.33 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.255 0 C-N-CA 123.091 0.556 . . . . 0.0 110.25 160.515 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -69.07 -32.52 72.02 Favored 'General case' 0 CA--C 1.583 2.24 0 C-N-CA 124.526 1.13 . . . . 0.0 111.436 176.136 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.41 -28.4 53.93 Favored 'General case' 0 CA--C 1.584 2.265 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 158.068 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.484 ' O ' ' CB ' ' A' ' 20' ' ' SER . 25.6 mt -88.63 -4.72 58.5 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 116.317 1.969 . . . . 0.0 116.317 163.156 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.25 -18.43 60.1 Favored 'General case' 0 CA--C 1.586 2.356 0 O-C-N 119.913 -1.742 . . . . 0.0 111.283 153.681 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 35.3 mt -77.0 -37.27 55.45 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 129.014 2.926 . . . . 0.0 113.123 154.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.484 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 1.5 t -36.97 -40.81 0.31 Allowed 'General case' 0 CA--C 1.588 2.426 0 CA-C-O 124.927 2.298 . . . . 0.0 109.786 160.608 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.437 ' CG ' ' O ' ' A' ' 17' ' ' LEU . 6.4 mmm180 -88.15 -56.22 3.42 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 127.743 2.417 . . . . 0.0 112.689 -170.677 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -47.26 -27.54 1.58 Allowed 'General case' 0 N--CA 1.507 2.382 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.711 178.238 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.0 t -28.38 90.23 0.04 OUTLIER Pre-proline 0 CA--C 1.582 2.176 0 C-N-CA 125.524 1.529 . . . . 0.0 114.272 -172.022 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -7.45 69.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.57 2.318 1 C-N-CA 127.382 5.388 . . . . 0.0 117.017 178.298 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.472 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -14.96 121.59 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 126.849 2.06 . . . . 0.0 114.506 175.463 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -54.63 148.17 22.62 Favored Glycine 0 CA--C 1.576 3.882 0 O-C-N 120.831 -1.168 . . . . 0.0 113.706 -179.41 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.562 0 O-C-N 121.396 -1.061 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mtp . . . . . 0 N--CA 1.499 2.024 0 CA-C-O 120.777 0.323 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 56.97 -88.09 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.952 -1.092 . . . . 0.0 112.687 -157.626 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.459 ' O ' ' CG ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER 51.92 27.36 4.28 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.961 -1.087 . . . . 0.0 113.595 157.135 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.459 ' CG ' ' O ' ' A' ' 3' ' ' LEU . 0.7 OUTLIER 147.07 75.04 0.0 OUTLIER 'General case' 0 CA--C 1.58 2.132 0 C-N-CA 127.578 2.351 . . . . 0.0 112.174 -159.704 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -87.0 -30.14 21.46 Favored 'General case' 0 N--CA 1.504 2.275 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 156.909 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.5 m -68.68 6.63 0.8 Allowed 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.388 -1.445 . . . . 0.0 113.162 155.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -146.27 15.48 1.31 Allowed 'General case' 0 N--CA 1.501 2.098 0 C-N-CA 125.785 1.634 . . . . 0.0 112.13 171.511 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -73.44 -27.61 61.52 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.136 -0.977 . . . . 0.0 113.418 177.833 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.0 -31.97 41.44 Favored Glycine 1 CA--C 1.584 4.382 0 CA-C-O 122.872 1.262 . . . . 0.0 111.998 165.628 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 t -58.27 -27.7 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 C-N-CA 124.999 1.319 . . . . 0.0 111.779 159.187 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.3 t -76.2 -65.13 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 C-N-CA 125.268 1.427 . . . . 0.0 110.74 -179.632 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.0 mt -68.43 -26.16 65.39 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 123.283 1.516 . . . . 0.0 113.236 -175.757 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -39.56 70.12 Favored 'General case' 0 CA--C 1.583 2.228 0 O-C-N 120.516 -1.365 . . . . 0.0 114.227 162.0 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.516 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -56.47 -29.09 28.06 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.326 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.917 164.359 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -74.05 -34.76 64.17 Favored 'General case' 0 N--CA 1.502 2.172 0 C-N-CA 124.896 1.278 . . . . 0.0 111.241 176.403 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.87 -27.42 12.65 Favored 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 124.596 1.158 . . . . 0.0 114.099 156.454 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.492 ' O ' ' CB ' ' A' ' 20' ' ' SER . 24.0 mt -90.34 -11.79 39.61 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 163.307 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.52 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.48 -16.42 63.88 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-O 124.503 2.096 . . . . 0.0 111.215 155.068 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 41.9 mt -78.89 -43.46 24.88 Favored 'General case' 0 CA--C 1.575 1.941 0 C-N-CA 129.502 3.121 . . . . 0.0 113.154 155.555 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.492 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -35.39 -39.48 0.13 Allowed 'General case' 0 N--CA 1.509 2.482 0 CA-C-O 125.321 2.486 . . . . 0.0 109.506 158.331 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -99.89 -37.44 9.04 Favored 'General case' 0 CA--C 1.58 2.103 0 C-N-CA 128.34 2.656 . . . . 0.0 112.262 -157.569 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -65.96 -91.94 0.01 OUTLIER 'General case' 0 CA--C 1.579 2.093 0 C-N-CA 126.061 1.744 . . . . 0.0 112.514 176.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.1 t 179.74 139.79 0.3 Allowed Pre-proline 0 CA--C 1.584 2.281 0 C-N-CA 126.009 1.724 . . . . 0.0 114.894 -160.429 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -62.18 -143.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.577 2.626 0 C-N-CA 124.519 3.479 . . . . 0.0 115.117 -178.331 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.419 ' N ' ' CD1' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -80.74 158.72 25.42 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 125.505 1.522 . . . . 0.0 114.374 -156.434 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.29 -10.36 0.94 Allowed Glycine 0 CA--C 1.576 3.866 0 O-C-N 120.815 -1.178 . . . . 0.0 113.921 177.032 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.564 0 O-C-N 120.979 -1.306 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 2.019 0 CA-C-O 120.948 0.404 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -133.77 18.59 3.86 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.021 -1.05 . . . . 0.0 112.564 162.326 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.429 ' O ' ' CB ' ' A' ' 4' ' ' LYS . 1.4 mp -61.42 -2.93 0.81 Allowed 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -171.813 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.567 ' CB ' ' CB ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 83.9 111.42 0.06 Allowed 'General case' 0 N--CA 1.507 2.4 0 CA-C-N 120.929 1.695 . . . . 0.0 112.504 -157.123 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -95.05 -37.64 11.01 Favored 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 163.425 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.8 t -68.79 5.36 1.12 Allowed 'General case' 0 N--CA 1.503 2.199 0 O-C-N 119.919 -1.738 . . . . 0.0 112.976 154.908 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.567 ' CB ' ' CB ' ' A' ' 4' ' ' LYS . 6.9 mt-10 -146.43 19.78 1.35 Allowed 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 126.915 2.086 . . . . 0.0 111.453 173.906 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -73.47 -26.36 60.88 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.113 -0.992 . . . . 0.0 113.186 173.95 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.16 -33.52 32.32 Favored Glycine 1 CA--C 1.583 4.295 0 CA-C-O 122.701 1.167 . . . . 0.0 112.203 166.157 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 t -53.38 -28.41 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.248 0 O-C-N 120.788 -1.419 . . . . 0.0 111.675 157.493 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 41.7 t -77.18 -62.94 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 C-N-CA 125.225 1.41 . . . . 0.0 110.956 -179.812 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mt -70.05 -29.26 66.23 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-O 123.074 1.416 . . . . 0.0 113.377 -173.83 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m -72.94 -25.91 61.2 Favored 'General case' 0 CA--C 1.581 2.164 0 O-C-N 120.302 -1.499 . . . . 0.0 114.672 162.618 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.464 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -65.74 -30.48 50.21 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.263 0 O-C-N 121.764 -0.585 . . . . 0.0 110.173 160.466 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -71.95 -34.35 68.95 Favored 'General case' 0 CA--C 1.582 2.197 0 C-N-CA 124.559 1.144 . . . . 0.0 111.399 177.884 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.39 -27.53 16.11 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 157.113 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.474 ' O ' ' CB ' ' A' ' 20' ' ' SER . 30.6 mt -88.22 -13.77 40.2 Favored 'General case' 0 N--CA 1.505 2.284 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 163.255 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.0 -14.55 63.05 Favored 'General case' 0 N--CA 1.512 2.646 0 CA-C-O 124.447 2.07 . . . . 0.0 111.382 155.049 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 48.0 mt -81.83 -43.13 18.69 Favored 'General case' 0 CA--C 1.575 1.905 0 C-N-CA 129.238 3.015 . . . . 0.0 113.086 155.6 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.474 ' CB ' ' O ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -35.37 -38.62 0.1 Allowed 'General case' 0 N--CA 1.511 2.617 0 CA-C-O 125.497 2.57 . . . . 0.0 109.225 158.015 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.53 -32.13 11.61 Favored 'General case' 0 CA--C 1.58 2.115 0 C-N-CA 129.52 3.128 . . . . 0.0 111.756 -162.591 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -80.01 -96.72 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 126.913 2.085 . . . . 0.0 113.316 161.882 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 t -158.45 165.46 18.51 Favored Pre-proline 0 CA--C 1.587 2.388 0 C-N-CA 126.989 2.116 . . . . 0.0 114.82 -178.949 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -71.55 29.45 0.24 Allowed 'Trans proline' 0 CA--C 1.575 2.538 1 C-N-CA 125.591 4.194 . . . . 0.0 119.508 -176.705 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.489 ' N ' ' CD2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER 24.62 -157.94 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 126.037 1.735 . . . . 0.0 115.349 -169.934 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.48 9.3 64.52 Favored Glycine 0 CA--C 1.575 3.834 0 O-C-N 120.327 -1.483 . . . . 0.0 114.171 163.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.555 0 O-C-N 121.009 -1.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.866 ' O ' HG23 ' A' ' 11' ' ' VAL . 13.5 mt-10 . . . . . 0 N--CA 1.501 2.087 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.24 -26.65 61.21 Favored 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 124.239 1.015 . . . . 0.0 113.551 169.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.76 -36.37 29.22 Favored Glycine 1 CA--C 1.581 4.173 0 O-C-N 121.061 -1.024 . . . . 0.0 112.535 170.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.554 ' CG2' ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -47.4 -33.46 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 120.805 -1.409 . . . . 0.0 111.294 156.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.866 HG23 ' O ' ' A' ' 7' ' ' GLU . 32.6 t -76.21 -62.13 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 C-N-CA 125.006 1.322 . . . . 0.0 110.911 -174.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.482 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.1 mt -70.37 -28.42 65.1 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.598 -1.314 . . . . 0.0 113.583 -175.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 m -72.88 -26.46 61.45 Favored 'General case' 0 CA--C 1.58 2.106 0 O-C-N 120.368 -1.457 . . . . 0.0 114.486 162.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.589 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -65.16 -31.52 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.241 0 O-C-N 121.808 -0.557 . . . . 0.0 110.031 161.214 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.778 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 56.0 m-20 -70.36 -36.93 74.48 Favored 'General case' 0 CA--C 1.581 2.163 0 C-N-CA 124.578 1.151 . . . . 0.0 111.823 178.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.806 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -50.78 -27.66 7.69 Favored 'General case' 0 CA--C 1.587 2.386 0 C-N-CA 124.98 1.312 . . . . 0.0 114.283 156.005 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.027 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 28.6 mt -87.28 -13.27 44.17 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 116.188 1.921 . . . . 0.0 116.188 164.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.978 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -69.9 -13.29 62.18 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 119.856 -1.778 . . . . 0.0 111.593 155.461 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.806 HD12 ' HA ' ' A' ' 16' ' ' ALA . 29.9 mt -85.51 -36.96 20.19 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 130.6 3.56 . . . . 0.0 113.36 154.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.027 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -38.29 -36.97 0.26 Allowed 'General case' 0 N--CA 1.515 2.776 0 CA-C-O 125.882 2.753 . . . . 0.0 108.424 158.525 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.582 2.174 1 C-N-CA 132.626 4.371 . . . . 0.0 111.992 173.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.852 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.5 mt-10 . . . . . 0 N--CA 1.501 2.094 0 CA-C-O 121.251 0.548 . . . . 0.0 111.642 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -70.09 -30.58 67.83 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.39 -0.819 . . . . 0.0 112.865 157.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.69 -28.07 52.34 Favored Glycine 1 CA--C 1.584 4.355 0 CA-C-O 122.435 1.019 . . . . 0.0 111.79 171.457 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.712 HG23 ' HA ' ' A' ' 7' ' ' GLU . 5.1 t -56.67 -29.56 30.06 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 C-N-CA 125.24 1.416 . . . . 0.0 111.705 156.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.852 HG23 ' O ' ' A' ' 7' ' ' GLU . 18.4 t -76.5 -45.3 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 C-N-CA 124.987 1.315 . . . . 0.0 110.581 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.427 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.0 mt -67.88 -27.52 66.74 Favored 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 123.208 1.48 . . . . 0.0 113.546 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.74 -27.51 62.08 Favored 'General case' 0 CA--C 1.582 2.177 0 O-C-N 120.226 -1.546 . . . . 0.0 114.546 163.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.99 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -65.35 -31.93 55.99 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 122.87 0.468 . . . . 0.0 110.318 161.342 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.947 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 12.6 m-20 -68.08 -35.66 78.54 Favored 'General case' 0 CA--C 1.581 2.157 0 C-N-CA 124.837 1.255 . . . . 0.0 111.667 175.138 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.815 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.64 -28.5 55.68 Favored 'General case' 0 CA--C 1.584 2.269 0 C-N-CA 124.1 0.96 . . . . 0.0 113.521 156.486 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.049 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 23.4 mt -89.08 -0.6 57.57 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 164.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 1.028 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -74.39 -29.68 61.64 Favored 'General case' 0 CA--C 1.592 2.574 0 CA-C-O 125.8 2.714 . . . . 0.0 110.818 153.734 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.815 HD12 ' HA ' ' A' ' 16' ' ' ALA . 35.2 mt -64.99 -40.12 94.48 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 128.704 2.802 . . . . 0.0 113.882 154.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.049 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.2 t -37.67 -43.18 0.61 Allowed 'General case' 0 CA--C 1.589 2.469 0 CA-C-O 124.971 2.319 . . . . 0.0 109.732 161.065 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 1.028 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.248 0 C-N-CA 127.268 2.227 . . . . 0.0 112.596 -168.446 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.889 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.2 mt-10 . . . . . 0 N--CA 1.501 2.121 0 CA-C-O 121.021 0.438 . . . . 0.0 112.008 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.467 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 3.0 t80 -71.08 -27.83 63.9 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.263 -0.898 . . . . 0.0 113.136 164.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.28 -36.61 30.38 Favored Glycine 1 CA--C 1.584 4.396 0 CA-C-O 122.77 1.205 . . . . 0.0 111.939 169.463 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.649 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.8 t -50.25 -29.99 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 C-N-CA 125.158 1.383 . . . . 0.0 111.751 157.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.889 HG23 ' O ' ' A' ' 7' ' ' GLU . 38.5 t -75.83 -61.7 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 C-N-CA 124.747 1.219 . . . . 0.0 111.005 -178.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.48 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.0 mt -64.4 -24.9 67.79 Favored 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 123.118 1.437 . . . . 0.0 113.675 -174.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.849 ' O ' HD13 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -73.17 -29.01 62.54 Favored 'General case' 0 CA--C 1.579 2.083 0 O-C-N 120.304 -1.498 . . . . 0.0 114.557 162.029 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.872 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -70.45 -19.32 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.586 2.342 0 CA-C-O 117.124 -1.417 . . . . 0.0 110.935 162.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.873 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 38.6 m-20 -73.65 -38.46 64.97 Favored 'General case' 0 CA--C 1.581 2.148 0 O-C-N 124.372 1.045 . . . . 0.0 110.908 167.206 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.82 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -50.78 -28.84 10.11 Favored 'General case' 0 CA--C 1.59 2.51 0 C-N-CA 125.285 1.434 . . . . 0.0 112.465 151.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.874 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.2 OUTLIER -88.94 -5.01 58.28 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 125.641 1.576 . . . . 0.0 114.981 168.131 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.962 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -77.6 -19.13 56.07 Favored 'General case' 0 CA--C 1.588 2.405 0 CA-C-O 124.683 2.182 . . . . 0.0 111.708 153.263 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.82 HD12 ' HA ' ' A' ' 16' ' ' ALA . 36.3 mt -76.08 -32.3 59.18 Favored 'General case' 0 CA--C 1.575 1.923 0 C-N-CA 129.073 2.949 . . . . 0.0 112.581 154.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.874 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -40.33 -40.73 1.22 Allowed 'General case' 0 N--CA 1.507 2.401 0 CA-C-O 124.563 2.125 . . . . 0.0 110.179 160.037 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.962 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.132 0 C-N-CA 127.176 2.19 . . . . 0.0 112.527 -160.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.871 ' O ' HG23 ' A' ' 11' ' ' VAL . 4.7 mt-10 . . . . . 0 N--CA 1.502 2.161 0 CA-C-O 121.096 0.474 . . . . 0.0 111.865 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -73.35 -29.3 62.57 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.93 -1.106 . . . . 0.0 113.028 170.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.55 -35.06 37.78 Favored Glycine 1 CA--C 1.584 4.385 0 CA-C-O 122.763 1.202 . . . . 0.0 111.925 170.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.601 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -49.05 -32.41 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 C-N-CA 125.306 1.442 . . . . 0.0 111.441 157.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.871 HG23 ' O ' ' A' ' 7' ' ' GLU . 28.6 t -76.55 -58.26 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 C-N-CA 124.839 1.256 . . . . 0.0 110.971 -176.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.42 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.2 mt -59.79 -28.4 67.4 Favored 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 125.274 1.43 . . . . 0.0 114.196 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.722 ' O ' HD13 ' A' ' 17' ' ' LEU . 1.0 OUTLIER -72.75 -27.53 62.08 Favored 'General case' 0 CA--C 1.582 2.179 0 O-C-N 120.378 -1.451 . . . . 0.0 114.664 163.596 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.871 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -70.62 -20.56 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.25 0 CA-C-O 117.487 -1.244 . . . . 0.0 111.164 161.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.871 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 5.5 m-20 -74.96 -38.66 61.64 Favored 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 124.448 1.099 . . . . 0.0 111.398 171.432 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.741 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -52.41 -27.98 18.02 Favored 'General case' 0 CA--C 1.59 2.507 0 C-N-CA 124.902 1.281 . . . . 0.0 112.403 152.413 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.835 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.71 -6.57 58.8 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 125.941 1.696 . . . . 0.0 114.623 167.413 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.915 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -77.39 -19.03 56.79 Favored 'General case' 0 CA--C 1.586 2.355 0 CA-C-O 124.445 2.069 . . . . 0.0 111.863 153.467 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.741 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 37.9 mt -77.2 -30.95 54.98 Favored 'General case' 0 CA--C 1.575 1.909 0 C-N-CA 128.721 2.808 . . . . 0.0 112.629 154.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.835 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -40.91 -39.31 1.12 Allowed 'General case' 0 CA--C 1.59 2.49 0 CA-C-O 124.783 2.23 . . . . 0.0 109.861 159.822 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.915 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 1.3 mmt180 . . . . . 0 N--CA 1.504 2.227 0 C-N-CA 127.603 2.361 . . . . 0.0 112.498 -163.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.92 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.5 mt-10 . . . . . 0 N--CA 1.501 2.109 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -73.68 -26.82 60.91 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.933 -1.104 . . . . 0.0 113.219 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.09 -34.62 32.82 Favored Glycine 1 CA--C 1.582 4.249 0 CA-C-O 122.303 0.946 . . . . 0.0 112.504 165.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.617 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.0 t -51.74 -31.63 13.28 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 O-C-N 120.884 -1.362 . . . . 0.0 111.422 158.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 7' ' ' GLU . 41.5 t -77.09 -63.89 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 C-N-CA 125.152 1.381 . . . . 0.0 110.846 -176.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 15' ' ' ASP . 5.2 mt -70.18 -29.94 66.94 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 123.51 1.624 . . . . 0.0 113.601 -175.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.416 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 3.6 m -73.19 -24.77 60.58 Favored 'General case' 0 CA--C 1.581 2.153 0 O-C-N 119.739 -1.851 . . . . 0.0 114.422 162.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.934 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.37 -30.39 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.239 0 O-C-N 121.794 -0.566 . . . . 0.0 110.283 160.065 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.9 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 20.5 m-20 -69.95 -35.34 74.43 Favored 'General case' 0 CA--C 1.581 2.17 0 C-N-CA 124.291 1.037 . . . . 0.0 111.55 176.342 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.755 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -52.03 -28.49 17.36 Favored 'General case' 0 CA--C 1.585 2.3 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 156.32 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.07 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 26.7 mt -88.16 -8.81 54.83 Favored 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 163.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.934 ' HE3' HG12 ' A' ' 14' ' ' VAL . 0.0 OUTLIER -71.0 -18.47 62.6 Favored 'General case' 0 N--CA 1.508 2.452 0 CA-C-O 124.894 2.283 . . . . 0.0 111.268 154.654 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.755 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 42.9 mt -76.46 -41.34 47.67 Favored 'General case' 0 CA--C 1.575 1.932 0 C-N-CA 129.498 3.119 . . . . 0.0 113.124 154.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.07 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.86 -40.67 0.47 Allowed 'General case' 0 CA--C 1.59 2.498 0 CA-C-O 125.315 2.483 . . . . 0.0 109.343 158.786 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.512 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.579 2.079 0 C-N-CA 128.032 2.533 . . . . 0.0 112.508 -168.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.914 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.6 mt-10 . . . . . 0 N--CA 1.502 2.161 0 CA-C-O 120.979 0.419 . . . . 0.0 111.829 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -73.28 -27.5 61.6 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.811 -1.181 . . . . 0.0 113.205 177.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.79 -38.03 28.46 Favored Glycine 1 CA--C 1.582 4.257 0 CA-C-O 122.71 1.172 . . . . 0.0 112.371 166.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 7' ' ' GLU . 1.9 t -48.31 -31.09 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 120.732 -1.452 . . . . 0.0 111.298 158.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 7' ' ' GLU . 42.3 t -77.07 -66.08 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 C-N-CA 125.08 1.352 . . . . 0.0 110.915 -178.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.447 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.4 mt -66.26 -28.47 68.74 Favored 'General case' 0 N--CA 1.503 2.206 0 CA-C-O 122.759 1.266 . . . . 0.0 113.588 -173.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.733 ' O ' HD13 ' A' ' 17' ' ' LEU . 19.2 m -72.67 -24.97 61.1 Favored 'General case' 0 CA--C 1.582 2.174 0 O-C-N 120.334 -1.479 . . . . 0.0 114.366 162.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.785 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t -72.39 -20.2 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.263 0 CA-C-O 117.38 -1.295 . . . . 0.0 111.088 161.229 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.739 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.5 m-20 -74.92 -38.74 61.72 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 124.316 1.01 . . . . 0.0 111.363 170.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.738 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -51.78 -27.3 11.76 Favored 'General case' 0 CA--C 1.59 2.512 0 C-N-CA 125.072 1.349 . . . . 0.0 112.528 151.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.874 ' CA ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -87.86 -7.64 56.94 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 125.836 1.654 . . . . 0.0 114.814 167.007 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.972 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -76.09 -17.77 59.47 Favored 'General case' 0 CA--C 1.588 2.417 0 O-C-N 118.88 -2.387 . . . . 0.0 111.739 153.936 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.738 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 37.8 mt -78.43 -33.89 48.29 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 129.102 2.961 . . . . 0.0 112.744 154.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.874 ' HB2' ' CA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -39.72 -38.62 0.66 Allowed 'General case' 0 CA--C 1.591 2.54 0 CA-C-O 125.643 2.64 . . . . 0.0 109.591 158.645 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.42 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.58 2.12 0 C-N-CA 128.731 2.812 . . . . 0.0 112.206 -156.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.622 ' HA ' HG23 ' A' ' 10' ' ' VAL . 13.0 mt-10 . . . . . 0 N--CA 1.501 2.125 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.528 ' CE1' HD21 ' A' ' 12' ' ' LEU . 3.2 t80 -73.33 -34.82 65.86 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.701 -1.249 . . . . 0.0 113.398 157.042 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.07 -41.82 98.36 Favored Glycine 1 CA--C 1.585 4.458 0 CA-C-O 122.414 1.008 . . . . 0.0 112.322 172.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.5 t -42.26 -37.67 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.25 0 C-N-CA 125.2 1.4 . . . . 0.0 111.243 159.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 7' ' ' GLU . 16.2 t -76.82 -50.39 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 C-N-CA 125.439 1.496 . . . . 0.0 110.737 -172.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.528 HD21 ' CE1' ' A' ' 8' ' ' PHE . 3.8 mt -70.07 -19.71 63.26 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 120.408 -1.432 . . . . 0.0 113.081 -175.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.748 ' O ' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -73.21 -30.04 63.23 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 162.601 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.782 ' HA ' HD22 ' A' ' 17' ' ' LEU . 2.1 t -67.43 -26.76 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.322 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.619 162.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.799 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 59.4 m-20 -70.39 -37.96 74.59 Favored 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 124.291 1.036 . . . . 0.0 111.553 169.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.744 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -53.5 -26.8 22.3 Favored 'General case' 0 CA--C 1.588 2.438 0 CA-C-O 122.847 1.308 . . . . 0.0 112.496 153.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.871 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.0 OUTLIER -88.02 -6.67 57.85 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 126.883 2.073 . . . . 0.0 114.654 167.634 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.964 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -79.24 -20.32 48.49 Favored 'General case' 0 CA--C 1.584 2.264 0 O-C-N 119.552 -1.967 . . . . 0.0 112.014 154.404 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.744 HD12 ' HA ' ' A' ' 16' ' ' ALA . 28.8 mt -77.33 -29.38 53.48 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 128.632 2.773 . . . . 0.0 112.681 155.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.871 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.17 -37.97 0.19 Allowed 'General case' 0 CA--C 1.59 2.487 0 CA-C-O 125.289 2.471 . . . . 0.0 109.65 157.597 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.85 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.219 0 C-N-CA 128.014 2.525 . . . . 0.0 112.359 -158.266 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.915 ' O ' HG23 ' A' ' 11' ' ' VAL . 13.0 mt-10 . . . . . 0 N--CA 1.502 2.138 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.474 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 0.7 OUTLIER -72.36 -25.3 61.48 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 124.107 0.963 . . . . 0.0 113.166 170.788 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.09 -36.25 25.15 Favored Glycine 1 CA--C 1.581 4.206 0 CA-C-O 122.212 0.895 . . . . 0.0 112.444 166.097 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.614 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.5 t -51.13 -29.39 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 O-C-N 120.827 -1.396 . . . . 0.0 111.712 157.177 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.915 HG23 ' O ' ' A' ' 7' ' ' GLU . 45.4 t -76.16 -64.47 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 C-N-CA 125.056 1.342 . . . . 0.0 110.93 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.41 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.4 mt -70.29 -29.4 66.15 Favored 'General case' 0 N--CA 1.502 2.152 0 CA-C-O 122.934 1.35 . . . . 0.0 113.515 -174.112 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.7 m -73.0 -26.48 61.34 Favored 'General case' 0 CA--C 1.58 2.134 0 O-C-N 120.338 -1.476 . . . . 0.0 114.538 162.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.613 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -65.19 -30.16 49.46 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.259 0 O-C-N 121.759 -0.588 . . . . 0.0 110.192 160.726 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.731 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 56.0 m-20 -71.91 -35.8 69.79 Favored 'General case' 0 CA--C 1.582 2.174 0 C-N-CA 124.589 1.155 . . . . 0.0 111.548 177.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.775 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.17 -28.4 18.03 Favored 'General case' 0 CA--C 1.585 2.296 0 C-N-CA 124.765 1.226 . . . . 0.0 113.823 155.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.006 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 27.7 mt -86.27 -11.29 52.7 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 163.31 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 1.004 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.08 -14.95 62.49 Favored 'General case' 0 N--CA 1.508 2.473 0 CA-C-O 124.317 2.008 . . . . 0.0 111.606 154.736 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.775 HD12 ' HA ' ' A' ' 16' ' ' ALA . 36.9 mt -81.15 -39.06 26.12 Favored 'General case' 0 CA--C 1.574 1.9 0 C-N-CA 128.857 2.863 . . . . 0.0 113.079 154.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.006 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -37.02 -39.91 0.26 Allowed 'General case' 0 CA--C 1.59 2.496 0 CA-C-O 124.806 2.241 . . . . 0.0 109.261 161.022 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.788 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.25 0 C-N-CA 127.327 2.251 . . . . 0.0 112.349 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.906 ' O ' HG23 ' A' ' 11' ' ' VAL . 4.8 mt-10 . . . . . 0 N--CA 1.502 2.154 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -73.2 -24.42 60.52 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.416 1.086 . . . . 0.0 113.087 175.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.43 -35.48 22.99 Favored Glycine 1 CA--C 1.579 4.046 0 O-C-N 121.513 -0.742 . . . . 0.0 113.057 165.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.573 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -49.81 -30.94 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 O-C-N 120.851 -1.382 . . . . 0.0 111.197 157.154 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 7' ' ' GLU . 40.7 t -77.07 -67.18 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 C-N-CA 125.25 1.42 . . . . 0.0 110.924 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.1 mt -70.18 -27.69 64.72 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-O 123.227 1.489 . . . . 0.0 113.344 -174.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.722 ' O ' HD13 ' A' ' 17' ' ' LEU . 3.8 m -72.94 -24.16 60.77 Favored 'General case' 0 CA--C 1.581 2.136 0 O-C-N 120.169 -1.582 . . . . 0.0 114.401 161.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.999 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -70.56 -23.59 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.276 0 CA-C-O 117.233 -1.365 . . . . 0.0 110.868 160.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.914 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.2 m-20 -72.92 -39.62 66.13 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 124.485 1.116 . . . . 0.0 111.535 172.233 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.798 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.66 -27.94 19.47 Favored 'General case' 0 CA--C 1.59 2.5 0 C-N-CA 124.781 1.232 . . . . 0.0 112.454 152.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.898 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.19 -6.08 59.06 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 125.719 1.608 . . . . 0.0 115.151 166.275 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.999 ' HE3' HG12 ' A' ' 14' ' ' VAL . 0.1 OUTLIER -77.12 -17.45 58.64 Favored 'General case' 0 CA--C 1.588 2.407 0 CA-C-O 124.519 2.104 . . . . 0.0 111.819 152.661 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' A' ' 16' ' ' ALA . 38.4 mt -78.38 -32.02 48.68 Favored 'General case' 0 CA--C 1.574 1.894 0 C-N-CA 128.692 2.797 . . . . 0.0 112.593 154.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.898 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -41.01 -39.87 1.29 Allowed 'General case' 0 CA--C 1.59 2.481 0 CA-C-O 124.7 2.19 . . . . 0.0 109.957 160.499 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.902 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.127 0 C-N-CA 127.466 2.307 . . . . 0.0 112.557 -164.107 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.921 ' O ' HG23 ' A' ' 11' ' ' VAL . 9.9 mt-10 . . . . . 0 N--CA 1.503 2.212 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -72.97 -25.95 61.19 Favored 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 124.221 1.008 . . . . 0.0 113.25 170.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.511 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -78.25 -35.94 32.41 Favored Glycine 1 CA--C 1.582 4.279 0 CA-C-O 122.484 1.047 . . . . 0.0 112.439 166.621 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.611 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -51.99 -31.12 13.48 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.904 -1.35 . . . . 0.0 111.93 158.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.921 HG23 ' O ' ' A' ' 7' ' ' GLU . 41.6 t -75.9 -62.64 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 C-N-CA 125.103 1.361 . . . . 0.0 111.061 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.43 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.5 mt -70.6 -27.2 63.91 Favored 'General case' 0 N--CA 1.502 2.161 0 CA-C-O 122.801 1.286 . . . . 0.0 113.493 -174.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.4 t -73.39 -30.44 63.27 Favored 'General case' 0 CA--C 1.579 2.073 0 O-C-N 120.507 -1.371 . . . . 0.0 114.643 162.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.976 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -61.16 -32.11 51.94 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.29 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 161.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.888 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 29.5 m-20 -71.57 -31.73 67.3 Favored 'General case' 0 CA--C 1.582 2.21 0 C-N-CA 125.007 1.323 . . . . 0.0 111.101 174.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.933 ' HA ' HD23 ' A' ' 19' ' ' LEU . . . -57.08 -25.7 59.17 Favored 'General case' 0 CA--C 1.581 2.16 0 C-N-CA 124.67 1.188 . . . . 0.0 113.59 156.243 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.053 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 23.9 mt -91.36 -4.68 55.51 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 117.363 2.357 . . . . 0.0 117.363 163.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.976 ' HE3' HG12 ' A' ' 14' ' ' VAL . 0.0 OUTLIER -75.34 -26.88 58.94 Favored 'General case' 0 CA--C 1.587 2.39 0 CA-C-O 124.674 2.178 . . . . 0.0 111.418 154.969 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.933 HD23 ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -80.22 -18.11 50.45 Favored 'General case' 0 CA--C 1.586 2.357 0 C-N-CA 129.691 3.196 . . . . 0.0 112.595 157.722 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.053 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -52.36 -43.31 64.59 Favored 'General case' 0 CA--C 1.592 2.565 0 CA-C-O 125.425 2.536 . . . . 0.0 109.651 156.322 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.757 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER . . . . . 0 CA--C 1.58 2.108 0 C-N-CA 128.101 2.561 . . . . 0.0 112.0 -168.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.905 ' O ' HG23 ' A' ' 11' ' ' VAL . 5.4 mt-10 . . . . . 0 N--CA 1.501 2.1 0 CA-C-O 121.138 0.494 . . . . 0.0 111.987 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.452 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 1.7 t80 -73.06 -23.77 60.61 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.111 -0.993 . . . . 0.0 113.144 164.111 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.21 -38.62 25.37 Favored Glycine 1 CA--C 1.581 4.192 0 O-C-N 121.357 -0.839 . . . . 0.0 112.799 163.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.672 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.5 t -50.03 -29.47 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.334 0 O-C-N 120.852 -1.381 . . . . 0.0 111.742 158.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.905 HG23 ' O ' ' A' ' 7' ' ' GLU . 42.0 t -76.09 -68.32 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 C-N-CA 125.035 1.334 . . . . 0.0 111.26 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.9 mt -68.65 -27.27 65.85 Favored 'General case' 0 N--CA 1.503 2.218 0 CA-C-O 123.642 1.687 . . . . 0.0 113.432 -173.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.777 ' O ' HD13 ' A' ' 17' ' ' LEU . 2.5 m -72.48 -25.0 61.26 Favored 'General case' 0 CA--C 1.581 2.144 0 O-C-N 119.902 -1.749 . . . . 0.0 114.192 161.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.845 ' HA ' HD22 ' A' ' 17' ' ' LEU . 2.1 t -71.99 -20.22 20.24 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.3 0 CA-C-O 117.132 -1.413 . . . . 0.0 111.203 161.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.834 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 58.1 m-20 -74.05 -39.76 63.28 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 124.423 1.077 . . . . 0.0 111.547 170.208 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.776 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -53.26 -25.4 14.33 Favored 'General case' 0 CA--C 1.59 2.507 0 C-N-CA 125.18 1.392 . . . . 0.0 113.059 152.62 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.992 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.5 -10.34 54.31 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 164.559 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.914 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.52 -13.78 60.72 Favored 'General case' 0 CA--C 1.587 2.391 0 O-C-N 119.461 -2.024 . . . . 0.0 111.695 154.299 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.776 HD12 ' HA ' ' A' ' 16' ' ' ALA . 33.2 mt -84.27 -33.95 23.9 Favored 'General case' 0 CA--C 1.573 1.858 0 C-N-CA 129.519 3.128 . . . . 0.0 112.922 154.075 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.992 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -41.38 -38.97 1.33 Allowed 'General case' 0 CA--C 1.602 2.954 0 CA-C-O 126.762 3.172 . . . . 0.0 108.075 156.624 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.658 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.588 2.408 1 C-N-CA 134.502 5.121 . . . . 0.0 110.898 -177.447 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.87 ' O ' HG23 ' A' ' 11' ' ' VAL . 4.9 mt-10 . . . . . 0 N--CA 1.503 2.221 0 CA-C-O 120.834 0.349 . . . . 0.0 111.867 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -72.65 -30.58 64.41 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.26 1.024 . . . . 0.0 112.819 169.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.34 -23.54 58.52 Favored Glycine 1 CA--C 1.583 4.296 0 CA-C-O 122.139 0.855 . . . . 0.0 112.237 170.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.7 t -60.83 -29.77 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.188 0 C-N-CA 125.073 1.349 . . . . 0.0 111.444 156.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.87 HG23 ' O ' ' A' ' 7' ' ' GLU . 21.8 t -76.67 -47.87 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 CA-C-O 123.39 1.567 . . . . 0.0 110.781 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.01 -24.72 64.24 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 119.979 -1.701 . . . . 0.0 113.228 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 10.7 m -73.04 -24.85 60.76 Favored 'General case' 0 CA--C 1.58 2.116 0 O-C-N 120.121 -1.612 . . . . 0.0 114.558 162.063 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.498 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.42 -33.41 63.27 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.266 0 O-C-N 121.658 -0.651 . . . . 0.0 110.202 160.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.797 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -65.81 -36.93 84.89 Favored 'General case' 0 CA--C 1.58 2.126 0 C-N-CA 124.488 1.115 . . . . 0.0 112.073 174.221 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.777 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.37 -28.14 18.38 Favored 'General case' 0 CA--C 1.586 2.338 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 157.292 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.093 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 26.9 mt -87.79 -8.41 55.99 Favored 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 163.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.16 -18.84 62.48 Favored 'General case' 0 N--CA 1.509 2.51 0 CA-C-O 124.814 2.245 . . . . 0.0 111.241 154.764 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.777 HD12 ' HA ' ' A' ' 16' ' ' ALA . 42.3 mt -76.13 -41.68 49.32 Favored 'General case' 0 CA--C 1.574 1.89 0 C-N-CA 129.502 3.121 . . . . 0.0 113.099 154.581 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.093 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.94 -41.47 0.55 Allowed 'General case' 0 N--CA 1.51 2.557 0 CA-C-O 125.399 2.523 . . . . 0.0 109.043 158.589 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.539 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.58 2.114 0 C-N-CA 128.22 2.608 . . . . 0.0 112.194 -173.068 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.872 ' O ' HG23 ' A' ' 11' ' ' VAL . 10.1 mt-10 . . . . . 0 CA--C 1.58 2.129 0 CA-C-O 121.369 0.604 . . . . 0.0 111.114 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -71.47 -28.76 64.17 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.289 -1.507 . . . . 0.0 112.739 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.99 -27.42 45.55 Favored Glycine 1 CA--C 1.582 4.223 0 CA-C-O 122.188 0.882 . . . . 0.0 112.323 169.555 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.0 t -55.46 -31.08 27.08 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.188 0 O-C-N 120.945 -1.326 . . . . 0.0 110.846 156.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.872 HG23 ' O ' ' A' ' 7' ' ' GLU . 22.4 t -77.2 -53.57 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 C-N-CA 125.504 1.521 . . . . 0.0 111.114 -177.184 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.447 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.2 mt -67.99 -26.77 66.07 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.223 -1.548 . . . . 0.0 113.412 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 m -72.67 -25.43 61.26 Favored 'General case' 0 CA--C 1.581 2.141 0 O-C-N 120.143 -1.598 . . . . 0.0 114.707 162.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.481 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t -66.24 -32.21 57.08 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.265 0 O-C-N 121.721 -0.612 . . . . 0.0 110.163 160.48 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.765 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -68.77 -33.75 74.42 Favored 'General case' 0 CA--C 1.582 2.209 0 C-N-CA 124.595 1.158 . . . . 0.0 111.579 175.513 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.777 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.33 -28.46 53.91 Favored 'General case' 0 CA--C 1.583 2.221 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 157.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.05 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 27.5 mt -87.28 -5.14 59.04 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 163.139 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.967 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.1 -18.71 60.2 Favored 'General case' 0 CA--C 1.587 2.382 0 CA-C-O 123.877 1.799 . . . . 0.0 111.291 153.886 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.777 HD12 ' HA ' ' A' ' 16' ' ' ALA . 36.1 mt -77.15 -36.57 55.14 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 129.118 2.967 . . . . 0.0 113.155 154.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.05 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.5 t -38.12 -41.25 0.57 Allowed 'General case' 0 CA--C 1.59 2.493 0 CA-C-O 124.99 2.329 . . . . 0.0 109.475 160.491 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.945 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.503 2.194 0 C-N-CA 127.357 2.263 . . . . 0.0 112.664 -173.203 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.874 ' O ' HG23 ' A' ' 11' ' ' VAL . 20.0 mt-10 . . . . . 0 N--CA 1.501 2.092 0 CA-C-O 121.057 0.456 . . . . 0.0 112.09 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -73.22 -26.63 61.22 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.825 -1.172 . . . . 0.0 113.148 167.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.93 -33.61 45.35 Favored Glycine 1 CA--C 1.581 4.2 0 CA-C-O 122.214 0.897 . . . . 0.0 112.548 166.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.663 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.9 t -53.21 -32.42 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 O-C-N 120.814 -1.404 . . . . 0.0 111.858 158.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 7' ' ' GLU . 33.7 t -76.67 -60.08 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 C-N-CA 125.23 1.412 . . . . 0.0 111.27 -175.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.09 -26.69 64.11 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.076 -1.64 . . . . 0.0 113.528 -178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.8 m -73.15 -23.92 60.52 Favored 'General case' 0 CA--C 1.58 2.108 0 O-C-N 120.122 -1.611 . . . . 0.0 114.545 162.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.825 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.34 -32.3 57.46 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.26 0 O-C-N 121.598 -0.688 . . . . 0.0 110.182 160.503 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.903 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.2 m-20 -67.88 -37.51 81.86 Favored 'General case' 0 CA--C 1.581 2.141 0 C-N-CA 124.538 1.135 . . . . 0.0 112.021 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.786 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.0 -28.21 16.13 Favored 'General case' 0 CA--C 1.585 2.316 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 156.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.103 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 29.1 mt -87.47 -8.73 56.1 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 164.221 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.903 ' HD3' ' HA ' ' A' ' 15' ' ' ASP . 0.0 OUTLIER -70.64 -20.38 62.73 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 124.891 2.282 . . . . 0.0 111.117 155.123 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.786 HD12 ' HA ' ' A' ' 16' ' ' ALA . 38.2 mt -75.52 -40.72 56.66 Favored 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 129.416 3.086 . . . . 0.0 113.286 155.035 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.103 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.91 -38.71 0.32 Allowed 'General case' 0 CA--C 1.59 2.506 0 CA-C-O 125.253 2.454 . . . . 0.0 109.464 160.002 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.424 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.58 2.112 0 C-N-CA 127.91 2.484 . . . . 0.0 112.353 -159.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.896 ' O ' HG23 ' A' ' 11' ' ' VAL . 8.5 mt-10 . . . . . 0 N--CA 1.502 2.163 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -73.05 -24.35 60.69 Favored 'General case' 0 N--CA 1.502 2.152 0 C-N-CA 124.308 1.043 . . . . 0.0 113.609 161.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.97 -37.21 26.16 Favored Glycine 1 CA--C 1.58 4.101 0 O-C-N 121.326 -0.859 . . . . 0.0 113.174 167.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.6 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.3 t -48.52 -32.55 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 O-C-N 120.827 -1.396 . . . . 0.0 111.431 157.371 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.896 HG23 ' O ' ' A' ' 7' ' ' GLU . 38.3 t -76.49 -64.5 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 C-N-CA 124.886 1.274 . . . . 0.0 111.121 -175.764 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.465 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.3 mt -70.58 -28.85 65.2 Favored 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 122.942 1.353 . . . . 0.0 113.568 -175.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.0 m -72.91 -24.92 60.89 Favored 'General case' 0 CA--C 1.581 2.149 0 O-C-N 120.174 -1.579 . . . . 0.0 114.523 162.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.973 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -65.86 -32.46 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.245 0 O-C-N 121.826 -0.546 . . . . 0.0 110.205 160.14 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.938 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 28.1 m-20 -69.67 -34.08 73.47 Favored 'General case' 0 CA--C 1.583 2.237 0 C-N-CA 124.65 1.18 . . . . 0.0 111.515 177.058 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.745 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -54.47 -28.61 45.7 Favored 'General case' 0 CA--C 1.583 2.222 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 157.504 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.979 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 26.7 mt -86.7 -8.08 57.73 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 116.221 1.934 . . . . 0.0 116.221 163.395 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.98 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -73.2 -17.32 61.37 Favored 'General case' 0 CA--C 1.588 2.434 0 CA-C-O 124.604 2.145 . . . . 0.0 111.485 154.471 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.745 HD12 ' HA ' ' A' ' 16' ' ' ALA . 33.6 mt -79.02 -36.67 40.76 Favored 'General case' 0 CA--C 1.574 1.888 0 C-N-CA 128.98 2.912 . . . . 0.0 113.078 155.008 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.979 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.4 t -38.48 -42.28 0.74 Allowed 'General case' 0 CA--C 1.59 2.513 0 CA-C-O 124.946 2.307 . . . . 0.0 109.453 160.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.98 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.501 2.096 0 C-N-CA 127.317 2.247 . . . . 0.0 112.676 -173.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.886 ' O ' HG23 ' A' ' 11' ' ' VAL . 12.8 mt-10 . . . . . 0 N--CA 1.501 2.103 0 CA-C-O 120.98 0.419 . . . . 0.0 112.054 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.461 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 0.4 OUTLIER -72.97 -27.64 61.93 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.025 -1.047 . . . . 0.0 113.132 165.603 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.9 -37.57 43.82 Favored Glycine 1 CA--C 1.584 4.406 0 CA-C-O 122.493 1.052 . . . . 0.0 112.123 167.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.648 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.0 t -49.74 -31.66 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 C-N-CA 125.19 1.396 . . . . 0.0 111.713 158.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 7' ' ' GLU . 36.1 t -76.3 -58.21 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 C-N-CA 125.106 1.362 . . . . 0.0 111.07 -176.358 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.435 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.5 mt -68.19 -28.25 67.11 Favored 'General case' 0 N--CA 1.503 2.217 0 CA-C-O 123.11 1.433 . . . . 0.0 113.641 -176.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 m -72.77 -26.73 61.65 Favored 'General case' 0 CA--C 1.582 2.179 0 O-C-N 120.201 -1.562 . . . . 0.0 114.715 162.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.809 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -65.56 -30.96 51.75 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 O-C-N 121.872 -0.517 . . . . 0.0 110.192 160.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.864 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 52.7 m-20 -70.02 -35.34 74.25 Favored 'General case' 0 CA--C 1.581 2.166 0 C-N-CA 124.547 1.139 . . . . 0.0 111.551 176.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.756 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.92 -28.91 25.62 Favored 'General case' 0 CA--C 1.584 2.268 0 C-N-CA 124.536 1.134 . . . . 0.0 114.033 156.51 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.091 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 25.9 mt -87.97 -5.29 58.61 Favored 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 163.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 1.046 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -74.58 -19.21 60.4 Favored 'General case' 0 CA--C 1.587 2.393 0 O-C-N 119.877 -1.764 . . . . 0.0 111.19 154.013 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.756 HD12 ' HA ' ' A' ' 16' ' ' ALA . 35.2 mt -76.3 -37.46 57.43 Favored 'General case' 0 CA--C 1.575 1.929 0 C-N-CA 129.124 2.969 . . . . 0.0 113.245 154.765 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.091 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -38.12 -41.91 0.62 Allowed 'General case' 0 CA--C 1.589 2.467 0 CA-C-O 124.789 2.233 . . . . 0.0 109.696 160.459 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 1.046 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.12 0 C-N-CA 127.24 2.216 . . . . 0.0 112.484 -173.312 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.88 ' O ' HG23 ' A' ' 11' ' ' VAL . 14.1 mt-10 . . . . . 0 N--CA 1.502 2.139 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.55 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.5 OUTLIER -70.14 -29.36 66.26 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.182 -0.949 . . . . 0.0 112.66 157.186 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.83 -40.73 74.88 Favored Glycine 1 CA--C 1.585 4.433 0 CA-C-O 122.291 0.939 . . . . 0.0 111.893 166.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.695 HG23 ' HA ' ' A' ' 7' ' ' GLU . 4.0 t -51.83 -30.92 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.257 0 C-N-CA 125.487 1.515 . . . . 0.0 112.117 161.813 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 7' ' ' GLU . 39.8 t -75.9 -57.44 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 C-N-CA 125.011 1.324 . . . . 0.0 111.356 -176.381 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.46 HD21 ' HE1' ' A' ' 8' ' ' PHE . 4.6 mt -58.28 -27.64 64.23 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.352 -1.467 . . . . 0.0 114.21 175.33 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.42 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.3 m -72.91 -27.67 62.01 Favored 'General case' 0 CA--C 1.58 2.127 0 O-C-N 120.045 -1.66 . . . . 0.0 114.911 163.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.487 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -65.08 -30.21 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.273 0 O-C-N 121.736 -0.602 . . . . 0.0 110.18 161.022 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.72 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 9.1 m-20 -70.36 -35.05 73.31 Favored 'General case' 0 CA--C 1.582 2.177 0 C-N-CA 124.515 1.126 . . . . 0.0 111.328 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.797 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.49 -29.01 22.77 Favored 'General case' 0 CA--C 1.584 2.278 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 156.401 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.061 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 23.0 mt -88.29 -5.37 58.38 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 116.172 1.915 . . . . 0.0 116.172 163.44 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.992 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.91 -17.64 60.54 Favored 'General case' 0 CA--C 1.587 2.385 0 O-C-N 119.765 -1.834 . . . . 0.0 111.287 153.94 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.797 HD12 ' HA ' ' A' ' 16' ' ' ALA . 37.0 mt -77.49 -38.03 49.94 Favored 'General case' 0 CA--C 1.574 1.891 0 C-N-CA 129.163 2.985 . . . . 0.0 113.117 154.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.061 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -37.25 -41.87 0.42 Allowed 'General case' 0 CA--C 1.588 2.419 0 CA-C-O 124.788 2.232 . . . . 0.0 109.662 160.455 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.962 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 3.6 mmm180 . . . . . 0 N--CA 1.501 2.09 0 C-N-CA 127.365 2.266 . . . . 0.0 112.544 -173.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.877 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.2 mt-10 . . . . . 0 N--CA 1.502 2.169 0 CA-C-O 120.929 0.395 . . . . 0.0 111.95 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -72.75 -26.03 61.41 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.799 -1.188 . . . . 0.0 113.162 172.531 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.615 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -83.87 -24.29 49.67 Favored Glycine 1 CA--C 1.582 4.263 0 CA-C-O 122.795 1.22 . . . . 0.0 112.443 167.537 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.669 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -61.17 -28.47 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 120.651 -1.499 . . . . 0.0 111.395 156.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 7' ' ' GLU . 40.0 t -77.39 -63.08 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 C-N-CA 125.472 1.509 . . . . 0.0 111.456 -178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.495 ' N ' HD23 ' A' ' 12' ' ' LEU . 3.8 mt -61.91 -21.81 65.06 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 119.917 -1.739 . . . . 0.0 113.429 174.374 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.615 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 1.4 t -73.73 -29.91 62.52 Favored 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 161.317 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.823 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -63.18 -30.01 48.65 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.283 0 CA-C-O 119.043 -0.503 . . . . 0.0 109.777 162.15 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.889 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 53.5 m-20 -70.6 -36.3 73.46 Favored 'General case' 0 CA--C 1.581 2.136 0 C-N-CA 124.95 1.3 . . . . 0.0 111.5 173.296 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.816 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.48 -29.16 23.42 Favored 'General case' 0 CA--C 1.584 2.251 0 C-N-CA 124.893 1.277 . . . . 0.0 113.592 155.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.051 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 47.6 mt -90.0 -2.08 58.08 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 164.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.889 ' HD3' ' HA ' ' A' ' 15' ' ' ASP . 0.0 OUTLIER -75.97 -20.61 57.77 Favored 'General case' 0 CA--C 1.589 2.466 0 CA-C-O 124.881 2.277 . . . . 0.0 111.22 153.034 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.816 HD12 ' HA ' ' A' ' 16' ' ' ALA . 34.3 mt -74.63 -37.43 62.81 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 129.347 3.059 . . . . 0.0 113.166 155.12 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.051 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.8 t -37.11 -40.06 0.29 Allowed 'General case' 0 CA--C 1.587 2.399 0 CA-C-O 124.672 2.177 . . . . 0.0 109.97 160.365 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.821 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 4.3 mmm-85 . . . . . 0 N--CA 1.502 2.156 0 C-N-CA 126.939 2.096 . . . . 0.0 112.701 -164.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.857 ' O ' HG23 ' A' ' 11' ' ' VAL . 3.8 mt-10 . . . . . 0 N--CA 1.501 2.096 0 CA-C-O 121.313 0.577 . . . . 0.0 111.544 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.423 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 19.1 t80 -67.68 -37.7 82.7 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.313 -0.867 . . . . 0.0 113.036 163.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.59 -29.49 71.39 Favored Glycine 1 CA--C 1.581 4.192 0 CA-C-O 123.101 1.389 . . . . 0.0 112.211 167.668 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.744 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.7 t -63.15 -25.72 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 O-C-N 120.752 -1.44 . . . . 0.0 111.937 161.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 7' ' ' GLU . 16.4 t -76.8 -39.53 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 CA-C-O 123.275 1.512 . . . . 0.0 110.399 177.024 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.504 ' N ' HD23 ' A' ' 12' ' ' LEU . 3.7 mt -70.15 -26.45 63.94 Favored 'General case' 0 N--CA 1.502 2.13 0 CA-C-O 124.173 1.94 . . . . 0.0 112.733 176.168 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -73.01 -27.23 61.66 Favored 'General case' 0 CA--C 1.58 2.123 0 O-C-N 119.916 -1.74 . . . . 0.0 114.378 160.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.567 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -64.94 -30.94 51.84 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.245 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.26 161.344 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.754 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.2 m-20 -68.67 -37.08 79.34 Favored 'General case' 0 CA--C 1.582 2.178 0 C-N-CA 124.522 1.129 . . . . 0.0 111.725 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.786 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -52.5 -28.17 19.37 Favored 'General case' 0 CA--C 1.586 2.337 0 C-N-CA 124.696 1.198 . . . . 0.0 114.232 155.672 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.068 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 28.4 mt -87.16 -6.7 58.53 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 163.219 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 1.004 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -73.85 -16.96 61.12 Favored 'General case' 0 N--CA 1.507 2.417 0 CA-C-O 124.896 2.284 . . . . 0.0 111.365 154.502 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.786 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 45.8 mt -77.16 -40.47 45.38 Favored 'General case' 0 CA--C 1.575 1.913 0 C-N-CA 129.711 3.204 . . . . 0.0 112.842 153.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.068 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -39.15 -39.75 0.63 Allowed 'General case' 0 CA--C 1.589 2.472 0 CA-C-O 125.297 2.475 . . . . 0.0 109.508 158.685 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.627 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.579 2.087 0 C-N-CA 127.767 2.427 . . . . 0.0 112.369 -160.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.914 ' O ' HG23 ' A' ' 11' ' ' VAL . 8.8 mt-10 . . . . . 0 N--CA 1.501 2.117 0 CA-C-O 121.126 0.489 . . . . 0.0 111.789 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.48 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 3.6 t80 -69.49 -32.01 70.63 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.861 -1.149 . . . . 0.0 113.078 171.047 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -72.63 -35.23 59.27 Favored Glycine 1 CA--C 1.587 4.539 0 CA-C-O 122.878 1.265 . . . . 0.0 111.736 168.232 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.67 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.2 t -55.55 -28.43 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.252 0 C-N-CA 125.175 1.39 . . . . 0.0 111.76 160.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 7' ' ' GLU . 33.0 t -77.03 -53.14 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 C-N-CA 125.11 1.364 . . . . 0.0 110.954 -177.584 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.419 ' O ' ' HB2' ' A' ' 15' ' ' ASP . 5.4 mt -70.97 -33.85 70.84 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -174.412 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 7.9 t -75.18 -20.52 59.28 Favored 'General case' 0 CA--C 1.578 2.023 0 O-C-N 120.373 -1.455 . . . . 0.0 114.42 160.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.537 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -66.29 -29.11 45.61 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.251 0 O-C-N 121.631 -0.668 . . . . 0.0 110.186 157.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.819 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.1 m-20 -73.85 -34.94 64.72 Favored 'General case' 0 CA--C 1.583 2.231 0 CA-C-O 122.462 1.125 . . . . 0.0 110.806 175.337 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.82 -28.83 24.5 Favored 'General case' 0 CA--C 1.584 2.272 0 C-N-CA 125.135 1.374 . . . . 0.0 113.59 154.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.036 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 27.0 mt -89.34 -4.04 58.24 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 163.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.941 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -75.49 -18.17 59.91 Favored 'General case' 0 CA--C 1.588 2.435 0 CA-C-O 123.938 1.828 . . . . 0.0 111.286 153.328 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.826 HD12 ' HA ' ' A' ' 16' ' ' ALA . 34.2 mt -76.62 -37.79 55.8 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 129.269 3.028 . . . . 0.0 113.112 154.748 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.036 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -37.26 -40.31 0.33 Allowed 'General case' 0 CA--C 1.587 2.397 0 CA-C-O 124.527 2.108 . . . . 0.0 109.768 160.009 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.941 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 2.4 mmt180 . . . . . 0 N--CA 1.502 2.127 0 C-N-CA 127.122 2.169 . . . . 0.0 112.733 -169.97 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.92 ' O ' HG23 ' A' ' 11' ' ' VAL . 14.9 mt-10 . . . . . 0 N--CA 1.501 2.099 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.19 -24.49 60.54 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.971 -1.08 . . . . 0.0 113.425 171.998 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.531 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -77.61 -35.41 36.5 Favored Glycine 1 CA--C 1.582 4.27 0 O-C-N 121.187 -0.946 . . . . 0.0 112.762 165.092 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.599 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -53.34 -31.97 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.277 0 O-C-N 120.977 -1.308 . . . . 0.0 111.582 159.47 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 7' ' ' GLU . 40.9 t -76.91 -63.94 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 125.056 1.343 . . . . 0.0 111.025 -175.77 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.0 mt -70.74 -27.25 63.81 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.727 -1.233 . . . . 0.0 114.03 -177.528 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.531 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 29.4 t -74.4 -25.54 59.54 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.513 -1.367 . . . . 0.0 114.614 162.223 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.607 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -63.54 -33.53 62.07 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.287 0 O-C-N 122.002 -0.436 . . . . 0.0 109.944 159.618 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.828 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 14.8 m-20 -69.44 -33.99 73.76 Favored 'General case' 0 CA--C 1.583 2.216 0 C-N-CA 124.826 1.25 . . . . 0.0 111.377 174.093 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.775 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.45 -28.17 52.69 Favored 'General case' 0 CA--C 1.582 2.201 0 C-N-CA 124.236 1.014 . . . . 0.0 113.702 157.508 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.021 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 44.4 mt -89.79 -2.59 58.27 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 116.295 1.961 . . . . 0.0 116.295 163.597 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.932 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -76.3 -18.67 58.85 Favored 'General case' 0 CA--C 1.587 2.395 0 CA-C-O 124.638 2.161 . . . . 0.0 111.463 153.072 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.775 HD12 ' HA ' ' A' ' 16' ' ' ALA . 33.4 mt -76.61 -36.87 57.21 Favored 'General case' 0 CA--C 1.575 1.907 0 C-N-CA 129.222 3.009 . . . . 0.0 112.996 155.097 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.021 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.3 t -37.43 -38.83 0.26 Allowed 'General case' 0 CA--C 1.587 2.378 0 CA-C-O 124.351 2.024 . . . . 0.0 109.897 160.069 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.769 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.503 2.211 0 C-N-CA 126.599 1.96 . . . . 0.0 112.803 -165.081 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.89 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.3 mt-10 . . . . . 0 N--CA 1.502 2.135 0 CA-C-O 120.838 0.352 . . . . 0.0 111.902 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -72.92 -28.38 62.42 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 120.729 -1.232 . . . . 0.0 113.263 167.831 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.15 -35.19 57.48 Favored Glycine 1 CA--C 1.584 4.398 0 CA-C-O 122.697 1.165 . . . . 0.0 112.042 167.816 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.688 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -53.79 -33.83 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 C-N-CA 125.288 1.435 . . . . 0.0 111.753 160.978 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.89 HG23 ' O ' ' A' ' 7' ' ' GLU . 33.3 t -76.56 -59.11 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 C-N-CA 125.129 1.372 . . . . 0.0 111.258 -173.316 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.459 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.3 mt -67.59 -25.95 66.03 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 120.32 -1.488 . . . . 0.0 113.587 -177.337 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m -72.89 -26.46 61.44 Favored 'General case' 0 CA--C 1.581 2.161 0 O-C-N 120.233 -1.542 . . . . 0.0 114.626 162.269 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.842 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.13 -30.06 48.72 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.242 0 O-C-N 121.841 -0.537 . . . . 0.0 110.188 161.381 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.87 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.7 m-20 -70.23 -37.26 74.96 Favored 'General case' 0 CA--C 1.581 2.144 0 C-N-CA 124.616 1.166 . . . . 0.0 111.859 176.119 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.824 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -51.17 -27.17 8.09 Favored 'General case' 0 CA--C 1.587 2.387 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 156.266 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.048 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 25.5 mt -89.38 -10.62 45.92 Favored 'General case' 0 N--CA 1.505 2.276 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 164.199 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.894 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.59 -20.2 64.5 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 124.772 2.225 . . . . 0.0 111.218 155.119 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 16' ' ' ALA . 34.2 mt -76.17 -42.71 45.62 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 129.123 2.969 . . . . 0.0 113.307 155.237 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.048 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -37.34 -40.85 0.38 Allowed 'General case' 0 N--CA 1.512 2.626 0 CA-C-O 125.225 2.44 . . . . 0.0 108.802 158.183 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.54 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.579 2.089 0 C-N-CA 128.032 2.533 . . . . 0.0 112.128 -176.527 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.824 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.4 mt-10 . . . . . 0 N--CA 1.503 2.214 0 CA-C-O 121.422 0.63 . . . . 0.0 112.08 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -73.82 -27.72 61.26 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.585 -1.322 . . . . 0.0 113.217 169.497 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.67 -34.69 38.49 Favored Glycine 1 CA--C 1.583 4.29 0 CA-C-O 122.51 1.061 . . . . 0.0 112.2 171.13 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.623 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.5 t -47.07 -35.69 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.152 0 O-C-N 120.823 -1.398 . . . . 0.0 110.959 156.665 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 7' ' ' GLU . 23.5 t -76.86 -55.65 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 C-N-CA 125.329 1.451 . . . . 0.0 111.004 -173.013 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.427 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.3 mt -70.19 -28.37 65.26 Favored 'General case' 0 N--CA 1.502 2.17 0 CA-C-O 123.473 1.606 . . . . 0.0 113.321 -177.031 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.413 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.8 m -72.46 -25.58 61.5 Favored 'General case' 0 CA--C 1.582 2.184 0 O-C-N 120.076 -1.64 . . . . 0.0 114.516 163.259 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.653 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -66.34 -32.33 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.255 0 C-N-CA 123.091 0.556 . . . . 0.0 110.25 160.515 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.796 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 2.0 m-20 -69.07 -32.52 72.02 Favored 'General case' 0 CA--C 1.583 2.24 0 C-N-CA 124.526 1.13 . . . . 0.0 111.436 176.136 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.788 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.41 -28.4 53.93 Favored 'General case' 0 CA--C 1.584 2.265 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 158.068 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.023 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 25.6 mt -88.63 -4.72 58.5 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 116.317 1.969 . . . . 0.0 116.317 163.156 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.939 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.25 -18.43 60.1 Favored 'General case' 0 CA--C 1.586 2.356 0 O-C-N 119.913 -1.742 . . . . 0.0 111.283 153.681 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.788 HD12 ' HA ' ' A' ' 16' ' ' ALA . 35.3 mt -77.0 -37.27 55.45 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 129.014 2.926 . . . . 0.0 113.123 154.946 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.023 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.5 t -36.97 -40.81 0.31 Allowed 'General case' 0 CA--C 1.588 2.426 0 CA-C-O 124.927 2.298 . . . . 0.0 109.786 160.608 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.791 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 6.4 mmm180 . . . . . 0 N--CA 1.502 2.142 0 C-N-CA 127.743 2.417 . . . . 0.0 112.689 -170.677 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.906 ' O ' HG23 ' A' ' 11' ' ' VAL . 8.1 mt-10 . . . . . 0 N--CA 1.501 2.098 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.467 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 1.8 t80 -73.44 -27.61 61.52 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.136 -0.977 . . . . 0.0 113.418 177.833 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.674 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -79.0 -31.97 41.44 Favored Glycine 1 CA--C 1.584 4.382 0 CA-C-O 122.872 1.262 . . . . 0.0 111.998 165.628 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.581 HG23 ' HA ' ' A' ' 7' ' ' GLU . 1.9 t -58.27 -27.7 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 C-N-CA 124.999 1.319 . . . . 0.0 111.779 159.187 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 7' ' ' GLU . 47.3 t -76.2 -65.13 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 C-N-CA 125.268 1.427 . . . . 0.0 110.74 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.451 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.0 mt -68.43 -26.16 65.39 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 123.283 1.516 . . . . 0.0 113.236 -175.757 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.674 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -71.7 -39.56 70.12 Favored 'General case' 0 CA--C 1.583 2.228 0 O-C-N 120.516 -1.365 . . . . 0.0 114.227 162.0 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.679 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -56.47 -29.09 28.06 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.326 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.917 164.359 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.757 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 15.6 m-20 -74.05 -34.76 64.17 Favored 'General case' 0 N--CA 1.502 2.172 0 C-N-CA 124.896 1.278 . . . . 0.0 111.241 176.403 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.807 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -51.87 -27.42 12.65 Favored 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 124.596 1.158 . . . . 0.0 114.099 156.454 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.075 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 24.0 mt -90.34 -11.79 39.61 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 163.307 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.48 -16.42 63.88 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-O 124.503 2.096 . . . . 0.0 111.215 155.068 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.807 HD12 ' HA ' ' A' ' 16' ' ' ALA . 41.9 mt -78.89 -43.46 24.88 Favored 'General case' 0 CA--C 1.575 1.941 0 C-N-CA 129.502 3.121 . . . . 0.0 113.154 155.555 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.075 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -35.39 -39.48 0.13 Allowed 'General case' 0 N--CA 1.509 2.482 0 CA-C-O 125.321 2.486 . . . . 0.0 109.506 158.331 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.562 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 1.2 tpp180 . . . . . 0 CA--C 1.58 2.103 0 C-N-CA 128.34 2.656 . . . . 0.0 112.262 -157.569 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.906 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.9 mt-10 . . . . . 0 N--CA 1.502 2.144 0 CA-C-O 121.103 0.478 . . . . 0.0 111.453 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.464 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 1.6 t80 -73.47 -26.36 60.88 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.113 -0.992 . . . . 0.0 113.186 173.95 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.16 -33.52 32.32 Favored Glycine 1 CA--C 1.583 4.295 0 CA-C-O 122.701 1.167 . . . . 0.0 112.203 166.157 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.661 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.1 t -53.38 -28.41 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.248 0 O-C-N 120.788 -1.419 . . . . 0.0 111.675 157.493 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 7' ' ' GLU . 41.7 t -77.18 -62.94 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 C-N-CA 125.225 1.41 . . . . 0.0 110.956 -179.812 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.435 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.6 mt -70.05 -29.26 66.23 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-O 123.074 1.416 . . . . 0.0 113.377 -173.83 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m -72.94 -25.91 61.2 Favored 'General case' 0 CA--C 1.581 2.164 0 O-C-N 120.302 -1.499 . . . . 0.0 114.672 162.618 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.498 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -65.74 -30.48 50.21 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.263 0 O-C-N 121.764 -0.585 . . . . 0.0 110.173 160.466 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.732 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 2.5 m-20 -71.95 -34.35 68.95 Favored 'General case' 0 CA--C 1.582 2.197 0 C-N-CA 124.559 1.144 . . . . 0.0 111.399 177.884 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.783 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.39 -27.53 16.11 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 157.113 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.067 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 30.6 mt -88.22 -13.77 40.2 Favored 'General case' 0 N--CA 1.505 2.284 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 163.255 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.968 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.0 -14.55 63.05 Favored 'General case' 0 N--CA 1.512 2.646 0 CA-C-O 124.447 2.07 . . . . 0.0 111.382 155.049 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.783 HD12 ' HA ' ' A' ' 16' ' ' ALA . 48.0 mt -81.83 -43.13 18.69 Favored 'General case' 0 CA--C 1.575 1.905 0 C-N-CA 129.238 3.015 . . . . 0.0 113.086 155.6 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' SER . . . . . 1.067 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -35.37 -38.62 0.1 Allowed 'General case' 0 N--CA 1.511 2.617 0 CA-C-O 125.497 2.57 . . . . 0.0 109.225 158.015 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.567 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.58 2.115 0 C-N-CA 129.52 3.128 . . . . 0.0 111.756 -162.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 tmm? . . . . . 0 N--CA 1.499 2.018 0 CA-C-O 120.803 0.335 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.631 ' HG2' ' HE3' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -163.32 -102.8 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.931 -1.106 . . . . 0.0 112.531 -157.369 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.42 ' H ' ' HB3' ' A' ' 2' ' ' GLU . 0.6 OUTLIER 35.82 41.5 0.12 Allowed 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 125.381 1.473 . . . . 0.0 114.405 168.032 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.631 ' HE3' ' HG2' ' A' ' 2' ' ' GLU . 0.0 OUTLIER -21.47 88.3 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.222 0 C-N-CA 125.045 1.338 . . . . 0.0 113.71 156.366 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.806 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -120.75 -27.09 5.13 Favored 'General case' 0 N--CA 1.509 2.485 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 164.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.37 7.32 0.46 Allowed 'General case' 0 CA--C 1.583 2.24 0 O-C-N 120.811 -1.18 . . . . 0.0 112.671 153.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.866 ' O ' HG23 ' A' ' 11' ' ' VAL . 13.5 mt-10 -140.8 -2.09 1.37 Allowed 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 126.507 1.923 . . . . 0.0 112.64 170.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.806 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.1 OUTLIER -73.24 -26.65 61.21 Favored 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 124.239 1.015 . . . . 0.0 113.551 169.752 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.76 -36.37 29.22 Favored Glycine 1 CA--C 1.581 4.173 0 O-C-N 121.061 -1.024 . . . . 0.0 112.535 170.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.554 ' CG2' ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -47.4 -33.46 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 120.805 -1.409 . . . . 0.0 111.294 156.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.866 HG23 ' O ' ' A' ' 7' ' ' GLU . 32.6 t -76.21 -62.13 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 C-N-CA 125.006 1.322 . . . . 0.0 110.911 -174.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.482 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.1 mt -70.37 -28.42 65.1 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.598 -1.314 . . . . 0.0 113.583 -175.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 m -72.88 -26.46 61.45 Favored 'General case' 0 CA--C 1.58 2.106 0 O-C-N 120.368 -1.457 . . . . 0.0 114.486 162.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.589 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -65.16 -31.52 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.241 0 O-C-N 121.808 -0.557 . . . . 0.0 110.031 161.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.778 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 56.0 m-20 -70.36 -36.93 74.48 Favored 'General case' 0 CA--C 1.581 2.163 0 C-N-CA 124.578 1.151 . . . . 0.0 111.823 178.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.806 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -50.78 -27.66 7.69 Favored 'General case' 0 CA--C 1.587 2.386 0 C-N-CA 124.98 1.312 . . . . 0.0 114.283 156.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.027 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 28.6 mt -87.28 -13.27 44.17 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 116.188 1.921 . . . . 0.0 116.188 164.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.978 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -69.9 -13.29 62.18 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 119.856 -1.778 . . . . 0.0 111.593 155.461 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.923 ' HA ' ' HG2' ' A' ' 22' ' ' GLN . 29.9 mt -85.51 -36.96 20.19 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 130.6 3.56 . . . . 0.0 113.36 154.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.027 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -38.29 -36.97 0.26 Allowed 'General case' 0 N--CA 1.515 2.776 0 CA-C-O 125.882 2.753 . . . . 0.0 108.424 158.525 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.707 ' HG3' ' H ' ' A' ' 23' ' ' SER . 0.0 OUTLIER -93.96 -54.32 3.64 Favored 'General case' 0 CA--C 1.582 2.174 1 C-N-CA 132.626 4.371 . . . . 0.0 111.992 173.129 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.923 ' HG2' ' HA ' ' A' ' 19' ' ' LEU . 9.0 mt-30 53.52 -28.04 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.525 1 C-N-CA 132.728 4.411 . . . . 0.0 117.211 -159.629 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.707 ' H ' ' HG3' ' A' ' 21' ' ' ARG . 0.4 OUTLIER 176.5 98.8 0.11 Allowed Pre-proline 0 CA--C 1.584 2.271 0 N-CA-C 116.647 2.091 . . . . 0.0 116.647 -160.013 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.688 ' C ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -5.27 66.19 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.255 1 C-N-CA 128.237 5.958 . . . . 0.0 117.922 172.418 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.723 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER 27.64 -157.4 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 127.024 2.13 . . . . 0.0 115.714 179.456 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -29.75 -98.73 0.01 OUTLIER Glycine 0 CA--C 1.572 3.625 0 O-C-N 120.322 -1.486 . . . . 0.0 115.519 164.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.351 0.662 0 O-C-N 120.717 -1.461 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.033 0 CA-C-O 120.741 0.305 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.724 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 4.3 pm0 -120.75 20.37 11.7 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.983 -1.073 . . . . 0.0 112.827 -168.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.724 ' HB2' ' O ' ' A' ' 2' ' ' GLU . 0.0 OUTLIER 142.74 51.69 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 127.321 2.248 . . . . 0.0 113.206 -175.176 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.98 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 4.4 mptt 52.61 59.04 4.76 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.634 -1.291 . . . . 0.0 113.354 157.032 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.495 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -74.26 -28.56 61.27 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.727 -1.233 . . . . 0.0 113.976 156.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.644 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 1.5 t -68.22 9.72 0.29 Allowed 'General case' 0 CA--C 1.583 2.234 0 O-C-N 120.709 -1.244 . . . . 0.0 112.735 154.026 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.98 ' HB2' ' HB3' ' A' ' 4' ' ' LYS . 6.5 mt-10 -145.22 21.2 1.56 Allowed 'General case' 0 N--CA 1.501 2.094 0 C-N-CA 126.468 1.907 . . . . 0.0 111.642 166.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.495 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.9 OUTLIER -70.09 -30.58 67.83 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.39 -0.819 . . . . 0.0 112.865 157.418 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.69 -28.07 52.34 Favored Glycine 1 CA--C 1.584 4.355 0 CA-C-O 122.435 1.019 . . . . 0.0 111.79 171.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.712 HG23 ' HA ' ' A' ' 7' ' ' GLU . 5.1 t -56.67 -29.56 30.06 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 C-N-CA 125.24 1.416 . . . . 0.0 111.705 156.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.852 HG23 ' O ' ' A' ' 7' ' ' GLU . 18.4 t -76.5 -45.3 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 C-N-CA 124.987 1.315 . . . . 0.0 110.581 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.427 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.0 mt -67.88 -27.52 66.74 Favored 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 123.208 1.48 . . . . 0.0 113.546 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.74 -27.51 62.08 Favored 'General case' 0 CA--C 1.582 2.177 0 O-C-N 120.226 -1.546 . . . . 0.0 114.546 163.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.99 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -65.35 -31.93 55.99 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 122.87 0.468 . . . . 0.0 110.318 161.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.947 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 12.6 m-20 -68.08 -35.66 78.54 Favored 'General case' 0 CA--C 1.581 2.157 0 C-N-CA 124.837 1.255 . . . . 0.0 111.667 175.138 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.815 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.64 -28.5 55.68 Favored 'General case' 0 CA--C 1.584 2.269 0 C-N-CA 124.1 0.96 . . . . 0.0 113.521 156.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.049 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 23.4 mt -89.08 -0.6 57.57 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 164.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 1.028 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -74.39 -29.68 61.64 Favored 'General case' 0 CA--C 1.592 2.574 0 CA-C-O 125.8 2.714 . . . . 0.0 110.818 153.734 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.815 HD12 ' HA ' ' A' ' 16' ' ' ALA . 35.2 mt -64.99 -40.12 94.48 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 128.704 2.802 . . . . 0.0 113.882 154.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.049 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.2 t -37.67 -43.18 0.61 Allowed 'General case' 0 CA--C 1.589 2.469 0 CA-C-O 124.971 2.319 . . . . 0.0 109.732 161.065 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 1.028 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -81.73 -43.28 18.64 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 127.268 2.227 . . . . 0.0 112.596 -168.446 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.504 ' HG3' ' HA ' ' A' ' 19' ' ' LEU . 5.9 mt-30 -38.05 -77.48 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.276 0 CA-C-O 123.087 1.422 . . . . 0.0 111.41 157.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 84.7 p -47.09 92.38 0.05 OUTLIER Pre-proline 0 N--CA 1.502 2.151 0 C-N-CA 124.89 1.276 . . . . 0.0 113.385 173.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -64.54 -144.43 0.01 OUTLIER 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 124.105 3.203 . . . . 0.0 115.16 -174.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.689 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -83.15 -177.48 6.77 Favored 'General case' 0 N--CA 1.502 2.16 0 C-N-CA 125.29 1.436 . . . . 0.0 114.043 -158.251 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 28.02 94.02 0.01 OUTLIER Glycine 0 CA--C 1.571 3.575 0 N-CA-C 117.091 1.597 . . . . 0.0 117.091 156.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.553 0 O-C-N 120.83 -1.394 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.499 2.015 0 CA-C-O 120.809 0.338 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.453 ' HB3' ' H ' ' A' ' 3' ' ' LEU . 2.1 mt-10 61.95 -136.07 0.52 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.002 -1.061 . . . . 0.0 112.514 -162.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.575 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 0.1 OUTLIER 61.4 67.39 0.79 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.598 -1.314 . . . . 0.0 113.124 -173.049 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.834 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 0.2 OUTLIER 114.09 69.58 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 127.498 2.319 . . . . 0.0 112.391 -158.688 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.746 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -83.73 -30.77 26.43 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 156.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.464 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 0.6 OUTLIER -66.95 5.83 0.6 Allowed 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.464 -1.398 . . . . 0.0 112.931 155.601 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.889 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.2 mt-10 -143.26 15.97 1.87 Allowed 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 126.064 1.745 . . . . 0.0 112.008 168.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.746 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 3.0 t80 -71.08 -27.83 63.9 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.263 -0.898 . . . . 0.0 113.136 164.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.28 -36.61 30.38 Favored Glycine 1 CA--C 1.584 4.396 0 CA-C-O 122.77 1.205 . . . . 0.0 111.939 169.463 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.649 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.8 t -50.25 -29.99 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 C-N-CA 125.158 1.383 . . . . 0.0 111.751 157.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.889 HG23 ' O ' ' A' ' 7' ' ' GLU . 38.5 t -75.83 -61.7 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 C-N-CA 124.747 1.219 . . . . 0.0 111.005 -178.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.48 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.0 mt -64.4 -24.9 67.79 Favored 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 123.118 1.437 . . . . 0.0 113.675 -174.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.849 ' O ' HD13 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -73.17 -29.01 62.54 Favored 'General case' 0 CA--C 1.579 2.083 0 O-C-N 120.304 -1.498 . . . . 0.0 114.557 162.029 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.872 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -70.45 -19.32 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.586 2.342 0 CA-C-O 117.124 -1.417 . . . . 0.0 110.935 162.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.873 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 38.6 m-20 -73.65 -38.46 64.97 Favored 'General case' 0 CA--C 1.581 2.148 0 O-C-N 124.372 1.045 . . . . 0.0 110.908 167.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.82 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -50.78 -28.84 10.11 Favored 'General case' 0 CA--C 1.59 2.51 0 C-N-CA 125.285 1.434 . . . . 0.0 112.465 151.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.874 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.2 OUTLIER -88.94 -5.01 58.28 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 125.641 1.576 . . . . 0.0 114.981 168.131 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.962 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -77.6 -19.13 56.07 Favored 'General case' 0 CA--C 1.588 2.405 0 CA-C-O 124.683 2.182 . . . . 0.0 111.708 153.263 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.82 HD12 ' HA ' ' A' ' 16' ' ' ALA . 36.3 mt -76.08 -32.3 59.18 Favored 'General case' 0 CA--C 1.575 1.923 0 C-N-CA 129.073 2.949 . . . . 0.0 112.581 154.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.874 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -40.33 -40.73 1.22 Allowed 'General case' 0 N--CA 1.507 2.401 0 CA-C-O 124.563 2.125 . . . . 0.0 110.179 160.037 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.962 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -96.17 -53.99 3.45 Favored 'General case' 0 N--CA 1.502 2.132 0 C-N-CA 127.176 2.19 . . . . 0.0 112.527 -160.47 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.834 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 13.4 mt-30 -37.43 -81.25 0.01 OUTLIER 'General case' 0 CA--C 1.582 2.194 0 C-N-CA 124.345 1.058 . . . . 0.0 112.175 161.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t 13.97 98.82 0.02 OUTLIER Pre-proline 0 CA--C 1.581 2.17 0 C-N-CA 126.61 1.964 . . . . 0.0 114.96 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.462 ' HB3' HD22 ' A' ' 25' ' ' LEU . 88.1 Cg_exo -62.11 -142.34 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.586 0 C-N-CA 124.535 3.49 . . . . 0.0 115.124 -176.196 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.472 HD22 ' N ' ' A' ' 25' ' ' LEU . 1.5 mm? -83.96 24.6 0.9 Allowed 'General case' 0 CA--C 1.602 2.953 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -156.345 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -37.83 -59.39 1.38 Allowed Glycine 0 CA--C 1.577 3.957 0 CA-C-N 114.12 -1.4 . . . . 0.0 113.737 174.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.59 0 O-C-N 121.148 -1.207 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 120.65 0.262 . . . . 0.0 111.303 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -125.71 -156.56 0.74 Allowed 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.003 -1.06 . . . . 0.0 113.048 -178.052 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.716 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 2.7 mt -49.44 -4.23 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 125.426 1.49 . . . . 0.0 114.76 173.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 1.055 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 1.4 mtpp 91.43 66.64 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 125.382 1.473 . . . . 0.0 112.277 175.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.683 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -75.46 -28.86 59.44 Favored 'General case' 0 N--CA 1.504 2.256 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 159.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.477 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 2.7 m -68.42 7.31 0.63 Allowed 'General case' 0 CA--C 1.582 2.182 0 O-C-N 120.511 -1.368 . . . . 0.0 113.021 154.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 1.055 ' HB2' ' HB3' ' A' ' 4' ' ' LYS . 4.7 mt-10 -142.35 14.43 2.01 Favored 'General case' 0 N--CA 1.502 2.161 0 C-N-CA 126.694 1.998 . . . . 0.0 111.865 171.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.683 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 2.3 t80 -73.35 -29.3 62.57 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.93 -1.106 . . . . 0.0 113.028 170.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.55 -35.06 37.78 Favored Glycine 1 CA--C 1.584 4.385 0 CA-C-O 122.763 1.202 . . . . 0.0 111.925 170.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.601 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -49.05 -32.41 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 C-N-CA 125.306 1.442 . . . . 0.0 111.441 157.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.871 HG23 ' O ' ' A' ' 7' ' ' GLU . 28.6 t -76.55 -58.26 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 C-N-CA 124.839 1.256 . . . . 0.0 110.971 -176.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.42 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.2 mt -59.79 -28.4 67.4 Favored 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 125.274 1.43 . . . . 0.0 114.196 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.722 ' O ' HD13 ' A' ' 17' ' ' LEU . 1.0 OUTLIER -72.75 -27.53 62.08 Favored 'General case' 0 CA--C 1.582 2.179 0 O-C-N 120.378 -1.451 . . . . 0.0 114.664 163.596 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.871 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -70.62 -20.56 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.25 0 CA-C-O 117.487 -1.244 . . . . 0.0 111.164 161.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.871 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 5.5 m-20 -74.96 -38.66 61.64 Favored 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 124.448 1.099 . . . . 0.0 111.398 171.432 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.741 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -52.41 -27.98 18.02 Favored 'General case' 0 CA--C 1.59 2.507 0 C-N-CA 124.902 1.281 . . . . 0.0 112.403 152.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.835 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.71 -6.57 58.8 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 125.941 1.696 . . . . 0.0 114.623 167.413 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.915 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -77.39 -19.03 56.79 Favored 'General case' 0 CA--C 1.586 2.355 0 CA-C-O 124.445 2.069 . . . . 0.0 111.863 153.467 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.741 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 37.9 mt -77.2 -30.95 54.98 Favored 'General case' 0 CA--C 1.575 1.909 0 C-N-CA 128.721 2.808 . . . . 0.0 112.629 154.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.835 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -40.91 -39.31 1.12 Allowed 'General case' 0 CA--C 1.59 2.49 0 CA-C-O 124.783 2.23 . . . . 0.0 109.861 159.822 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.915 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 1.3 mmt180 -94.82 -54.41 3.49 Favored 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 127.603 2.361 . . . . 0.0 112.498 -163.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 8.9 mt-30 -42.14 -83.39 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.163 0 C-N-CA 124.37 1.068 . . . . 0.0 112.131 164.044 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.3 t -30.83 111.95 0.3 Allowed Pre-proline 0 CA--C 1.58 2.134 0 C-N-CA 125.694 1.598 . . . . 0.0 114.265 -172.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.564 ' C ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -1.41 61.3 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.231 1 C-N-CA 128.006 5.804 . . . . 0.0 117.857 177.812 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.709 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER 23.82 -161.43 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 127.051 2.14 . . . . 0.0 115.43 -166.739 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.08 107.53 3.26 Favored Glycine 0 CA--C 1.575 3.84 0 O-C-N 120.243 -1.536 . . . . 0.0 114.179 171.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.59 0 O-C-N 121.006 -1.29 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.484 ' HG2' ' N ' ' A' ' 2' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.0 0 CA-C-O 120.675 0.274 . . . . 0.0 111.342 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.484 ' N ' ' HG2' ' A' ' 1' ' ' MET . 5.5 mm-40 -120.2 61.26 0.86 Allowed 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.962 -1.087 . . . . 0.0 112.723 159.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.607 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 1.1 mt -62.76 21.18 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.394 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 -178.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 1.094 ' CB ' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 84.31 97.18 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 119.754 -1.841 . . . . 0.0 112.502 167.984 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.75 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -88.39 -29.77 20.0 Favored 'General case' 0 N--CA 1.506 2.344 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 160.08 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.504 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 15.3 m -69.17 7.95 0.66 Allowed 'General case' 0 CA--C 1.582 2.174 0 O-C-N 120.475 -1.391 . . . . 0.0 112.98 154.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 1.094 ' HB2' ' CB ' ' A' ' 4' ' ' LYS . 7.5 mt-10 -147.59 12.61 1.03 Allowed 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 126.46 1.904 . . . . 0.0 111.874 174.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.75 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 13.8 t80 -73.68 -26.82 60.91 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.933 -1.104 . . . . 0.0 113.219 177.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.09 -34.62 32.82 Favored Glycine 1 CA--C 1.582 4.249 0 CA-C-O 122.303 0.946 . . . . 0.0 112.504 165.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.617 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.0 t -51.74 -31.63 13.28 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 O-C-N 120.884 -1.362 . . . . 0.0 111.422 158.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 7' ' ' GLU . 41.5 t -77.09 -63.89 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 C-N-CA 125.152 1.381 . . . . 0.0 110.846 -176.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 15' ' ' ASP . 5.2 mt -70.18 -29.94 66.94 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 123.51 1.624 . . . . 0.0 113.601 -175.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.416 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 3.6 m -73.19 -24.77 60.58 Favored 'General case' 0 CA--C 1.581 2.153 0 O-C-N 119.739 -1.851 . . . . 0.0 114.422 162.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.934 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.37 -30.39 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.239 0 O-C-N 121.794 -0.566 . . . . 0.0 110.283 160.065 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.9 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 20.5 m-20 -69.95 -35.34 74.43 Favored 'General case' 0 CA--C 1.581 2.17 0 C-N-CA 124.291 1.037 . . . . 0.0 111.55 176.342 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.755 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -52.03 -28.49 17.36 Favored 'General case' 0 CA--C 1.585 2.3 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 156.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.07 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 26.7 mt -88.16 -8.81 54.83 Favored 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 163.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.934 ' HE3' HG12 ' A' ' 14' ' ' VAL . 0.0 OUTLIER -71.0 -18.47 62.6 Favored 'General case' 0 N--CA 1.508 2.452 0 CA-C-O 124.894 2.283 . . . . 0.0 111.268 154.654 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.755 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 42.9 mt -76.46 -41.34 47.67 Favored 'General case' 0 CA--C 1.575 1.932 0 C-N-CA 129.498 3.119 . . . . 0.0 113.124 154.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.07 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.86 -40.67 0.47 Allowed 'General case' 0 CA--C 1.59 2.498 0 CA-C-O 125.315 2.483 . . . . 0.0 109.343 158.786 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.512 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -84.18 -45.23 13.16 Favored 'General case' 0 CA--C 1.579 2.079 0 C-N-CA 128.032 2.533 . . . . 0.0 112.508 -168.532 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.44 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 1.6 mt-30 -54.32 -80.09 0.02 OUTLIER 'General case' 0 CA--C 1.581 2.137 0 C-N-CA 125.548 1.539 . . . . 0.0 112.414 166.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.9 t -26.07 93.31 0.05 OUTLIER Pre-proline 0 CA--C 1.581 2.137 0 C-N-CA 125.28 1.432 . . . . 0.0 113.449 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.66 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -6.72 61.76 0.0 OUTLIER 'Trans proline' 0 CA--C 1.57 2.303 1 C-N-CA 127.764 5.643 . . . . 0.0 118.207 -175.721 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.683 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER 26.4 -157.47 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 127.977 2.511 . . . . 0.0 116.57 173.749 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.8 -131.23 3.05 Favored Glycine 0 CA--C 1.576 3.847 0 O-C-N 119.961 -1.712 . . . . 0.0 114.056 165.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.624 0 O-C-N 121.014 -1.286 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.018 0 CA-C-O 120.844 0.354 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -11.84 61.17 Favored 'General case' 0 N--CA 1.501 2.093 0 C-N-CA 124.196 0.998 . . . . 0.0 112.72 -172.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 57.41 14.33 2.16 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 124.453 1.101 . . . . 0.0 113.621 -164.48 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.851 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 39.98 67.34 0.49 Allowed 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 124.863 1.265 . . . . 0.0 113.732 163.352 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.726 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -82.13 -30.94 30.84 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 161.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 33.3 t -68.87 6.66 0.83 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.324 -1.485 . . . . 0.0 113.316 155.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.914 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.6 mt-10 -144.25 16.5 1.7 Allowed 'General case' 0 N--CA 1.502 2.161 0 C-N-CA 126.131 1.772 . . . . 0.0 111.829 172.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.726 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 2.0 t80 -73.28 -27.5 61.6 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.811 -1.181 . . . . 0.0 113.205 177.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.79 -38.03 28.46 Favored Glycine 1 CA--C 1.582 4.257 0 CA-C-O 122.71 1.172 . . . . 0.0 112.371 166.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 7' ' ' GLU . 1.9 t -48.31 -31.09 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 120.732 -1.452 . . . . 0.0 111.298 158.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 7' ' ' GLU . 42.3 t -77.07 -66.08 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 C-N-CA 125.08 1.352 . . . . 0.0 110.915 -178.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.447 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.4 mt -66.26 -28.47 68.74 Favored 'General case' 0 N--CA 1.503 2.206 0 CA-C-O 122.759 1.266 . . . . 0.0 113.588 -173.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.733 ' O ' HD13 ' A' ' 17' ' ' LEU . 19.2 m -72.67 -24.97 61.1 Favored 'General case' 0 CA--C 1.582 2.174 0 O-C-N 120.334 -1.479 . . . . 0.0 114.366 162.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.785 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t -72.39 -20.2 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.263 0 CA-C-O 117.38 -1.295 . . . . 0.0 111.088 161.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.739 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.5 m-20 -74.92 -38.74 61.72 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 124.316 1.01 . . . . 0.0 111.363 170.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.738 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -51.78 -27.3 11.76 Favored 'General case' 0 CA--C 1.59 2.512 0 C-N-CA 125.072 1.349 . . . . 0.0 112.528 151.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.874 ' CA ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -87.86 -7.64 56.94 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 125.836 1.654 . . . . 0.0 114.814 167.007 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.972 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -76.09 -17.77 59.47 Favored 'General case' 0 CA--C 1.588 2.417 0 O-C-N 118.88 -2.387 . . . . 0.0 111.739 153.936 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.738 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 37.8 mt -78.43 -33.89 48.29 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 129.102 2.961 . . . . 0.0 112.744 154.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.874 ' HB2' ' CA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -39.72 -38.62 0.66 Allowed 'General case' 0 CA--C 1.591 2.54 0 CA-C-O 125.643 2.64 . . . . 0.0 109.591 158.645 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -99.5 -44.69 6.07 Favored 'General case' 0 CA--C 1.58 2.12 0 C-N-CA 128.731 2.812 . . . . 0.0 112.206 -156.799 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -58.92 -92.83 0.0 OUTLIER 'General case' 0 CA--C 1.578 2.046 0 C-N-CA 126.073 1.749 . . . . 0.0 112.539 177.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -31.73 94.74 0.07 OUTLIER Pre-proline 0 CA--C 1.581 2.166 0 C-N-CA 125.976 1.71 . . . . 0.0 114.665 -159.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -7.16 69.39 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.268 1 C-N-CA 127.464 5.443 . . . . 0.0 117.442 174.378 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.446 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 2.3 mp 48.82 126.85 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 155.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.07 -147.35 0.65 Allowed Glycine 0 CA--C 1.575 3.841 0 O-C-N 119.188 -2.195 . . . . 0.0 114.114 -164.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.578 0 O-C-N 120.937 -1.331 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.035 0 CA-C-O 120.861 0.362 . . . . 0.0 111.302 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 68.27 46.1 1.14 Allowed 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 124.283 1.033 . . . . 0.0 112.891 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 70.57 -2.33 2.25 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.967 -1.083 . . . . 0.0 113.493 168.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.573 ' HG2' ' OE1' ' A' ' 7' ' ' GLU . 2.7 mtpp 40.15 72.05 0.16 Allowed 'General case' 0 N--CA 1.504 2.254 0 C-N-CA 124.847 1.259 . . . . 0.0 113.663 169.141 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.56 -26.52 14.77 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 157.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.4 m -66.52 7.34 0.34 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.875 -1.141 . . . . 0.0 112.402 154.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.622 ' HA ' HG23 ' A' ' 10' ' ' VAL . 13.0 mt-10 -145.5 2.12 0.95 Allowed 'General case' 0 N--CA 1.501 2.125 0 C-N-CA 125.633 1.573 . . . . 0.0 113.105 168.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.528 ' CE1' HD21 ' A' ' 12' ' ' LEU . 3.2 t80 -73.33 -34.82 65.86 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.701 -1.249 . . . . 0.0 113.398 157.042 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.07 -41.82 98.36 Favored Glycine 1 CA--C 1.585 4.458 0 CA-C-O 122.414 1.008 . . . . 0.0 112.322 172.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.5 t -42.26 -37.67 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.25 0 C-N-CA 125.2 1.4 . . . . 0.0 111.243 159.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 7' ' ' GLU . 16.2 t -76.82 -50.39 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 C-N-CA 125.439 1.496 . . . . 0.0 110.737 -172.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.528 HD21 ' CE1' ' A' ' 8' ' ' PHE . 3.8 mt -70.07 -19.71 63.26 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 120.408 -1.432 . . . . 0.0 113.081 -175.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.748 ' O ' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -73.21 -30.04 63.23 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 162.601 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.782 ' HA ' HD22 ' A' ' 17' ' ' LEU . 2.1 t -67.43 -26.76 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.322 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.619 162.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.799 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 59.4 m-20 -70.39 -37.96 74.59 Favored 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 124.291 1.036 . . . . 0.0 111.553 169.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.744 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -53.5 -26.8 22.3 Favored 'General case' 0 CA--C 1.588 2.438 0 CA-C-O 122.847 1.308 . . . . 0.0 112.496 153.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.871 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.0 OUTLIER -88.02 -6.67 57.85 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 126.883 2.073 . . . . 0.0 114.654 167.634 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.964 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -79.24 -20.32 48.49 Favored 'General case' 0 CA--C 1.584 2.264 0 O-C-N 119.552 -1.967 . . . . 0.0 112.014 154.404 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.744 HD12 ' HA ' ' A' ' 16' ' ' ALA . 28.8 mt -77.33 -29.38 53.48 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 128.632 2.773 . . . . 0.0 112.681 155.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.871 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.17 -37.97 0.19 Allowed 'General case' 0 CA--C 1.59 2.487 0 CA-C-O 125.289 2.471 . . . . 0.0 109.65 157.597 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.85 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -102.58 -55.82 2.37 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 128.014 2.525 . . . . 0.0 112.359 -158.266 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.68 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 3.6 mt-30 -47.61 -37.45 12.6 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 125.383 1.473 . . . . 0.0 112.844 176.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.6 t 35.52 79.69 0.29 Allowed Pre-proline 0 CA--C 1.582 2.199 0 CA-C-O 117.556 -1.211 . . . . 0.0 113.948 177.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -7.32 70.94 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.268 1 C-N-CA 127.409 5.406 . . . . 0.0 117.52 175.837 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.724 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -28.0 149.75 0.0 OUTLIER 'General case' 0 CA--C 1.577 2.019 0 C-N-CA 124.808 1.243 . . . . 0.0 113.676 168.843 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 82.57 101.6 0.47 Allowed Glycine 0 CA--C 1.575 3.803 0 O-C-N 120.956 -1.09 . . . . 0.0 113.936 170.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.581 0 O-C-N 120.98 -1.306 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.501 ' O ' ' HB2' ' A' ' 2' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.577 2.0 0 CA-C-O 120.705 0.288 . . . . 0.0 111.277 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.513 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 14.2 mt-10 75.23 85.94 0.09 Allowed 'General case' 0 N--CA 1.501 2.116 0 C-N-CA 124.155 0.982 . . . . 0.0 112.87 -171.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.513 ' HB2' ' O ' ' A' ' 2' ' ' GLU . 0.1 OUTLIER 152.14 -79.01 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 126.34 1.856 . . . . 0.0 113.0 -168.166 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 25.05 50.4 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 125.747 1.619 . . . . 0.0 114.4 -177.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.822 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -82.53 -31.53 29.11 Favored 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 159.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.54 9.53 0.34 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.256 -1.528 . . . . 0.0 113.035 155.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.915 ' O ' HG23 ' A' ' 11' ' ' VAL . 13.0 mt-10 -142.93 12.67 1.85 Allowed 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 125.953 1.701 . . . . 0.0 112.098 167.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.822 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.7 OUTLIER -72.36 -25.3 61.48 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 124.107 0.963 . . . . 0.0 113.166 170.788 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.09 -36.25 25.15 Favored Glycine 1 CA--C 1.581 4.206 0 CA-C-O 122.212 0.895 . . . . 0.0 112.444 166.097 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.614 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.5 t -51.13 -29.39 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 O-C-N 120.827 -1.396 . . . . 0.0 111.712 157.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.915 HG23 ' O ' ' A' ' 7' ' ' GLU . 45.4 t -76.16 -64.47 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 C-N-CA 125.056 1.342 . . . . 0.0 110.93 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.41 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.4 mt -70.29 -29.4 66.15 Favored 'General case' 0 N--CA 1.502 2.152 0 CA-C-O 122.934 1.35 . . . . 0.0 113.515 -174.112 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.7 m -73.0 -26.48 61.34 Favored 'General case' 0 CA--C 1.58 2.134 0 O-C-N 120.338 -1.476 . . . . 0.0 114.538 162.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.613 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -65.19 -30.16 49.46 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.259 0 O-C-N 121.759 -0.588 . . . . 0.0 110.192 160.726 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.731 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 56.0 m-20 -71.91 -35.8 69.79 Favored 'General case' 0 CA--C 1.582 2.174 0 C-N-CA 124.589 1.155 . . . . 0.0 111.548 177.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.775 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.17 -28.4 18.03 Favored 'General case' 0 CA--C 1.585 2.296 0 C-N-CA 124.765 1.226 . . . . 0.0 113.823 155.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.006 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 27.7 mt -86.27 -11.29 52.7 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 163.31 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 1.004 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.08 -14.95 62.49 Favored 'General case' 0 N--CA 1.508 2.473 0 CA-C-O 124.317 2.008 . . . . 0.0 111.606 154.736 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.775 HD12 ' HA ' ' A' ' 16' ' ' ALA . 36.9 mt -81.15 -39.06 26.12 Favored 'General case' 0 CA--C 1.574 1.9 0 C-N-CA 128.857 2.863 . . . . 0.0 113.079 154.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.006 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -37.02 -39.91 0.26 Allowed 'General case' 0 CA--C 1.59 2.496 0 CA-C-O 124.806 2.241 . . . . 0.0 109.261 161.022 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.788 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -83.23 -48.32 10.6 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 127.327 2.251 . . . . 0.0 112.349 179.908 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.85 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 15.7 mt-30 -74.34 -95.42 0.02 OUTLIER 'General case' 0 CA--C 1.576 1.98 0 C-N-CA 126.069 1.748 . . . . 0.0 113.154 168.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.4 p 4.25 110.18 0.0 OUTLIER Pre-proline 0 CA--C 1.581 2.156 0 C-N-CA 128.114 2.566 . . . . 0.0 115.545 -167.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -59.34 -143.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.577 2.66 0 C-N-CA 124.927 3.751 . . . . 0.0 115.076 174.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.678 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -80.18 156.07 27.11 Favored 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 125.303 1.441 . . . . 0.0 114.279 -156.641 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 43.42 78.58 0.07 OUTLIER Glycine 0 CA--C 1.575 3.831 0 O-C-N 120.821 -1.174 . . . . 0.0 113.884 -171.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.603 0 O-C-N 121.019 -1.283 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 120.8 0.333 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -117.83 41.75 2.8 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.035 -1.04 . . . . 0.0 112.828 171.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -47.34 -59.45 3.19 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.039 -1.038 . . . . 0.0 112.881 -168.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -54.76 -19.8 7.1 Favored 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 176.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.802 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -74.81 -30.16 61.32 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 119.877 -1.765 . . . . 0.0 113.789 159.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 t -68.89 13.2 0.11 Allowed 'General case' 0 CA--C 1.584 2.264 0 O-C-N 120.93 -1.106 . . . . 0.0 112.747 153.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.906 ' O ' HG23 ' A' ' 11' ' ' VAL . 4.8 mt-10 -136.64 1.32 2.56 Favored 'General case' 0 N--CA 1.502 2.154 0 C-N-CA 126.187 1.795 . . . . 0.0 112.586 164.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.802 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 2.4 t80 -73.2 -24.42 60.52 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.416 1.086 . . . . 0.0 113.087 175.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.43 -35.48 22.99 Favored Glycine 1 CA--C 1.579 4.046 0 O-C-N 121.513 -0.742 . . . . 0.0 113.057 165.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.573 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -49.81 -30.94 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 O-C-N 120.851 -1.382 . . . . 0.0 111.197 157.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 7' ' ' GLU . 40.7 t -77.07 -67.18 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 C-N-CA 125.25 1.42 . . . . 0.0 110.924 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.1 mt -70.18 -27.69 64.72 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-O 123.227 1.489 . . . . 0.0 113.344 -174.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.722 ' O ' HD13 ' A' ' 17' ' ' LEU . 3.8 m -72.94 -24.16 60.77 Favored 'General case' 0 CA--C 1.581 2.136 0 O-C-N 120.169 -1.582 . . . . 0.0 114.401 161.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.999 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -70.56 -23.59 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.276 0 CA-C-O 117.233 -1.365 . . . . 0.0 110.868 160.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.914 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.2 m-20 -72.92 -39.62 66.13 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 124.485 1.116 . . . . 0.0 111.535 172.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.798 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.66 -27.94 19.47 Favored 'General case' 0 CA--C 1.59 2.5 0 C-N-CA 124.781 1.232 . . . . 0.0 112.454 152.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.898 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.19 -6.08 59.06 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 125.719 1.608 . . . . 0.0 115.151 166.275 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.999 ' HE3' HG12 ' A' ' 14' ' ' VAL . 0.1 OUTLIER -77.12 -17.45 58.64 Favored 'General case' 0 CA--C 1.588 2.407 0 CA-C-O 124.519 2.104 . . . . 0.0 111.819 152.661 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' A' ' 16' ' ' ALA . 38.4 mt -78.38 -32.02 48.68 Favored 'General case' 0 CA--C 1.574 1.894 0 C-N-CA 128.692 2.797 . . . . 0.0 112.593 154.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.898 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -41.01 -39.87 1.29 Allowed 'General case' 0 CA--C 1.59 2.481 0 CA-C-O 124.7 2.19 . . . . 0.0 109.957 160.499 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.902 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -94.52 -55.44 3.15 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 127.466 2.307 . . . . 0.0 112.557 -164.107 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.697 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 3.5 mt-30 -42.33 -86.95 0.0 OUTLIER 'General case' 0 CA--C 1.578 2.053 0 CA-C-O 123.342 1.544 . . . . 0.0 112.394 165.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.18 159.54 21.27 Favored Pre-proline 0 CA--C 1.587 2.369 0 C-N-CA 126.1 1.76 . . . . 0.0 115.356 -178.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -71.67 48.71 1.08 Allowed 'Trans proline' 0 CA--C 1.575 2.537 1 C-N-CA 126.187 4.591 . . . . 0.0 118.323 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.59 HD11 ' HB3' ' A' ' 19' ' ' LEU . 2.1 mp 54.91 -169.4 0.07 Allowed 'General case' 0 N--CA 1.505 2.313 0 O-C-N 119.247 -2.158 . . . . 0.0 114.33 155.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.67 -141.08 34.38 Favored Glycine 0 CA--C 1.575 3.793 0 O-C-N 120.734 -1.229 . . . . 0.0 114.166 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.587 0 O-C-N 120.901 -1.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 120.58 0.229 . . . . 0.0 111.218 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.618 ' O ' ' HG2' ' A' ' 2' ' ' GLU . 1.5 pm0 -158.6 108.77 2.05 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.02 -1.05 . . . . 0.0 113.177 -176.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.703 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -41.19 -39.54 1.34 Allowed 'General case' 0 N--CA 1.504 2.234 0 C-N-CA 125.104 1.362 . . . . 0.0 114.284 179.27 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.775 ' HG2' ' OE2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 85.76 45.85 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 125.813 1.645 . . . . 0.0 113.064 -156.445 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.793 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -77.19 -30.07 54.64 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 157.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.0 t -68.5 11.93 0.15 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.325 -1.484 . . . . 0.0 113.02 155.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.921 ' O ' HG23 ' A' ' 11' ' ' VAL . 9.9 mt-10 -142.17 10.16 1.91 Allowed 'General case' 0 N--CA 1.503 2.212 0 C-N-CA 125.847 1.659 . . . . 0.0 112.187 164.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.793 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.5 OUTLIER -72.97 -25.95 61.19 Favored 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 124.221 1.008 . . . . 0.0 113.25 170.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.511 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -78.25 -35.94 32.41 Favored Glycine 1 CA--C 1.582 4.279 0 CA-C-O 122.484 1.047 . . . . 0.0 112.439 166.621 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.611 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -51.99 -31.12 13.48 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.904 -1.35 . . . . 0.0 111.93 158.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.921 HG23 ' O ' ' A' ' 7' ' ' GLU . 41.6 t -75.9 -62.64 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 C-N-CA 125.103 1.361 . . . . 0.0 111.061 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.43 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.5 mt -70.6 -27.2 63.91 Favored 'General case' 0 N--CA 1.502 2.161 0 CA-C-O 122.801 1.286 . . . . 0.0 113.493 -174.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.4 t -73.39 -30.44 63.27 Favored 'General case' 0 CA--C 1.579 2.073 0 O-C-N 120.507 -1.371 . . . . 0.0 114.643 162.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.976 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -61.16 -32.11 51.94 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.29 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 161.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.888 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 29.5 m-20 -71.57 -31.73 67.3 Favored 'General case' 0 CA--C 1.582 2.21 0 C-N-CA 125.007 1.323 . . . . 0.0 111.101 174.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.933 ' HA ' HD23 ' A' ' 19' ' ' LEU . . . -57.08 -25.7 59.17 Favored 'General case' 0 CA--C 1.581 2.16 0 C-N-CA 124.67 1.188 . . . . 0.0 113.59 156.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.053 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 23.9 mt -91.36 -4.68 55.51 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 117.363 2.357 . . . . 0.0 117.363 163.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.976 ' HE3' HG12 ' A' ' 14' ' ' VAL . 0.0 OUTLIER -75.34 -26.88 58.94 Favored 'General case' 0 CA--C 1.587 2.39 0 CA-C-O 124.674 2.178 . . . . 0.0 111.418 154.969 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.933 HD23 ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -80.22 -18.11 50.45 Favored 'General case' 0 CA--C 1.586 2.357 0 C-N-CA 129.691 3.196 . . . . 0.0 112.595 157.722 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.053 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -52.36 -43.31 64.59 Favored 'General case' 0 CA--C 1.592 2.565 0 CA-C-O 125.425 2.536 . . . . 0.0 109.651 156.322 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.757 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -80.11 -60.16 2.44 Favored 'General case' 0 CA--C 1.58 2.108 0 C-N-CA 128.101 2.561 . . . . 0.0 112.0 -168.422 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 4.8 mt-30 -45.03 -86.28 0.0 OUTLIER 'General case' 0 CA--C 1.577 2.007 0 CA-C-N 114.204 -1.362 . . . . 0.0 112.441 168.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -37.83 104.83 0.3 Allowed Pre-proline 0 N--CA 1.502 2.128 0 C-N-CA 125.555 1.542 . . . . 0.0 114.096 -170.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -7.45 73.03 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.249 1 C-N-CA 127.322 5.348 . . . . 0.0 117.165 174.657 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.725 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -24.06 133.09 0.02 OUTLIER 'General case' 0 CA--C 1.577 1.982 0 C-N-CA 124.684 1.194 . . . . 0.0 113.465 165.228 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.75 94.17 0.07 OUTLIER Glycine 0 CA--C 1.575 3.801 0 O-C-N 121.141 -0.974 . . . . 0.0 113.911 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.613 0 O-C-N 120.955 -1.321 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 ttt . . . . . 0 N--CA 1.499 2.017 0 N-CA-C 111.1 0.037 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.413 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 2.0 mt-10 72.19 140.67 0.06 Allowed 'General case' 0 N--CA 1.503 2.221 0 O-C-N 120.656 -1.277 . . . . 0.0 113.095 175.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.61 -6.82 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 124.958 1.303 . . . . 0.0 114.181 166.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.768 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 75.61 82.42 0.1 Allowed 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.078 -1.639 . . . . 0.0 112.955 164.751 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.884 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -94.03 -31.22 14.32 Favored 'General case' 0 N--CA 1.505 2.31 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 157.143 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.728 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 1.3 t -67.92 7.05 0.58 Allowed 'General case' 0 N--CA 1.503 2.217 0 O-C-N 120.399 -1.438 . . . . 0.0 112.985 155.421 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.905 ' O ' HG23 ' A' ' 11' ' ' VAL . 5.4 mt-10 -148.43 15.55 1.01 Allowed 'General case' 0 N--CA 1.501 2.1 0 C-N-CA 125.994 1.718 . . . . 0.0 111.987 167.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.884 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 1.7 t80 -73.06 -23.77 60.61 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.111 -0.993 . . . . 0.0 113.144 164.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.21 -38.62 25.37 Favored Glycine 1 CA--C 1.581 4.192 0 O-C-N 121.357 -0.839 . . . . 0.0 112.799 163.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.672 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.5 t -50.03 -29.47 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.334 0 O-C-N 120.852 -1.381 . . . . 0.0 111.742 158.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.905 HG23 ' O ' ' A' ' 7' ' ' GLU . 42.0 t -76.09 -68.32 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 C-N-CA 125.035 1.334 . . . . 0.0 111.26 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.9 mt -68.65 -27.27 65.85 Favored 'General case' 0 N--CA 1.503 2.218 0 CA-C-O 123.642 1.687 . . . . 0.0 113.432 -173.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.777 ' O ' HD13 ' A' ' 17' ' ' LEU . 2.5 m -72.48 -25.0 61.26 Favored 'General case' 0 CA--C 1.581 2.144 0 O-C-N 119.902 -1.749 . . . . 0.0 114.192 161.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.845 ' HA ' HD22 ' A' ' 17' ' ' LEU . 2.1 t -71.99 -20.22 20.24 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.3 0 CA-C-O 117.132 -1.413 . . . . 0.0 111.203 161.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.834 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 58.1 m-20 -74.05 -39.76 63.28 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 124.423 1.077 . . . . 0.0 111.547 170.208 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.776 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -53.26 -25.4 14.33 Favored 'General case' 0 CA--C 1.59 2.507 0 C-N-CA 125.18 1.392 . . . . 0.0 113.059 152.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.992 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.5 -10.34 54.31 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 164.559 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.914 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.52 -13.78 60.72 Favored 'General case' 0 CA--C 1.587 2.391 0 O-C-N 119.461 -2.024 . . . . 0.0 111.695 154.299 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.869 ' O ' ' HG3' ' A' ' 22' ' ' GLN . 33.2 mt -84.27 -33.95 23.9 Favored 'General case' 0 CA--C 1.573 1.858 0 C-N-CA 129.519 3.128 . . . . 0.0 112.922 154.075 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.992 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -41.38 -38.97 1.33 Allowed 'General case' 0 CA--C 1.602 2.954 0 CA-C-O 126.762 3.172 . . . . 0.0 108.075 156.624 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.658 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -95.56 -35.19 11.74 Favored 'General case' 0 CA--C 1.588 2.408 1 C-N-CA 134.502 5.121 . . . . 0.0 110.898 -177.447 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.869 ' HG3' ' O ' ' A' ' 19' ' ' LEU . 51.6 mt-30 31.31 105.02 0.0 OUTLIER 'General case' 0 CA--C 1.573 1.842 0 C-N-CA 129.466 3.106 . . . . 0.0 112.917 -155.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 16.15 97.21 0.03 OUTLIER Pre-proline 0 CA--C 1.582 2.178 0 C-N-CA 128.302 2.641 . . . . 0.0 115.638 164.122 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.606 ' HD3' ' HD2' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -9.66 75.25 0.0 OUTLIER 'Trans proline' 0 CA--C 1.57 2.278 1 C-N-CA 127.557 5.505 . . . . 0.0 116.78 172.0 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.729 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -11.28 125.17 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 C-N-CA 126.174 1.789 . . . . 0.0 114.344 165.372 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.95 -94.55 0.01 OUTLIER Glycine 0 CA--C 1.576 3.851 0 O-C-N 120.953 -1.092 . . . . 0.0 113.857 -166.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.529 0 O-C-N 121.098 -1.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 119.462 -0.304 . . . . 0.0 110.997 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -155.87 46.69 0.48 Allowed 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.266 -1.521 . . . . 0.0 113.253 171.195 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mt -42.6 -66.05 0.4 Allowed 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.515 -1.365 . . . . 0.0 112.79 159.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 1.24 ' CB ' ' HB2' ' A' ' 7' ' ' GLU . 0.7 OUTLIER 60.93 150.36 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 125.015 1.326 . . . . 0.0 113.177 177.949 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.637 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -92.38 -30.77 15.62 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.575 -1.328 . . . . 0.0 114.12 162.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.514 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 7.1 m -68.99 10.52 0.28 Allowed 'General case' 0 CA--C 1.585 2.322 0 O-C-N 120.419 -1.425 . . . . 0.0 112.543 151.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 1.24 ' HB2' ' CB ' ' A' ' 4' ' ' LYS . 4.9 mt-10 -147.87 9.87 0.9 Allowed 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 127.57 2.348 . . . . 0.0 111.867 176.078 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.637 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 9.5 t80 -72.65 -30.58 64.41 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.26 1.024 . . . . 0.0 112.819 169.144 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.34 -23.54 58.52 Favored Glycine 1 CA--C 1.583 4.296 0 CA-C-O 122.139 0.855 . . . . 0.0 112.237 170.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.7 t -60.83 -29.77 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.188 0 C-N-CA 125.073 1.349 . . . . 0.0 111.444 156.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.87 HG23 ' O ' ' A' ' 7' ' ' GLU . 21.8 t -76.67 -47.87 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 CA-C-O 123.39 1.567 . . . . 0.0 110.781 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.01 -24.72 64.24 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 119.979 -1.701 . . . . 0.0 113.228 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 10.7 m -73.04 -24.85 60.76 Favored 'General case' 0 CA--C 1.58 2.116 0 O-C-N 120.121 -1.612 . . . . 0.0 114.558 162.063 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.498 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.42 -33.41 63.27 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.266 0 O-C-N 121.658 -0.651 . . . . 0.0 110.202 160.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.797 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -65.81 -36.93 84.89 Favored 'General case' 0 CA--C 1.58 2.126 0 C-N-CA 124.488 1.115 . . . . 0.0 112.073 174.221 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.777 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.37 -28.14 18.38 Favored 'General case' 0 CA--C 1.586 2.338 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 157.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.093 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 26.9 mt -87.79 -8.41 55.99 Favored 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 163.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.16 -18.84 62.48 Favored 'General case' 0 N--CA 1.509 2.51 0 CA-C-O 124.814 2.245 . . . . 0.0 111.241 154.764 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.777 HD12 ' HA ' ' A' ' 16' ' ' ALA . 42.3 mt -76.13 -41.68 49.32 Favored 'General case' 0 CA--C 1.574 1.89 0 C-N-CA 129.502 3.121 . . . . 0.0 113.099 154.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.093 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.94 -41.47 0.55 Allowed 'General case' 0 N--CA 1.51 2.557 0 CA-C-O 125.399 2.523 . . . . 0.0 109.043 158.589 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.539 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -78.54 -42.02 30.56 Favored 'General case' 0 CA--C 1.58 2.114 0 C-N-CA 128.22 2.608 . . . . 0.0 112.194 -173.068 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 5.2 mt-30 -73.75 -88.12 0.03 OUTLIER 'General case' 0 CA--C 1.578 2.047 0 C-N-CA 125.928 1.691 . . . . 0.0 112.526 165.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -30.47 110.86 0.28 Allowed Pre-proline 0 CA--C 1.582 2.21 0 C-N-CA 125.822 1.649 . . . . 0.0 114.32 -177.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.903 ' C ' HD22 ' A' ' 25' ' ' LEU . 52.5 Cg_exo -70.75 29.57 0.21 Allowed 'Trans proline' 0 CA--C 1.573 2.474 1 C-N-CA 125.83 4.353 . . . . 0.0 117.806 179.084 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.903 HD22 ' C ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER 31.28 -176.7 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 126.444 1.898 . . . . 0.0 115.141 -162.922 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 29.58 -95.4 0.01 OUTLIER Glycine 0 CA--C 1.575 3.831 0 O-C-N 120.307 -1.496 . . . . 0.0 114.011 -157.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.608 0 O-C-N 121.008 -1.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 2.019 0 CA-C-O 120.907 0.384 . . . . 0.0 111.345 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.457 ' HG2' HD13 ' A' ' 3' ' ' LEU . 0.7 OUTLIER -121.19 -127.16 0.27 Allowed 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.139 -0.976 . . . . 0.0 112.48 -162.243 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.457 HD13 ' HG2' ' A' ' 2' ' ' GLU . 1.1 mp 42.36 48.42 4.4 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 120.538 -1.352 . . . . 0.0 113.164 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 5' ' ' ALA . 4.9 mtpt 57.99 -163.34 0.2 Allowed 'General case' 0 N--CA 1.501 2.122 0 CA-C-O 122.609 1.195 . . . . 0.0 113.074 -177.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.496 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . 61.25 -9.41 0.07 Allowed 'General case' 0 N--CA 1.529 3.501 0 C-N-CA 127.93 2.492 . . . . 0.0 113.66 -158.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.5 m -70.35 -4.84 24.18 Favored 'General case' 0 CA--C 1.584 2.287 0 CA-C-O 122.846 1.308 . . . . 0.0 112.468 153.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.872 ' O ' HG23 ' A' ' 11' ' ' VAL . 10.1 mt-10 -146.25 9.52 1.1 Allowed 'General case' 0 CA--C 1.58 2.129 0 C-N-CA 129.44 3.096 . . . . 0.0 111.114 -164.032 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.496 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 5.4 t80 -71.47 -28.76 64.17 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.289 -1.507 . . . . 0.0 112.739 178.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.99 -27.42 45.55 Favored Glycine 1 CA--C 1.582 4.223 0 CA-C-O 122.188 0.882 . . . . 0.0 112.323 169.555 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.0 t -55.46 -31.08 27.08 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.188 0 O-C-N 120.945 -1.326 . . . . 0.0 110.846 156.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.872 HG23 ' O ' ' A' ' 7' ' ' GLU . 22.4 t -77.2 -53.57 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 C-N-CA 125.504 1.521 . . . . 0.0 111.114 -177.184 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.447 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.2 mt -67.99 -26.77 66.07 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.223 -1.548 . . . . 0.0 113.412 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 m -72.67 -25.43 61.26 Favored 'General case' 0 CA--C 1.581 2.141 0 O-C-N 120.143 -1.598 . . . . 0.0 114.707 162.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.481 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t -66.24 -32.21 57.08 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.265 0 O-C-N 121.721 -0.612 . . . . 0.0 110.163 160.48 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.765 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -68.77 -33.75 74.42 Favored 'General case' 0 CA--C 1.582 2.209 0 C-N-CA 124.595 1.158 . . . . 0.0 111.579 175.513 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.777 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.33 -28.46 53.91 Favored 'General case' 0 CA--C 1.583 2.221 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 157.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.05 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 27.5 mt -87.28 -5.14 59.04 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 163.139 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.967 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.1 -18.71 60.2 Favored 'General case' 0 CA--C 1.587 2.382 0 CA-C-O 123.877 1.799 . . . . 0.0 111.291 153.886 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.777 HD12 ' HA ' ' A' ' 16' ' ' ALA . 36.1 mt -77.15 -36.57 55.14 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 129.118 2.967 . . . . 0.0 113.155 154.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.05 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.5 t -38.12 -41.25 0.57 Allowed 'General case' 0 CA--C 1.59 2.493 0 CA-C-O 124.99 2.329 . . . . 0.0 109.475 160.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.945 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.1 OUTLIER -84.33 -53.22 5.62 Favored 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 127.357 2.263 . . . . 0.0 112.664 -173.203 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.724 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 11.0 mt-30 -50.57 -31.52 16.0 Favored 'General case' 0 N--CA 1.507 2.405 0 CA-C-O 121.634 0.731 . . . . 0.0 111.952 176.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.6 t 29.88 96.88 0.03 OUTLIER Pre-proline 0 CA--C 1.583 2.237 0 C-N-CA 125.775 1.63 . . . . 0.0 114.531 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.424 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -6.96 72.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.57 2.296 1 C-N-CA 127.139 5.226 . . . . 0.0 116.918 175.04 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.768 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -16.32 129.63 0.01 OUTLIER 'General case' 0 CA--C 1.577 1.994 0 C-N-CA 126.437 1.895 . . . . 0.0 114.242 169.23 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.34 145.39 18.7 Favored Glycine 0 CA--C 1.575 3.794 0 O-C-N 120.928 -1.108 . . . . 0.0 113.936 -157.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.551 0 O-C-N 120.969 -1.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.474 ' O ' ' HB2' ' A' ' 2' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.023 0 CA-C-O 120.825 0.345 . . . . 0.0 111.206 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.679 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 9.2 mp0 68.27 136.89 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.032 -1.042 . . . . 0.0 112.759 -175.007 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.679 ' HB2' ' O ' ' A' ' 2' ' ' GLU . 0.3 OUTLIER 149.15 38.19 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 127.303 2.241 . . . . 0.0 112.787 159.363 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.507 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 34.78 66.74 0.28 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.21 -0.931 . . . . 0.0 113.166 -169.993 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.765 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -92.18 -28.26 17.17 Favored 'General case' 0 N--CA 1.505 2.283 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 156.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.45 1.22 2.41 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.63 -1.294 . . . . 0.0 113.042 155.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.874 ' O ' HG23 ' A' ' 11' ' ' VAL . 20.0 mt-10 -141.96 11.82 2.02 Favored 'General case' 0 N--CA 1.501 2.092 0 C-N-CA 126.308 1.843 . . . . 0.0 112.09 171.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.765 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 8.9 t80 -73.22 -26.63 61.22 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.825 -1.172 . . . . 0.0 113.148 167.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.93 -33.61 45.35 Favored Glycine 1 CA--C 1.581 4.2 0 CA-C-O 122.214 0.897 . . . . 0.0 112.548 166.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.663 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.9 t -53.21 -32.42 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 O-C-N 120.814 -1.404 . . . . 0.0 111.858 158.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 7' ' ' GLU . 33.7 t -76.67 -60.08 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 C-N-CA 125.23 1.412 . . . . 0.0 111.27 -175.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.09 -26.69 64.11 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.076 -1.64 . . . . 0.0 113.528 -178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.8 m -73.15 -23.92 60.52 Favored 'General case' 0 CA--C 1.58 2.108 0 O-C-N 120.122 -1.611 . . . . 0.0 114.545 162.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.825 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.34 -32.3 57.46 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.26 0 O-C-N 121.598 -0.688 . . . . 0.0 110.182 160.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.903 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.2 m-20 -67.88 -37.51 81.86 Favored 'General case' 0 CA--C 1.581 2.141 0 C-N-CA 124.538 1.135 . . . . 0.0 112.021 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.786 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.0 -28.21 16.13 Favored 'General case' 0 CA--C 1.585 2.316 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 156.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.103 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 29.1 mt -87.47 -8.73 56.1 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 164.221 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.903 ' HD3' ' HA ' ' A' ' 15' ' ' ASP . 0.0 OUTLIER -70.64 -20.38 62.73 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 124.891 2.282 . . . . 0.0 111.117 155.123 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.786 HD12 ' HA ' ' A' ' 16' ' ' ALA . 38.2 mt -75.52 -40.72 56.66 Favored 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 129.416 3.086 . . . . 0.0 113.286 155.035 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.103 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.91 -38.71 0.32 Allowed 'General case' 0 CA--C 1.59 2.506 0 CA-C-O 125.253 2.454 . . . . 0.0 109.464 160.002 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.424 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -95.32 -45.14 7.27 Favored 'General case' 0 CA--C 1.58 2.112 0 C-N-CA 127.91 2.484 . . . . 0.0 112.353 -159.194 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.424 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 6.6 mt-30 -49.24 -95.83 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 125.709 1.603 . . . . 0.0 112.5 166.231 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.4 t 43.87 98.64 0.03 OUTLIER Pre-proline 0 CA--C 1.585 2.319 0 C-N-CA 125.869 1.668 . . . . 0.0 114.965 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.783 ' C ' HD22 ' A' ' 25' ' ' LEU . 52.9 Cg_exo -70.79 31.74 0.22 Allowed 'Trans proline' 0 CA--C 1.575 2.527 1 C-N-CA 125.877 4.385 . . . . 0.0 118.617 179.28 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.783 HD22 ' C ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER 28.83 -165.43 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 126.621 1.969 . . . . 0.0 115.783 -169.198 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 104.25 -64.71 0.34 Allowed Glycine 0 CA--C 1.574 3.754 0 O-C-N 120.461 -1.399 . . . . 0.0 114.08 170.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.604 0 O-C-N 120.881 -1.364 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 120.862 0.363 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -84.87 -43.05 14.47 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.108 -0.995 . . . . 0.0 112.737 -173.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.3 mp -46.97 -60.88 2.15 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 124.387 1.075 . . . . 0.0 113.25 -176.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.571 ' HE2' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -51.51 9.3 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.545 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -177.106 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.771 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -74.55 -26.05 59.7 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 119.691 -1.88 . . . . 0.0 113.96 162.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.1 t -66.37 14.04 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.226 0 CA-C-O 122.093 0.949 . . . . 0.0 112.741 154.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.896 ' O ' HG23 ' A' ' 11' ' ' VAL . 8.5 mt-10 -138.27 -0.39 2.03 Favored 'General case' 0 N--CA 1.502 2.163 0 C-N-CA 125.361 1.464 . . . . 0.0 112.861 158.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.771 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 1.4 t80 -73.05 -24.35 60.69 Favored 'General case' 0 N--CA 1.502 2.152 0 C-N-CA 124.308 1.043 . . . . 0.0 113.609 161.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.97 -37.21 26.16 Favored Glycine 1 CA--C 1.58 4.101 0 O-C-N 121.326 -0.859 . . . . 0.0 113.174 167.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.6 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.3 t -48.52 -32.55 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 O-C-N 120.827 -1.396 . . . . 0.0 111.431 157.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.896 HG23 ' O ' ' A' ' 7' ' ' GLU . 38.3 t -76.49 -64.5 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 C-N-CA 124.886 1.274 . . . . 0.0 111.121 -175.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.465 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.3 mt -70.58 -28.85 65.2 Favored 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 122.942 1.353 . . . . 0.0 113.568 -175.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.0 m -72.91 -24.92 60.89 Favored 'General case' 0 CA--C 1.581 2.149 0 O-C-N 120.174 -1.579 . . . . 0.0 114.523 162.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.973 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -65.86 -32.46 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.245 0 O-C-N 121.826 -0.546 . . . . 0.0 110.205 160.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.938 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 28.1 m-20 -69.67 -34.08 73.47 Favored 'General case' 0 CA--C 1.583 2.237 0 C-N-CA 124.65 1.18 . . . . 0.0 111.515 177.058 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.745 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -54.47 -28.61 45.7 Favored 'General case' 0 CA--C 1.583 2.222 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 157.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.979 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 26.7 mt -86.7 -8.08 57.73 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 116.221 1.934 . . . . 0.0 116.221 163.395 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.98 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -73.2 -17.32 61.37 Favored 'General case' 0 CA--C 1.588 2.434 0 CA-C-O 124.604 2.145 . . . . 0.0 111.485 154.471 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.745 HD12 ' HA ' ' A' ' 16' ' ' ALA . 33.6 mt -79.02 -36.67 40.76 Favored 'General case' 0 CA--C 1.574 1.888 0 C-N-CA 128.98 2.912 . . . . 0.0 113.078 155.008 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.979 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.4 t -38.48 -42.28 0.74 Allowed 'General case' 0 CA--C 1.59 2.513 0 CA-C-O 124.946 2.307 . . . . 0.0 109.453 160.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.98 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.4 OUTLIER -82.62 -58.75 2.77 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 127.317 2.247 . . . . 0.0 112.676 -173.938 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.672 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 8.6 mt-30 -48.82 -85.55 0.0 OUTLIER 'General case' 0 CA--C 1.58 2.11 0 C-N-CA 124.59 1.156 . . . . 0.0 112.364 172.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.408 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 46.8 t 24.69 101.08 0.02 OUTLIER Pre-proline 0 CA--C 1.582 2.194 0 C-N-CA 126.446 1.898 . . . . 0.0 114.97 167.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.528 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -6.95 71.54 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.271 1 C-N-CA 127.233 5.288 . . . . 0.0 117.173 177.015 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.76 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -13.22 129.81 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 126.22 1.808 . . . . 0.0 114.269 163.734 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.21 72.19 0.84 Allowed Glycine 0 CA--C 1.575 3.829 0 O-C-N 121.108 -0.995 . . . . 0.0 113.878 -172.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.566 0 O-C-N 121.021 -1.282 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.559 ' O ' ' HG3' ' A' ' 2' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.499 2.025 0 CA-C-O 120.773 0.32 . . . . 0.0 111.256 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 1' ' ' MET . 5.1 mt-10 -177.94 159.25 1.34 Allowed 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.096 -1.002 . . . . 0.0 112.713 174.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.952 HD13 ' N ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER 175.26 -27.75 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 124.563 1.145 . . . . 0.0 113.582 163.772 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.952 ' N ' HD13 ' A' ' 3' ' ' LEU . 2.0 mtmp? 56.17 67.44 1.0 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.77 -1.206 . . . . 0.0 113.017 160.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.825 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -93.03 -34.44 13.71 Favored 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 159.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 m -68.45 7.91 0.55 Allowed 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.174 -1.579 . . . . 0.0 112.999 155.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.886 ' O ' HG23 ' A' ' 11' ' ' VAL . 12.8 mt-10 -143.74 12.92 1.69 Allowed 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 126.298 1.839 . . . . 0.0 112.054 165.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.825 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.4 OUTLIER -72.97 -27.64 61.93 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.025 -1.047 . . . . 0.0 113.132 165.603 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.9 -37.57 43.82 Favored Glycine 1 CA--C 1.584 4.406 0 CA-C-O 122.493 1.052 . . . . 0.0 112.123 167.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.648 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.0 t -49.74 -31.66 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 C-N-CA 125.19 1.396 . . . . 0.0 111.713 158.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 7' ' ' GLU . 36.1 t -76.3 -58.21 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 C-N-CA 125.106 1.362 . . . . 0.0 111.07 -176.358 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.435 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.5 mt -68.19 -28.25 67.11 Favored 'General case' 0 N--CA 1.503 2.217 0 CA-C-O 123.11 1.433 . . . . 0.0 113.641 -176.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 m -72.77 -26.73 61.65 Favored 'General case' 0 CA--C 1.582 2.179 0 O-C-N 120.201 -1.562 . . . . 0.0 114.715 162.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.809 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -65.56 -30.96 51.75 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 O-C-N 121.872 -0.517 . . . . 0.0 110.192 160.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.864 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 52.7 m-20 -70.02 -35.34 74.25 Favored 'General case' 0 CA--C 1.581 2.166 0 C-N-CA 124.547 1.139 . . . . 0.0 111.551 176.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.756 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.92 -28.91 25.62 Favored 'General case' 0 CA--C 1.584 2.268 0 C-N-CA 124.536 1.134 . . . . 0.0 114.033 156.51 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.091 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 25.9 mt -87.97 -5.29 58.61 Favored 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 163.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 1.046 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -74.58 -19.21 60.4 Favored 'General case' 0 CA--C 1.587 2.393 0 O-C-N 119.877 -1.764 . . . . 0.0 111.19 154.013 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.756 HD12 ' HA ' ' A' ' 16' ' ' ALA . 35.2 mt -76.3 -37.46 57.43 Favored 'General case' 0 CA--C 1.575 1.929 0 C-N-CA 129.124 2.969 . . . . 0.0 113.245 154.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.091 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -38.12 -41.91 0.62 Allowed 'General case' 0 CA--C 1.589 2.467 0 CA-C-O 124.789 2.233 . . . . 0.0 109.696 160.459 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 1.046 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -82.44 -57.91 3.15 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 127.24 2.216 . . . . 0.0 112.484 -173.312 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.544 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 2.0 mt-30 -44.87 -27.6 0.54 Allowed 'General case' 0 N--CA 1.507 2.406 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.009 -176.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t 34.56 88.37 0.1 OUTLIER Pre-proline 0 CA--C 1.582 2.197 0 C-N-CA 124.938 1.295 . . . . 0.0 113.763 172.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -62.69 -144.11 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.58 0 C-N-CA 124.59 3.527 . . . . 0.0 115.359 -174.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.675 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -79.92 154.69 28.13 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.243 -1.536 . . . . 0.0 114.486 -156.069 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.8 60.54 8.28 Favored Glycine 0 CA--C 1.574 3.748 0 O-C-N 120.821 -1.174 . . . . 0.0 113.827 159.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.352 0.689 0 O-C-N 121.078 -1.248 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.518 ' HE2' ' HB2' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.024 0 CA-C-O 120.687 0.279 . . . . 0.0 111.383 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -47.3 -59.56 3.1 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.007 -1.058 . . . . 0.0 112.907 173.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 47.82 19.46 0.17 Allowed 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.428 1.091 . . . . 0.0 113.459 -165.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.3 mtpp 39.71 44.53 1.3 Allowed 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 124.664 1.186 . . . . 0.0 113.459 173.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.729 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -92.9 -32.77 14.46 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.741 -1.225 . . . . 0.0 114.072 156.171 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.1 t -67.82 5.01 0.95 Allowed 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.464 -1.398 . . . . 0.0 112.8 154.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.88 ' O ' HG23 ' A' ' 11' ' ' VAL . 14.1 mt-10 -140.89 13.56 2.27 Favored 'General case' 0 N--CA 1.502 2.139 0 C-N-CA 126.085 1.754 . . . . 0.0 112.047 165.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.729 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.5 OUTLIER -70.14 -29.36 66.26 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.182 -0.949 . . . . 0.0 112.66 157.186 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.83 -40.73 74.88 Favored Glycine 1 CA--C 1.585 4.433 0 CA-C-O 122.291 0.939 . . . . 0.0 111.893 166.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.695 HG23 ' HA ' ' A' ' 7' ' ' GLU . 4.0 t -51.83 -30.92 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.257 0 C-N-CA 125.487 1.515 . . . . 0.0 112.117 161.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 7' ' ' GLU . 39.8 t -75.9 -57.44 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 C-N-CA 125.011 1.324 . . . . 0.0 111.356 -176.381 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.46 HD21 ' HE1' ' A' ' 8' ' ' PHE . 4.6 mt -58.28 -27.64 64.23 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.352 -1.467 . . . . 0.0 114.21 175.33 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.42 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.3 m -72.91 -27.67 62.01 Favored 'General case' 0 CA--C 1.58 2.127 0 O-C-N 120.045 -1.66 . . . . 0.0 114.911 163.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.487 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -65.08 -30.21 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.273 0 O-C-N 121.736 -0.602 . . . . 0.0 110.18 161.022 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.72 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 9.1 m-20 -70.36 -35.05 73.31 Favored 'General case' 0 CA--C 1.582 2.177 0 C-N-CA 124.515 1.126 . . . . 0.0 111.328 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.797 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.49 -29.01 22.77 Favored 'General case' 0 CA--C 1.584 2.278 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 156.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.061 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 23.0 mt -88.29 -5.37 58.38 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 116.172 1.915 . . . . 0.0 116.172 163.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.992 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.91 -17.64 60.54 Favored 'General case' 0 CA--C 1.587 2.385 0 O-C-N 119.765 -1.834 . . . . 0.0 111.287 153.94 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.797 HD12 ' HA ' ' A' ' 16' ' ' ALA . 37.0 mt -77.49 -38.03 49.94 Favored 'General case' 0 CA--C 1.574 1.891 0 C-N-CA 129.163 2.985 . . . . 0.0 113.117 154.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.061 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -37.25 -41.87 0.42 Allowed 'General case' 0 CA--C 1.588 2.419 0 CA-C-O 124.788 2.232 . . . . 0.0 109.662 160.455 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.962 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 3.6 mmm180 -83.59 -59.39 2.45 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 127.365 2.266 . . . . 0.0 112.544 -173.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.684 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 12.2 mt-30 -44.05 -59.66 2.21 Favored 'General case' 0 CA--C 1.584 2.266 0 CA-C-O 122.484 1.135 . . . . 0.0 112.543 -175.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t 41.24 80.41 0.28 Allowed Pre-proline 0 CA--C 1.582 2.18 0 C-N-CA 124.427 1.091 . . . . 0.0 113.44 -166.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -62.13 -143.05 0.01 OUTLIER 'Trans proline' 0 CA--C 1.577 2.64 0 C-N-CA 124.325 3.35 . . . . 0.0 115.136 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.696 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -80.19 173.92 12.11 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 125.327 1.451 . . . . 0.0 114.289 -156.627 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.06 94.81 0.02 OUTLIER Glycine 0 CA--C 1.574 3.773 0 O-C-N 120.86 -1.15 . . . . 0.0 113.831 -170.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.544 0 O-C-N 121.042 -1.269 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tpp . . . . . 0 CA--C 1.578 2.036 0 CA-C-O 120.863 0.363 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 76.44 169.82 0.25 Allowed 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 124.494 1.118 . . . . 0.0 113.004 -173.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.422 ' O ' ' HG3' ' A' ' 4' ' ' LYS . 3.4 mm? -74.02 1.3 11.25 Favored 'General case' 0 N--CA 1.506 2.372 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -158.314 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 175.83 54.58 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 125.376 1.47 . . . . 0.0 113.759 -157.564 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.762 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -93.56 -28.17 16.2 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 120.538 -1.351 . . . . 0.0 114.506 156.393 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -68.82 8.48 0.51 Allowed 'General case' 0 CA--C 1.581 2.16 0 O-C-N 120.534 -1.354 . . . . 0.0 112.991 155.293 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.877 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.2 mt-10 -143.11 12.14 1.79 Allowed 'General case' 0 N--CA 1.502 2.169 0 C-N-CA 126.225 1.81 . . . . 0.0 111.95 169.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.762 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.7 OUTLIER -72.75 -26.03 61.41 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.799 -1.188 . . . . 0.0 113.162 172.531 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.615 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -83.87 -24.29 49.67 Favored Glycine 1 CA--C 1.582 4.263 0 CA-C-O 122.795 1.22 . . . . 0.0 112.443 167.537 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.669 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -61.17 -28.47 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 120.651 -1.499 . . . . 0.0 111.395 156.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 7' ' ' GLU . 40.0 t -77.39 -63.08 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 C-N-CA 125.472 1.509 . . . . 0.0 111.456 -178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.495 ' N ' HD23 ' A' ' 12' ' ' LEU . 3.8 mt -61.91 -21.81 65.06 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 119.917 -1.739 . . . . 0.0 113.429 174.374 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.615 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 1.4 t -73.73 -29.91 62.52 Favored 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 161.317 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.823 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -63.18 -30.01 48.65 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.283 0 CA-C-O 119.043 -0.503 . . . . 0.0 109.777 162.15 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.889 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 53.5 m-20 -70.6 -36.3 73.46 Favored 'General case' 0 CA--C 1.581 2.136 0 C-N-CA 124.95 1.3 . . . . 0.0 111.5 173.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.816 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.48 -29.16 23.42 Favored 'General case' 0 CA--C 1.584 2.251 0 C-N-CA 124.893 1.277 . . . . 0.0 113.592 155.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.051 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 47.6 mt -90.0 -2.08 58.08 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 164.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.889 ' HD3' ' HA ' ' A' ' 15' ' ' ASP . 0.0 OUTLIER -75.97 -20.61 57.77 Favored 'General case' 0 CA--C 1.589 2.466 0 CA-C-O 124.881 2.277 . . . . 0.0 111.22 153.034 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.816 HD12 ' HA ' ' A' ' 16' ' ' ALA . 34.3 mt -74.63 -37.43 62.81 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 129.347 3.059 . . . . 0.0 113.166 155.12 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.051 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.8 t -37.11 -40.06 0.29 Allowed 'General case' 0 CA--C 1.587 2.399 0 CA-C-O 124.672 2.177 . . . . 0.0 109.97 160.365 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.821 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 4.3 mmm-85 -92.43 -54.89 3.61 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 126.939 2.096 . . . . 0.0 112.701 -164.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -37.81 -86.6 0.0 OUTLIER 'General case' 0 CA--C 1.583 2.22 0 CA-C-O 122.125 0.964 . . . . 0.0 111.904 168.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 56.14 161.64 0.07 OUTLIER Pre-proline 0 CA--C 1.585 2.316 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 176.423 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -8.02 74.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.234 1 C-N-CA 127.491 5.461 . . . . 0.0 117.021 173.825 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.738 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -24.59 148.64 0.0 OUTLIER 'General case' 0 CA--C 1.577 1.999 0 C-N-CA 124.442 1.097 . . . . 0.0 113.615 164.234 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.48 -77.77 0.57 Allowed Glycine 0 CA--C 1.574 3.763 0 O-C-N 121.081 -1.012 . . . . 0.0 114.414 -177.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.56 0 O-C-N 120.829 -1.395 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.576 1.978 0 CA-C-O 120.865 0.364 . . . . 0.0 111.282 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.586 ' O ' ' HG2' ' A' ' 2' ' ' GLU . 0.2 OUTLIER -116.58 77.74 1.14 Allowed 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.128 -0.983 . . . . 0.0 112.855 165.789 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 mp 41.77 36.75 0.65 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.639 -1.288 . . . . 0.0 112.969 -163.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 1.016 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 43.6 mtmt -20.66 87.63 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 126.392 1.877 . . . . 0.0 115.238 -158.308 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.504 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -90.91 -32.75 15.89 Favored 'General case' 0 N--CA 1.505 2.312 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 156.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.638 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 1.1 p -68.27 5.09 1.05 Allowed 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.334 -1.479 . . . . 0.0 113.102 155.199 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 1.016 ' HB2' ' HB3' ' A' ' 4' ' ' LYS . 3.8 mt-10 -145.22 25.23 1.4 Allowed 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 126.18 1.792 . . . . 0.0 111.544 169.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.504 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 19.1 t80 -67.68 -37.7 82.7 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.313 -0.867 . . . . 0.0 113.036 163.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.59 -29.49 71.39 Favored Glycine 1 CA--C 1.581 4.192 0 CA-C-O 123.101 1.389 . . . . 0.0 112.211 167.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.744 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.7 t -63.15 -25.72 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 O-C-N 120.752 -1.44 . . . . 0.0 111.937 161.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 7' ' ' GLU . 16.4 t -76.8 -39.53 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 CA-C-O 123.275 1.512 . . . . 0.0 110.399 177.024 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.504 ' N ' HD23 ' A' ' 12' ' ' LEU . 3.7 mt -70.15 -26.45 63.94 Favored 'General case' 0 N--CA 1.502 2.13 0 CA-C-O 124.173 1.94 . . . . 0.0 112.733 176.168 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -73.01 -27.23 61.66 Favored 'General case' 0 CA--C 1.58 2.123 0 O-C-N 119.916 -1.74 . . . . 0.0 114.378 160.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.567 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -64.94 -30.94 51.84 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.245 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.26 161.344 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.754 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.2 m-20 -68.67 -37.08 79.34 Favored 'General case' 0 CA--C 1.582 2.178 0 C-N-CA 124.522 1.129 . . . . 0.0 111.725 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.786 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -52.5 -28.17 19.37 Favored 'General case' 0 CA--C 1.586 2.337 0 C-N-CA 124.696 1.198 . . . . 0.0 114.232 155.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.068 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 28.4 mt -87.16 -6.7 58.53 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 163.219 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 1.004 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -73.85 -16.96 61.12 Favored 'General case' 0 N--CA 1.507 2.417 0 CA-C-O 124.896 2.284 . . . . 0.0 111.365 154.502 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.786 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 45.8 mt -77.16 -40.47 45.38 Favored 'General case' 0 CA--C 1.575 1.913 0 C-N-CA 129.711 3.204 . . . . 0.0 112.842 153.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.068 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -39.15 -39.75 0.63 Allowed 'General case' 0 CA--C 1.589 2.472 0 CA-C-O 125.297 2.475 . . . . 0.0 109.508 158.685 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.627 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -91.32 -45.33 8.65 Favored 'General case' 0 CA--C 1.579 2.087 0 C-N-CA 127.767 2.427 . . . . 0.0 112.369 -160.622 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.534 ' OE1' HD23 ' A' ' 19' ' ' LEU . 2.4 mt-30 -37.03 -83.74 0.01 OUTLIER 'General case' 0 CA--C 1.58 2.133 0 C-N-CA 125.411 1.484 . . . . 0.0 112.413 161.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 0.96 88.41 0.03 OUTLIER Pre-proline 0 CA--C 1.582 2.179 0 C-N-CA 127.225 2.21 . . . . 0.0 115.326 -178.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -64.8 -144.11 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.615 0 C-N-CA 124.73 3.62 . . . . 0.0 115.286 -178.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.65 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -92.47 157.12 16.73 Favored 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 125.746 1.618 . . . . 0.0 113.934 -156.5 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 54.84 -105.18 0.33 Allowed Glycine 0 CA--C 1.575 3.822 0 O-C-N 120.599 -1.313 . . . . 0.0 113.994 -175.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.583 0 O-C-N 120.871 -1.37 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.8 mmt . . . . . 0 CA--C 1.577 2.011 0 CA-C-O 120.798 0.333 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 86.07 -63.23 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.943 1.297 . . . . 0.0 112.719 173.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER 65.03 9.7 5.69 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.574 -1.329 . . . . 0.0 113.459 159.369 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.695 ' CG ' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 43.34 82.75 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.829 -1.17 . . . . 0.0 113.86 157.88 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.745 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -97.51 -40.9 8.44 Favored 'General case' 0 N--CA 1.507 2.421 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 157.235 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.68 3.0 1.56 Allowed 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.083 -1.635 . . . . 0.0 112.985 155.111 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.914 ' O ' HG23 ' A' ' 11' ' ' VAL . 8.8 mt-10 -137.31 14.75 3.01 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 126.82 2.048 . . . . 0.0 111.789 170.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.745 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 3.6 t80 -69.49 -32.01 70.63 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.861 -1.149 . . . . 0.0 113.078 171.047 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -72.63 -35.23 59.27 Favored Glycine 1 CA--C 1.587 4.539 0 CA-C-O 122.878 1.265 . . . . 0.0 111.736 168.232 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.67 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.2 t -55.55 -28.43 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.252 0 C-N-CA 125.175 1.39 . . . . 0.0 111.76 160.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 7' ' ' GLU . 33.0 t -77.03 -53.14 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 C-N-CA 125.11 1.364 . . . . 0.0 110.954 -177.584 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.419 ' O ' ' HB2' ' A' ' 15' ' ' ASP . 5.4 mt -70.97 -33.85 70.84 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -174.412 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 7.9 t -75.18 -20.52 59.28 Favored 'General case' 0 CA--C 1.578 2.023 0 O-C-N 120.373 -1.455 . . . . 0.0 114.42 160.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.537 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -66.29 -29.11 45.61 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.251 0 O-C-N 121.631 -0.668 . . . . 0.0 110.186 157.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.819 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.1 m-20 -73.85 -34.94 64.72 Favored 'General case' 0 CA--C 1.583 2.231 0 CA-C-O 122.462 1.125 . . . . 0.0 110.806 175.337 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.82 -28.83 24.5 Favored 'General case' 0 CA--C 1.584 2.272 0 C-N-CA 125.135 1.374 . . . . 0.0 113.59 154.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.036 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 27.0 mt -89.34 -4.04 58.24 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 163.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.941 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -75.49 -18.17 59.91 Favored 'General case' 0 CA--C 1.588 2.435 0 CA-C-O 123.938 1.828 . . . . 0.0 111.286 153.328 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.826 HD12 ' HA ' ' A' ' 16' ' ' ALA . 34.2 mt -76.62 -37.79 55.8 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 129.269 3.028 . . . . 0.0 113.112 154.748 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.036 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -37.26 -40.31 0.33 Allowed 'General case' 0 CA--C 1.587 2.397 0 CA-C-O 124.527 2.108 . . . . 0.0 109.768 160.009 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.941 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 2.4 mmt180 -88.84 -53.54 4.56 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 127.122 2.169 . . . . 0.0 112.733 -169.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.591 ' HG3' ' HA ' ' A' ' 19' ' ' LEU . 1.1 mt-30 -39.75 -44.35 1.56 Allowed 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 123.628 0.771 . . . . 0.0 112.259 -177.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.7 t 49.24 103.42 0.03 OUTLIER Pre-proline 0 CA--C 1.582 2.209 0 C-N-CA 124.663 1.185 . . . . 0.0 113.935 177.134 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -5.04 69.99 0.0 OUTLIER 'Trans proline' 0 CA--C 1.571 2.326 1 C-N-CA 127.073 5.182 . . . . 0.0 117.007 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.466 ' N ' HD12 ' A' ' 25' ' ' LEU . 2.6 mp 54.98 -176.92 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.262 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 157.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 44.48 38.5 5.31 Favored Glycine 0 CA--C 1.575 3.825 0 O-C-N 120.634 -1.291 . . . . 0.0 114.179 176.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.584 0 O-C-N 120.908 -1.348 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.478 ' CB ' ' HE2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.019 0 CA-C-O 120.295 0.093 . . . . 0.0 111.075 . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -76.64 -104.79 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.583 -1.323 . . . . 0.0 112.603 -168.64 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.0 mp -45.65 -56.96 4.6 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 120.785 -1.197 . . . . 0.0 113.229 -165.667 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.541 ' HB2' ' HE3' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -19.04 85.66 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 126.259 1.824 . . . . 0.0 114.39 173.859 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.798 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -119.14 -27.3 5.72 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.687 -1.258 . . . . 0.0 114.33 159.671 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.6 p -68.45 10.85 0.21 Allowed 'General case' 0 CA--C 1.583 2.221 0 O-C-N 120.82 -1.175 . . . . 0.0 112.706 154.427 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.92 ' O ' HG23 ' A' ' 11' ' ' VAL . 14.9 mt-10 -143.0 1.67 1.28 Allowed 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 126.007 1.723 . . . . 0.0 112.536 166.554 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.798 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.2 OUTLIER -73.19 -24.49 60.54 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.971 -1.08 . . . . 0.0 113.425 171.998 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.531 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -77.61 -35.41 36.5 Favored Glycine 1 CA--C 1.582 4.27 0 O-C-N 121.187 -0.946 . . . . 0.0 112.762 165.092 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.599 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -53.34 -31.97 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.277 0 O-C-N 120.977 -1.308 . . . . 0.0 111.582 159.47 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 7' ' ' GLU . 40.9 t -76.91 -63.94 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 125.056 1.343 . . . . 0.0 111.025 -175.77 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.0 mt -70.74 -27.25 63.81 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.727 -1.233 . . . . 0.0 114.03 -177.528 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.531 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 29.4 t -74.4 -25.54 59.54 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.513 -1.367 . . . . 0.0 114.614 162.223 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.607 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -63.54 -33.53 62.07 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.287 0 O-C-N 122.002 -0.436 . . . . 0.0 109.944 159.618 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.828 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 14.8 m-20 -69.44 -33.99 73.76 Favored 'General case' 0 CA--C 1.583 2.216 0 C-N-CA 124.826 1.25 . . . . 0.0 111.377 174.093 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.775 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.45 -28.17 52.69 Favored 'General case' 0 CA--C 1.582 2.201 0 C-N-CA 124.236 1.014 . . . . 0.0 113.702 157.508 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.021 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 44.4 mt -89.79 -2.59 58.27 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 116.295 1.961 . . . . 0.0 116.295 163.597 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.932 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -76.3 -18.67 58.85 Favored 'General case' 0 CA--C 1.587 2.395 0 CA-C-O 124.638 2.161 . . . . 0.0 111.463 153.072 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.775 HD12 ' HA ' ' A' ' 16' ' ' ALA . 33.4 mt -76.61 -36.87 57.21 Favored 'General case' 0 CA--C 1.575 1.907 0 C-N-CA 129.222 3.009 . . . . 0.0 112.996 155.097 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.021 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.3 t -37.43 -38.83 0.26 Allowed 'General case' 0 CA--C 1.587 2.378 0 CA-C-O 124.351 2.024 . . . . 0.0 109.897 160.069 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.769 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -96.11 -57.36 2.36 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 126.599 1.96 . . . . 0.0 112.803 -165.081 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 11.4 mt-30 -36.24 -89.65 0.0 OUTLIER 'General case' 0 CA--C 1.582 2.19 0 CA-C-O 123.093 1.425 . . . . 0.0 112.315 179.603 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 49.75 164.39 0.04 OUTLIER Pre-proline 0 CA--C 1.583 2.234 0 C-N-CA 124.92 1.288 . . . . 0.0 114.37 -170.926 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.443 ' C ' HD13 ' A' ' 25' ' ' LEU . 76.6 Cg_exo -65.27 -141.06 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.6 0 C-N-CA 124.085 3.19 . . . . 0.0 114.797 177.824 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.721 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.05 127.31 37.47 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 125.645 1.578 . . . . 0.0 114.126 -166.923 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -107.24 105.17 2.25 Favored Glycine 0 CA--C 1.574 3.74 0 O-C-N 120.813 -1.179 . . . . 0.0 114.111 -174.246 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.588 0 O-C-N 120.795 -1.415 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mtm . . . . . 0 N--CA 1.499 2.018 0 CA-C-O 120.794 0.33 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.598 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 10.0 mt-10 49.38 40.96 19.82 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.992 -1.068 . . . . 0.0 112.834 162.619 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -40.17 -48.68 2.58 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 124.627 1.171 . . . . 0.0 113.876 -161.364 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.598 ' HB2' ' O ' ' A' ' 2' ' ' GLU . 0.0 OUTLIER 28.79 65.36 0.11 Allowed 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 125.638 1.575 . . . . 0.0 114.641 158.093 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.745 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -92.89 -28.53 16.43 Favored 'General case' 0 N--CA 1.507 2.409 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 163.226 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.517 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 1.2 t -67.69 6.37 0.67 Allowed 'General case' 0 N--CA 1.504 2.256 0 O-C-N 120.515 -1.366 . . . . 0.0 113.061 155.756 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.89 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.3 mt-10 -145.04 9.8 1.29 Allowed 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 126.424 1.89 . . . . 0.0 111.902 169.844 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.745 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 9.0 t80 -72.92 -28.38 62.42 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 120.729 -1.232 . . . . 0.0 113.263 167.831 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.15 -35.19 57.48 Favored Glycine 1 CA--C 1.584 4.398 0 CA-C-O 122.697 1.165 . . . . 0.0 112.042 167.816 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.688 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -53.79 -33.83 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 C-N-CA 125.288 1.435 . . . . 0.0 111.753 160.978 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.89 HG23 ' O ' ' A' ' 7' ' ' GLU . 33.3 t -76.56 -59.11 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 C-N-CA 125.129 1.372 . . . . 0.0 111.258 -173.316 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.459 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.3 mt -67.59 -25.95 66.03 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 120.32 -1.488 . . . . 0.0 113.587 -177.337 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m -72.89 -26.46 61.44 Favored 'General case' 0 CA--C 1.581 2.161 0 O-C-N 120.233 -1.542 . . . . 0.0 114.626 162.269 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.842 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.13 -30.06 48.72 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.242 0 O-C-N 121.841 -0.537 . . . . 0.0 110.188 161.381 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.87 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.7 m-20 -70.23 -37.26 74.96 Favored 'General case' 0 CA--C 1.581 2.144 0 C-N-CA 124.616 1.166 . . . . 0.0 111.859 176.119 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.824 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -51.17 -27.17 8.09 Favored 'General case' 0 CA--C 1.587 2.387 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 156.266 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.048 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 25.5 mt -89.38 -10.62 45.92 Favored 'General case' 0 N--CA 1.505 2.276 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 164.199 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.894 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.59 -20.2 64.5 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 124.772 2.225 . . . . 0.0 111.218 155.119 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 16' ' ' ALA . 34.2 mt -76.17 -42.71 45.62 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 129.123 2.969 . . . . 0.0 113.307 155.237 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.048 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -37.34 -40.85 0.38 Allowed 'General case' 0 N--CA 1.512 2.626 0 CA-C-O 125.225 2.44 . . . . 0.0 108.802 158.183 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.54 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -77.8 -39.24 44.47 Favored 'General case' 0 CA--C 1.579 2.089 0 C-N-CA 128.032 2.533 . . . . 0.0 112.128 -176.527 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 4.1 mt-30 -94.51 -105.43 0.14 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 126.012 1.725 . . . . 0.0 112.888 172.962 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 34.3 t -56.08 93.42 0.04 OUTLIER Pre-proline 0 N--CA 1.504 2.23 0 C-N-CA 125.432 1.493 . . . . 0.0 114.409 -158.3 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.455 ' HD3' ' O ' ' A' ' 22' ' ' GLN . 70.9 Cg_exo -63.82 -142.12 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.597 0 C-N-CA 123.979 3.119 . . . . 0.0 114.803 177.577 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.689 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -84.32 168.36 15.7 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 125.243 1.417 . . . . 0.0 113.983 -161.018 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.96 160.84 3.79 Favored Glycine 0 CA--C 1.575 3.835 0 O-C-N 120.547 -1.346 . . . . 0.0 113.873 -162.847 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.538 0 O-C-N 120.893 -1.357 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.998 0 CA-C-O 120.596 0.236 . . . . 0.0 111.017 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -53.21 -101.32 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 124.318 1.047 . . . . 0.0 113.585 -156.896 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.83 ' O ' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -58.0 -23.45 54.14 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 120.577 -1.327 . . . . 0.0 113.494 -165.785 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 1.134 ' HE2' ' HG3' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 85.76 107.42 0.05 OUTLIER 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 125.895 1.678 . . . . 0.0 112.52 -171.049 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.85 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -92.13 -32.59 15.08 Favored 'General case' 0 N--CA 1.508 2.467 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 166.217 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.93 7.98 0.46 Allowed 'General case' 0 CA--C 1.584 2.26 0 O-C-N 120.136 -1.602 . . . . 0.0 112.755 153.498 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 1.134 ' HG3' ' HE2' ' A' ' 4' ' ' LYS . 6.4 mt-10 -141.59 4.33 1.74 Allowed 'General case' 0 N--CA 1.503 2.214 0 C-N-CA 127.764 2.426 . . . . 0.0 112.08 173.047 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.85 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.9 OUTLIER -73.82 -27.72 61.26 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.585 -1.322 . . . . 0.0 113.217 169.497 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.67 -34.69 38.49 Favored Glycine 1 CA--C 1.583 4.29 0 CA-C-O 122.51 1.061 . . . . 0.0 112.2 171.13 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.623 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.5 t -47.07 -35.69 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.152 0 O-C-N 120.823 -1.398 . . . . 0.0 110.959 156.665 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 7' ' ' GLU . 23.5 t -76.86 -55.65 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 C-N-CA 125.329 1.451 . . . . 0.0 111.004 -173.013 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.427 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.3 mt -70.19 -28.37 65.26 Favored 'General case' 0 N--CA 1.502 2.17 0 CA-C-O 123.473 1.606 . . . . 0.0 113.321 -177.031 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.413 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.8 m -72.46 -25.58 61.5 Favored 'General case' 0 CA--C 1.582 2.184 0 O-C-N 120.076 -1.64 . . . . 0.0 114.516 163.259 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.653 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -66.34 -32.33 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.255 0 C-N-CA 123.091 0.556 . . . . 0.0 110.25 160.515 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.796 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 2.0 m-20 -69.07 -32.52 72.02 Favored 'General case' 0 CA--C 1.583 2.24 0 C-N-CA 124.526 1.13 . . . . 0.0 111.436 176.136 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.788 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.41 -28.4 53.93 Favored 'General case' 0 CA--C 1.584 2.265 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 158.068 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.023 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 25.6 mt -88.63 -4.72 58.5 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 116.317 1.969 . . . . 0.0 116.317 163.156 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.939 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.25 -18.43 60.1 Favored 'General case' 0 CA--C 1.586 2.356 0 O-C-N 119.913 -1.742 . . . . 0.0 111.283 153.681 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.788 HD12 ' HA ' ' A' ' 16' ' ' ALA . 35.3 mt -77.0 -37.27 55.45 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 129.014 2.926 . . . . 0.0 113.123 154.946 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.023 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.5 t -36.97 -40.81 0.31 Allowed 'General case' 0 CA--C 1.588 2.426 0 CA-C-O 124.927 2.298 . . . . 0.0 109.786 160.608 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.791 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 6.4 mmm180 -88.15 -56.22 3.42 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 127.743 2.417 . . . . 0.0 112.689 -170.677 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.73 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 2.9 mt-30 -47.26 -27.54 1.58 Allowed 'General case' 0 N--CA 1.507 2.382 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.711 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.0 t -28.38 90.23 0.04 OUTLIER Pre-proline 0 CA--C 1.582 2.176 0 C-N-CA 125.524 1.529 . . . . 0.0 114.272 -172.022 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -7.45 69.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.57 2.318 1 C-N-CA 127.382 5.388 . . . . 0.0 117.017 178.298 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.725 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -14.96 121.59 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 126.849 2.06 . . . . 0.0 114.506 175.463 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -54.63 148.17 22.62 Favored Glycine 0 CA--C 1.576 3.882 0 O-C-N 120.831 -1.168 . . . . 0.0 113.706 -179.41 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.562 0 O-C-N 121.396 -1.061 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.419 ' HB3' ' H ' ' A' ' 2' ' ' GLU . 4.9 mtp . . . . . 0 N--CA 1.499 2.024 0 CA-C-O 120.777 0.323 . . . . 0.0 111.281 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.419 ' H ' ' HB3' ' A' ' 1' ' ' MET . 21.9 mt-10 56.97 -88.09 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.952 -1.092 . . . . 0.0 112.687 -157.626 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.459 ' O ' ' CG ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER 51.92 27.36 4.28 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.961 -1.087 . . . . 0.0 113.595 157.135 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.729 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 0.7 OUTLIER 147.07 75.04 0.0 OUTLIER 'General case' 0 CA--C 1.58 2.132 0 C-N-CA 127.578 2.351 . . . . 0.0 112.174 -159.704 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.757 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -87.0 -30.14 21.46 Favored 'General case' 0 N--CA 1.504 2.275 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 156.909 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.429 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 1.5 m -68.68 6.63 0.8 Allowed 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.388 -1.445 . . . . 0.0 113.162 155.913 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.906 ' O ' HG23 ' A' ' 11' ' ' VAL . 8.1 mt-10 -146.27 15.48 1.31 Allowed 'General case' 0 N--CA 1.501 2.098 0 C-N-CA 125.785 1.634 . . . . 0.0 112.13 171.511 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.757 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 1.8 t80 -73.44 -27.61 61.52 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.136 -0.977 . . . . 0.0 113.418 177.833 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.674 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -79.0 -31.97 41.44 Favored Glycine 1 CA--C 1.584 4.382 0 CA-C-O 122.872 1.262 . . . . 0.0 111.998 165.628 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.581 HG23 ' HA ' ' A' ' 7' ' ' GLU . 1.9 t -58.27 -27.7 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 C-N-CA 124.999 1.319 . . . . 0.0 111.779 159.187 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 7' ' ' GLU . 47.3 t -76.2 -65.13 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 C-N-CA 125.268 1.427 . . . . 0.0 110.74 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.451 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.0 mt -68.43 -26.16 65.39 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 123.283 1.516 . . . . 0.0 113.236 -175.757 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.674 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -71.7 -39.56 70.12 Favored 'General case' 0 CA--C 1.583 2.228 0 O-C-N 120.516 -1.365 . . . . 0.0 114.227 162.0 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.679 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -56.47 -29.09 28.06 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.326 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.917 164.359 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.757 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 15.6 m-20 -74.05 -34.76 64.17 Favored 'General case' 0 N--CA 1.502 2.172 0 C-N-CA 124.896 1.278 . . . . 0.0 111.241 176.403 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.807 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -51.87 -27.42 12.65 Favored 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 124.596 1.158 . . . . 0.0 114.099 156.454 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.075 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 24.0 mt -90.34 -11.79 39.61 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 163.307 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.48 -16.42 63.88 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-O 124.503 2.096 . . . . 0.0 111.215 155.068 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.807 HD12 ' HA ' ' A' ' 16' ' ' ALA . 41.9 mt -78.89 -43.46 24.88 Favored 'General case' 0 CA--C 1.575 1.941 0 C-N-CA 129.502 3.121 . . . . 0.0 113.154 155.555 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.075 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -35.39 -39.48 0.13 Allowed 'General case' 0 N--CA 1.509 2.482 0 CA-C-O 125.321 2.486 . . . . 0.0 109.506 158.331 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.562 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 1.2 tpp180 -99.89 -37.44 9.04 Favored 'General case' 0 CA--C 1.58 2.103 0 C-N-CA 128.34 2.656 . . . . 0.0 112.262 -157.569 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.621 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 5.1 mt-30 -65.96 -91.94 0.01 OUTLIER 'General case' 0 CA--C 1.579 2.093 0 C-N-CA 126.061 1.744 . . . . 0.0 112.514 176.166 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.1 t 179.74 139.79 0.3 Allowed Pre-proline 0 CA--C 1.584 2.281 0 C-N-CA 126.009 1.724 . . . . 0.0 114.894 -160.429 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -62.18 -143.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.577 2.626 0 C-N-CA 124.519 3.479 . . . . 0.0 115.117 -178.331 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.683 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -80.74 158.72 25.42 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 125.505 1.522 . . . . 0.0 114.374 -156.434 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.29 -10.36 0.94 Allowed Glycine 0 CA--C 1.576 3.866 0 O-C-N 120.815 -1.178 . . . . 0.0 113.921 177.032 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.564 0 O-C-N 120.979 -1.306 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 2.019 0 CA-C-O 120.948 0.404 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -133.77 18.59 3.86 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.021 -1.05 . . . . 0.0 112.564 162.326 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.761 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 1.4 mp -61.42 -2.93 0.81 Allowed 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -171.813 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 1.082 ' CB ' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 83.9 111.42 0.06 Allowed 'General case' 0 N--CA 1.507 2.4 0 CA-C-N 120.929 1.695 . . . . 0.0 112.504 -157.123 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.764 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -95.05 -37.64 11.01 Favored 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 163.425 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 4.8 t -68.79 5.36 1.12 Allowed 'General case' 0 N--CA 1.503 2.199 0 O-C-N 119.919 -1.738 . . . . 0.0 112.976 154.908 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 1.082 ' HB2' ' CB ' ' A' ' 4' ' ' LYS . 6.9 mt-10 -146.43 19.78 1.35 Allowed 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 126.915 2.086 . . . . 0.0 111.453 173.906 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.764 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 1.6 t80 -73.47 -26.36 60.88 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.113 -0.992 . . . . 0.0 113.186 173.95 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.16 -33.52 32.32 Favored Glycine 1 CA--C 1.583 4.295 0 CA-C-O 122.701 1.167 . . . . 0.0 112.203 166.157 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.661 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.1 t -53.38 -28.41 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.248 0 O-C-N 120.788 -1.419 . . . . 0.0 111.675 157.493 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 7' ' ' GLU . 41.7 t -77.18 -62.94 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 C-N-CA 125.225 1.41 . . . . 0.0 110.956 -179.812 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.435 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.6 mt -70.05 -29.26 66.23 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-O 123.074 1.416 . . . . 0.0 113.377 -173.83 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m -72.94 -25.91 61.2 Favored 'General case' 0 CA--C 1.581 2.164 0 O-C-N 120.302 -1.499 . . . . 0.0 114.672 162.618 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.498 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -65.74 -30.48 50.21 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.263 0 O-C-N 121.764 -0.585 . . . . 0.0 110.173 160.466 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.732 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 2.5 m-20 -71.95 -34.35 68.95 Favored 'General case' 0 CA--C 1.582 2.197 0 C-N-CA 124.559 1.144 . . . . 0.0 111.399 177.884 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.783 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.39 -27.53 16.11 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 157.113 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.067 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 30.6 mt -88.22 -13.77 40.2 Favored 'General case' 0 N--CA 1.505 2.284 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 163.255 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.968 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.0 -14.55 63.05 Favored 'General case' 0 N--CA 1.512 2.646 0 CA-C-O 124.447 2.07 . . . . 0.0 111.382 155.049 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 1.113 HD22 HD11 ' A' ' 25' ' ' LEU . 48.0 mt -81.83 -43.13 18.69 Favored 'General case' 0 CA--C 1.575 1.905 0 C-N-CA 129.238 3.015 . . . . 0.0 113.086 155.6 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' SER . . . . . 1.067 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -35.37 -38.62 0.1 Allowed 'General case' 0 N--CA 1.511 2.617 0 CA-C-O 125.497 2.57 . . . . 0.0 109.225 158.015 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.567 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.1 OUTLIER -98.53 -32.13 11.61 Favored 'General case' 0 CA--C 1.58 2.115 0 C-N-CA 129.52 3.128 . . . . 0.0 111.756 -162.591 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.723 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 5.4 mt-30 -80.01 -96.72 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 126.913 2.085 . . . . 0.0 113.316 161.882 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 t -158.45 165.46 18.51 Favored Pre-proline 0 CA--C 1.587 2.388 0 C-N-CA 126.989 2.116 . . . . 0.0 114.82 -178.949 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.797 ' C ' HD22 ' A' ' 25' ' ' LEU . 50.9 Cg_exo -71.55 29.45 0.24 Allowed 'Trans proline' 0 CA--C 1.575 2.538 1 C-N-CA 125.591 4.194 . . . . 0.0 119.508 -176.705 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 1.113 HD11 HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 24.62 -157.94 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 126.037 1.735 . . . . 0.0 115.349 -169.934 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.48 9.3 64.52 Favored Glycine 0 CA--C 1.575 3.834 0 O-C-N 120.327 -1.483 . . . . 0.0 114.171 163.965 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.555 0 O-C-N 121.009 -1.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.866 ' O ' HG23 ' A' ' 11' ' ' VAL . 13.5 mt-10 . . . . . 0 N--CA 1.501 2.087 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.24 -26.65 61.21 Favored 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 124.239 1.015 . . . . 0.0 113.551 169.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.76 -36.37 29.22 Favored Glycine 1 CA--C 1.581 4.173 0 O-C-N 121.061 -1.024 . . . . 0.0 112.535 170.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.554 ' CG2' ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -47.4 -33.46 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 120.805 -1.409 . . . . 0.0 111.294 156.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.866 HG23 ' O ' ' A' ' 7' ' ' GLU . 32.6 t -76.21 -62.13 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 C-N-CA 125.006 1.322 . . . . 0.0 110.911 -174.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.482 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.1 mt -70.37 -28.42 65.1 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.598 -1.314 . . . . 0.0 113.583 -175.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 m -72.88 -26.46 61.45 Favored 'General case' 0 CA--C 1.58 2.106 0 O-C-N 120.368 -1.457 . . . . 0.0 114.486 162.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.589 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -65.16 -31.52 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.241 0 O-C-N 121.808 -0.557 . . . . 0.0 110.031 161.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.778 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 56.0 m-20 -70.36 -36.93 74.48 Favored 'General case' 0 CA--C 1.581 2.163 0 C-N-CA 124.578 1.151 . . . . 0.0 111.823 178.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.806 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -50.78 -27.66 7.69 Favored 'General case' 0 CA--C 1.587 2.386 0 C-N-CA 124.98 1.312 . . . . 0.0 114.283 156.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.027 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 28.6 mt -87.28 -13.27 44.17 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 116.188 1.921 . . . . 0.0 116.188 164.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.978 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -69.9 -13.29 62.18 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 119.856 -1.778 . . . . 0.0 111.593 155.461 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.806 HD12 ' HA ' ' A' ' 16' ' ' ALA . 29.9 mt -85.51 -36.96 20.19 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 130.6 3.56 . . . . 0.0 113.36 154.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.027 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -38.29 -36.97 0.26 Allowed 'General case' 0 N--CA 1.515 2.776 0 CA-C-O 125.882 2.753 . . . . 0.0 108.424 158.525 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.582 2.174 1 C-N-CA 132.626 4.371 . . . . 0.0 111.992 173.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.852 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.5 mt-10 . . . . . 0 N--CA 1.501 2.094 0 CA-C-O 121.251 0.548 . . . . 0.0 111.642 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -70.09 -30.58 67.83 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.39 -0.819 . . . . 0.0 112.865 157.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.69 -28.07 52.34 Favored Glycine 1 CA--C 1.584 4.355 0 CA-C-O 122.435 1.019 . . . . 0.0 111.79 171.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.712 HG23 ' HA ' ' A' ' 7' ' ' GLU . 5.1 t -56.67 -29.56 30.06 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 C-N-CA 125.24 1.416 . . . . 0.0 111.705 156.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.852 HG23 ' O ' ' A' ' 7' ' ' GLU . 18.4 t -76.5 -45.3 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 C-N-CA 124.987 1.315 . . . . 0.0 110.581 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.427 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.0 mt -67.88 -27.52 66.74 Favored 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 123.208 1.48 . . . . 0.0 113.546 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.74 -27.51 62.08 Favored 'General case' 0 CA--C 1.582 2.177 0 O-C-N 120.226 -1.546 . . . . 0.0 114.546 163.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.99 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -65.35 -31.93 55.99 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 122.87 0.468 . . . . 0.0 110.318 161.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.947 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 12.6 m-20 -68.08 -35.66 78.54 Favored 'General case' 0 CA--C 1.581 2.157 0 C-N-CA 124.837 1.255 . . . . 0.0 111.667 175.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.815 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.64 -28.5 55.68 Favored 'General case' 0 CA--C 1.584 2.269 0 C-N-CA 124.1 0.96 . . . . 0.0 113.521 156.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.049 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 23.4 mt -89.08 -0.6 57.57 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 164.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 1.028 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -74.39 -29.68 61.64 Favored 'General case' 0 CA--C 1.592 2.574 0 CA-C-O 125.8 2.714 . . . . 0.0 110.818 153.734 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.815 HD12 ' HA ' ' A' ' 16' ' ' ALA . 35.2 mt -64.99 -40.12 94.48 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 128.704 2.802 . . . . 0.0 113.882 154.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.049 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.2 t -37.67 -43.18 0.61 Allowed 'General case' 0 CA--C 1.589 2.469 0 CA-C-O 124.971 2.319 . . . . 0.0 109.732 161.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 1.028 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.248 0 C-N-CA 127.268 2.227 . . . . 0.0 112.596 -168.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.889 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.2 mt-10 . . . . . 0 N--CA 1.501 2.121 0 CA-C-O 121.021 0.438 . . . . 0.0 112.008 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.467 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 3.0 t80 -71.08 -27.83 63.9 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.263 -0.898 . . . . 0.0 113.136 164.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.28 -36.61 30.38 Favored Glycine 1 CA--C 1.584 4.396 0 CA-C-O 122.77 1.205 . . . . 0.0 111.939 169.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.649 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.8 t -50.25 -29.99 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 C-N-CA 125.158 1.383 . . . . 0.0 111.751 157.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.889 HG23 ' O ' ' A' ' 7' ' ' GLU . 38.5 t -75.83 -61.7 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 C-N-CA 124.747 1.219 . . . . 0.0 111.005 -178.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.48 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.0 mt -64.4 -24.9 67.79 Favored 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 123.118 1.437 . . . . 0.0 113.675 -174.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.849 ' O ' HD13 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -73.17 -29.01 62.54 Favored 'General case' 0 CA--C 1.579 2.083 0 O-C-N 120.304 -1.498 . . . . 0.0 114.557 162.029 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.872 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -70.45 -19.32 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.586 2.342 0 CA-C-O 117.124 -1.417 . . . . 0.0 110.935 162.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.873 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 38.6 m-20 -73.65 -38.46 64.97 Favored 'General case' 0 CA--C 1.581 2.148 0 O-C-N 124.372 1.045 . . . . 0.0 110.908 167.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.82 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -50.78 -28.84 10.11 Favored 'General case' 0 CA--C 1.59 2.51 0 C-N-CA 125.285 1.434 . . . . 0.0 112.465 151.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.874 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.2 OUTLIER -88.94 -5.01 58.28 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 125.641 1.576 . . . . 0.0 114.981 168.131 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.962 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -77.6 -19.13 56.07 Favored 'General case' 0 CA--C 1.588 2.405 0 CA-C-O 124.683 2.182 . . . . 0.0 111.708 153.263 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.82 HD12 ' HA ' ' A' ' 16' ' ' ALA . 36.3 mt -76.08 -32.3 59.18 Favored 'General case' 0 CA--C 1.575 1.923 0 C-N-CA 129.073 2.949 . . . . 0.0 112.581 154.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.874 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -40.33 -40.73 1.22 Allowed 'General case' 0 N--CA 1.507 2.401 0 CA-C-O 124.563 2.125 . . . . 0.0 110.179 160.037 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.962 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.132 0 C-N-CA 127.176 2.19 . . . . 0.0 112.527 -160.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.871 ' O ' HG23 ' A' ' 11' ' ' VAL . 4.7 mt-10 . . . . . 0 N--CA 1.502 2.161 0 CA-C-O 121.096 0.474 . . . . 0.0 111.865 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -73.35 -29.3 62.57 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.93 -1.106 . . . . 0.0 113.028 170.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.55 -35.06 37.78 Favored Glycine 1 CA--C 1.584 4.385 0 CA-C-O 122.763 1.202 . . . . 0.0 111.925 170.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.601 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -49.05 -32.41 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 C-N-CA 125.306 1.442 . . . . 0.0 111.441 157.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.871 HG23 ' O ' ' A' ' 7' ' ' GLU . 28.6 t -76.55 -58.26 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 C-N-CA 124.839 1.256 . . . . 0.0 110.971 -176.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.42 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.2 mt -59.79 -28.4 67.4 Favored 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 125.274 1.43 . . . . 0.0 114.196 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.722 ' O ' HD13 ' A' ' 17' ' ' LEU . 1.0 OUTLIER -72.75 -27.53 62.08 Favored 'General case' 0 CA--C 1.582 2.179 0 O-C-N 120.378 -1.451 . . . . 0.0 114.664 163.596 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.871 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -70.62 -20.56 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.25 0 CA-C-O 117.487 -1.244 . . . . 0.0 111.164 161.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.871 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 5.5 m-20 -74.96 -38.66 61.64 Favored 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 124.448 1.099 . . . . 0.0 111.398 171.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.741 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -52.41 -27.98 18.02 Favored 'General case' 0 CA--C 1.59 2.507 0 C-N-CA 124.902 1.281 . . . . 0.0 112.403 152.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.835 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.71 -6.57 58.8 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 125.941 1.696 . . . . 0.0 114.623 167.413 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.915 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -77.39 -19.03 56.79 Favored 'General case' 0 CA--C 1.586 2.355 0 CA-C-O 124.445 2.069 . . . . 0.0 111.863 153.467 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.741 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 37.9 mt -77.2 -30.95 54.98 Favored 'General case' 0 CA--C 1.575 1.909 0 C-N-CA 128.721 2.808 . . . . 0.0 112.629 154.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.835 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -40.91 -39.31 1.12 Allowed 'General case' 0 CA--C 1.59 2.49 0 CA-C-O 124.783 2.23 . . . . 0.0 109.861 159.822 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.915 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 1.3 mmt180 . . . . . 0 N--CA 1.504 2.227 0 C-N-CA 127.603 2.361 . . . . 0.0 112.498 -163.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.92 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.5 mt-10 . . . . . 0 N--CA 1.501 2.109 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -73.68 -26.82 60.91 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.933 -1.104 . . . . 0.0 113.219 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.09 -34.62 32.82 Favored Glycine 1 CA--C 1.582 4.249 0 CA-C-O 122.303 0.946 . . . . 0.0 112.504 165.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.617 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.0 t -51.74 -31.63 13.28 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 O-C-N 120.884 -1.362 . . . . 0.0 111.422 158.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 7' ' ' GLU . 41.5 t -77.09 -63.89 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 C-N-CA 125.152 1.381 . . . . 0.0 110.846 -176.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 15' ' ' ASP . 5.2 mt -70.18 -29.94 66.94 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 123.51 1.624 . . . . 0.0 113.601 -175.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.416 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 3.6 m -73.19 -24.77 60.58 Favored 'General case' 0 CA--C 1.581 2.153 0 O-C-N 119.739 -1.851 . . . . 0.0 114.422 162.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.934 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.37 -30.39 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.239 0 O-C-N 121.794 -0.566 . . . . 0.0 110.283 160.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.9 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 20.5 m-20 -69.95 -35.34 74.43 Favored 'General case' 0 CA--C 1.581 2.17 0 C-N-CA 124.291 1.037 . . . . 0.0 111.55 176.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.755 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -52.03 -28.49 17.36 Favored 'General case' 0 CA--C 1.585 2.3 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 156.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.07 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 26.7 mt -88.16 -8.81 54.83 Favored 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 163.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.934 ' HE3' HG12 ' A' ' 14' ' ' VAL . 0.0 OUTLIER -71.0 -18.47 62.6 Favored 'General case' 0 N--CA 1.508 2.452 0 CA-C-O 124.894 2.283 . . . . 0.0 111.268 154.654 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.755 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 42.9 mt -76.46 -41.34 47.67 Favored 'General case' 0 CA--C 1.575 1.932 0 C-N-CA 129.498 3.119 . . . . 0.0 113.124 154.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.07 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.86 -40.67 0.47 Allowed 'General case' 0 CA--C 1.59 2.498 0 CA-C-O 125.315 2.483 . . . . 0.0 109.343 158.786 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.512 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.579 2.079 0 C-N-CA 128.032 2.533 . . . . 0.0 112.508 -168.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.914 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.6 mt-10 . . . . . 0 N--CA 1.502 2.161 0 CA-C-O 120.979 0.419 . . . . 0.0 111.829 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -73.28 -27.5 61.6 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.811 -1.181 . . . . 0.0 113.205 177.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.79 -38.03 28.46 Favored Glycine 1 CA--C 1.582 4.257 0 CA-C-O 122.71 1.172 . . . . 0.0 112.371 166.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 7' ' ' GLU . 1.9 t -48.31 -31.09 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 120.732 -1.452 . . . . 0.0 111.298 158.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 7' ' ' GLU . 42.3 t -77.07 -66.08 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 C-N-CA 125.08 1.352 . . . . 0.0 110.915 -178.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.447 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.4 mt -66.26 -28.47 68.74 Favored 'General case' 0 N--CA 1.503 2.206 0 CA-C-O 122.759 1.266 . . . . 0.0 113.588 -173.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.733 ' O ' HD13 ' A' ' 17' ' ' LEU . 19.2 m -72.67 -24.97 61.1 Favored 'General case' 0 CA--C 1.582 2.174 0 O-C-N 120.334 -1.479 . . . . 0.0 114.366 162.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.785 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t -72.39 -20.2 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.263 0 CA-C-O 117.38 -1.295 . . . . 0.0 111.088 161.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.739 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.5 m-20 -74.92 -38.74 61.72 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 124.316 1.01 . . . . 0.0 111.363 170.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.738 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -51.78 -27.3 11.76 Favored 'General case' 0 CA--C 1.59 2.512 0 C-N-CA 125.072 1.349 . . . . 0.0 112.528 151.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.874 ' CA ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -87.86 -7.64 56.94 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 125.836 1.654 . . . . 0.0 114.814 167.007 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.972 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -76.09 -17.77 59.47 Favored 'General case' 0 CA--C 1.588 2.417 0 O-C-N 118.88 -2.387 . . . . 0.0 111.739 153.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.738 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 37.8 mt -78.43 -33.89 48.29 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 129.102 2.961 . . . . 0.0 112.744 154.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.874 ' HB2' ' CA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -39.72 -38.62 0.66 Allowed 'General case' 0 CA--C 1.591 2.54 0 CA-C-O 125.643 2.64 . . . . 0.0 109.591 158.645 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.42 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.58 2.12 0 C-N-CA 128.731 2.812 . . . . 0.0 112.206 -156.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.622 ' HA ' HG23 ' A' ' 10' ' ' VAL . 13.0 mt-10 . . . . . 0 N--CA 1.501 2.125 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.528 ' CE1' HD21 ' A' ' 12' ' ' LEU . 3.2 t80 -73.33 -34.82 65.86 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.701 -1.249 . . . . 0.0 113.398 157.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.07 -41.82 98.36 Favored Glycine 1 CA--C 1.585 4.458 0 CA-C-O 122.414 1.008 . . . . 0.0 112.322 172.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.5 t -42.26 -37.67 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.25 0 C-N-CA 125.2 1.4 . . . . 0.0 111.243 159.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 7' ' ' GLU . 16.2 t -76.82 -50.39 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 C-N-CA 125.439 1.496 . . . . 0.0 110.737 -172.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.528 HD21 ' CE1' ' A' ' 8' ' ' PHE . 3.8 mt -70.07 -19.71 63.26 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 120.408 -1.432 . . . . 0.0 113.081 -175.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.748 ' O ' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -73.21 -30.04 63.23 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 162.601 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.782 ' HA ' HD22 ' A' ' 17' ' ' LEU . 2.1 t -67.43 -26.76 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.322 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.619 162.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.799 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 59.4 m-20 -70.39 -37.96 74.59 Favored 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 124.291 1.036 . . . . 0.0 111.553 169.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.744 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -53.5 -26.8 22.3 Favored 'General case' 0 CA--C 1.588 2.438 0 CA-C-O 122.847 1.308 . . . . 0.0 112.496 153.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.871 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.0 OUTLIER -88.02 -6.67 57.85 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 126.883 2.073 . . . . 0.0 114.654 167.634 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.964 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -79.24 -20.32 48.49 Favored 'General case' 0 CA--C 1.584 2.264 0 O-C-N 119.552 -1.967 . . . . 0.0 112.014 154.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.744 HD12 ' HA ' ' A' ' 16' ' ' ALA . 28.8 mt -77.33 -29.38 53.48 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 128.632 2.773 . . . . 0.0 112.681 155.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.871 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.17 -37.97 0.19 Allowed 'General case' 0 CA--C 1.59 2.487 0 CA-C-O 125.289 2.471 . . . . 0.0 109.65 157.597 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.85 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.219 0 C-N-CA 128.014 2.525 . . . . 0.0 112.359 -158.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.915 ' O ' HG23 ' A' ' 11' ' ' VAL . 13.0 mt-10 . . . . . 0 N--CA 1.502 2.138 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.474 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 0.7 OUTLIER -72.36 -25.3 61.48 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 124.107 0.963 . . . . 0.0 113.166 170.788 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.09 -36.25 25.15 Favored Glycine 1 CA--C 1.581 4.206 0 CA-C-O 122.212 0.895 . . . . 0.0 112.444 166.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.614 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.5 t -51.13 -29.39 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 O-C-N 120.827 -1.396 . . . . 0.0 111.712 157.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.915 HG23 ' O ' ' A' ' 7' ' ' GLU . 45.4 t -76.16 -64.47 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 C-N-CA 125.056 1.342 . . . . 0.0 110.93 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.41 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.4 mt -70.29 -29.4 66.15 Favored 'General case' 0 N--CA 1.502 2.152 0 CA-C-O 122.934 1.35 . . . . 0.0 113.515 -174.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.7 m -73.0 -26.48 61.34 Favored 'General case' 0 CA--C 1.58 2.134 0 O-C-N 120.338 -1.476 . . . . 0.0 114.538 162.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.613 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -65.19 -30.16 49.46 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.259 0 O-C-N 121.759 -0.588 . . . . 0.0 110.192 160.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.731 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 56.0 m-20 -71.91 -35.8 69.79 Favored 'General case' 0 CA--C 1.582 2.174 0 C-N-CA 124.589 1.155 . . . . 0.0 111.548 177.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.775 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.17 -28.4 18.03 Favored 'General case' 0 CA--C 1.585 2.296 0 C-N-CA 124.765 1.226 . . . . 0.0 113.823 155.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.006 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 27.7 mt -86.27 -11.29 52.7 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 163.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 1.004 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.08 -14.95 62.49 Favored 'General case' 0 N--CA 1.508 2.473 0 CA-C-O 124.317 2.008 . . . . 0.0 111.606 154.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.775 HD12 ' HA ' ' A' ' 16' ' ' ALA . 36.9 mt -81.15 -39.06 26.12 Favored 'General case' 0 CA--C 1.574 1.9 0 C-N-CA 128.857 2.863 . . . . 0.0 113.079 154.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.006 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -37.02 -39.91 0.26 Allowed 'General case' 0 CA--C 1.59 2.496 0 CA-C-O 124.806 2.241 . . . . 0.0 109.261 161.022 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.788 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.25 0 C-N-CA 127.327 2.251 . . . . 0.0 112.349 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.906 ' O ' HG23 ' A' ' 11' ' ' VAL . 4.8 mt-10 . . . . . 0 N--CA 1.502 2.154 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -73.2 -24.42 60.52 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.416 1.086 . . . . 0.0 113.087 175.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.43 -35.48 22.99 Favored Glycine 1 CA--C 1.579 4.046 0 O-C-N 121.513 -0.742 . . . . 0.0 113.057 165.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.573 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -49.81 -30.94 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 O-C-N 120.851 -1.382 . . . . 0.0 111.197 157.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 7' ' ' GLU . 40.7 t -77.07 -67.18 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 C-N-CA 125.25 1.42 . . . . 0.0 110.924 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.1 mt -70.18 -27.69 64.72 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-O 123.227 1.489 . . . . 0.0 113.344 -174.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.722 ' O ' HD13 ' A' ' 17' ' ' LEU . 3.8 m -72.94 -24.16 60.77 Favored 'General case' 0 CA--C 1.581 2.136 0 O-C-N 120.169 -1.582 . . . . 0.0 114.401 161.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.999 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -70.56 -23.59 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.276 0 CA-C-O 117.233 -1.365 . . . . 0.0 110.868 160.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.914 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.2 m-20 -72.92 -39.62 66.13 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 124.485 1.116 . . . . 0.0 111.535 172.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.798 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.66 -27.94 19.47 Favored 'General case' 0 CA--C 1.59 2.5 0 C-N-CA 124.781 1.232 . . . . 0.0 112.454 152.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.898 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.19 -6.08 59.06 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 125.719 1.608 . . . . 0.0 115.151 166.275 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.999 ' HE3' HG12 ' A' ' 14' ' ' VAL . 0.1 OUTLIER -77.12 -17.45 58.64 Favored 'General case' 0 CA--C 1.588 2.407 0 CA-C-O 124.519 2.104 . . . . 0.0 111.819 152.661 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' A' ' 16' ' ' ALA . 38.4 mt -78.38 -32.02 48.68 Favored 'General case' 0 CA--C 1.574 1.894 0 C-N-CA 128.692 2.797 . . . . 0.0 112.593 154.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.898 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -41.01 -39.87 1.29 Allowed 'General case' 0 CA--C 1.59 2.481 0 CA-C-O 124.7 2.19 . . . . 0.0 109.957 160.499 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.902 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.127 0 C-N-CA 127.466 2.307 . . . . 0.0 112.557 -164.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.921 ' O ' HG23 ' A' ' 11' ' ' VAL . 9.9 mt-10 . . . . . 0 N--CA 1.503 2.212 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -72.97 -25.95 61.19 Favored 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 124.221 1.008 . . . . 0.0 113.25 170.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.511 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -78.25 -35.94 32.41 Favored Glycine 1 CA--C 1.582 4.279 0 CA-C-O 122.484 1.047 . . . . 0.0 112.439 166.621 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.611 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -51.99 -31.12 13.48 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.904 -1.35 . . . . 0.0 111.93 158.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.921 HG23 ' O ' ' A' ' 7' ' ' GLU . 41.6 t -75.9 -62.64 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 C-N-CA 125.103 1.361 . . . . 0.0 111.061 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.43 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.5 mt -70.6 -27.2 63.91 Favored 'General case' 0 N--CA 1.502 2.161 0 CA-C-O 122.801 1.286 . . . . 0.0 113.493 -174.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.4 t -73.39 -30.44 63.27 Favored 'General case' 0 CA--C 1.579 2.073 0 O-C-N 120.507 -1.371 . . . . 0.0 114.643 162.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.976 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -61.16 -32.11 51.94 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.29 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 161.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.888 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 29.5 m-20 -71.57 -31.73 67.3 Favored 'General case' 0 CA--C 1.582 2.21 0 C-N-CA 125.007 1.323 . . . . 0.0 111.101 174.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.933 ' HA ' HD23 ' A' ' 19' ' ' LEU . . . -57.08 -25.7 59.17 Favored 'General case' 0 CA--C 1.581 2.16 0 C-N-CA 124.67 1.188 . . . . 0.0 113.59 156.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.053 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 23.9 mt -91.36 -4.68 55.51 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 117.363 2.357 . . . . 0.0 117.363 163.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.976 ' HE3' HG12 ' A' ' 14' ' ' VAL . 0.0 OUTLIER -75.34 -26.88 58.94 Favored 'General case' 0 CA--C 1.587 2.39 0 CA-C-O 124.674 2.178 . . . . 0.0 111.418 154.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.933 HD23 ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -80.22 -18.11 50.45 Favored 'General case' 0 CA--C 1.586 2.357 0 C-N-CA 129.691 3.196 . . . . 0.0 112.595 157.722 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.053 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -52.36 -43.31 64.59 Favored 'General case' 0 CA--C 1.592 2.565 0 CA-C-O 125.425 2.536 . . . . 0.0 109.651 156.322 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.757 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER . . . . . 0 CA--C 1.58 2.108 0 C-N-CA 128.101 2.561 . . . . 0.0 112.0 -168.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.905 ' O ' HG23 ' A' ' 11' ' ' VAL . 5.4 mt-10 . . . . . 0 N--CA 1.501 2.1 0 CA-C-O 121.138 0.494 . . . . 0.0 111.987 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.452 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 1.7 t80 -73.06 -23.77 60.61 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.111 -0.993 . . . . 0.0 113.144 164.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.21 -38.62 25.37 Favored Glycine 1 CA--C 1.581 4.192 0 O-C-N 121.357 -0.839 . . . . 0.0 112.799 163.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.672 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.5 t -50.03 -29.47 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.334 0 O-C-N 120.852 -1.381 . . . . 0.0 111.742 158.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.905 HG23 ' O ' ' A' ' 7' ' ' GLU . 42.0 t -76.09 -68.32 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 C-N-CA 125.035 1.334 . . . . 0.0 111.26 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.9 mt -68.65 -27.27 65.85 Favored 'General case' 0 N--CA 1.503 2.218 0 CA-C-O 123.642 1.687 . . . . 0.0 113.432 -173.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.777 ' O ' HD13 ' A' ' 17' ' ' LEU . 2.5 m -72.48 -25.0 61.26 Favored 'General case' 0 CA--C 1.581 2.144 0 O-C-N 119.902 -1.749 . . . . 0.0 114.192 161.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.845 ' HA ' HD22 ' A' ' 17' ' ' LEU . 2.1 t -71.99 -20.22 20.24 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.3 0 CA-C-O 117.132 -1.413 . . . . 0.0 111.203 161.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.834 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 58.1 m-20 -74.05 -39.76 63.28 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 124.423 1.077 . . . . 0.0 111.547 170.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.776 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -53.26 -25.4 14.33 Favored 'General case' 0 CA--C 1.59 2.507 0 C-N-CA 125.18 1.392 . . . . 0.0 113.059 152.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.992 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.5 -10.34 54.31 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 164.559 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.914 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.52 -13.78 60.72 Favored 'General case' 0 CA--C 1.587 2.391 0 O-C-N 119.461 -2.024 . . . . 0.0 111.695 154.299 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.776 HD12 ' HA ' ' A' ' 16' ' ' ALA . 33.2 mt -84.27 -33.95 23.9 Favored 'General case' 0 CA--C 1.573 1.858 0 C-N-CA 129.519 3.128 . . . . 0.0 112.922 154.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.992 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -41.38 -38.97 1.33 Allowed 'General case' 0 CA--C 1.602 2.954 0 CA-C-O 126.762 3.172 . . . . 0.0 108.075 156.624 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.658 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.588 2.408 1 C-N-CA 134.502 5.121 . . . . 0.0 110.898 -177.447 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.87 ' O ' HG23 ' A' ' 11' ' ' VAL . 4.9 mt-10 . . . . . 0 N--CA 1.503 2.221 0 CA-C-O 120.834 0.349 . . . . 0.0 111.867 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -72.65 -30.58 64.41 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.26 1.024 . . . . 0.0 112.819 169.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.34 -23.54 58.52 Favored Glycine 1 CA--C 1.583 4.296 0 CA-C-O 122.139 0.855 . . . . 0.0 112.237 170.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.7 t -60.83 -29.77 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.188 0 C-N-CA 125.073 1.349 . . . . 0.0 111.444 156.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.87 HG23 ' O ' ' A' ' 7' ' ' GLU . 21.8 t -76.67 -47.87 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 CA-C-O 123.39 1.567 . . . . 0.0 110.781 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.01 -24.72 64.24 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 119.979 -1.701 . . . . 0.0 113.228 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 10.7 m -73.04 -24.85 60.76 Favored 'General case' 0 CA--C 1.58 2.116 0 O-C-N 120.121 -1.612 . . . . 0.0 114.558 162.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.498 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.42 -33.41 63.27 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.266 0 O-C-N 121.658 -0.651 . . . . 0.0 110.202 160.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.797 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -65.81 -36.93 84.89 Favored 'General case' 0 CA--C 1.58 2.126 0 C-N-CA 124.488 1.115 . . . . 0.0 112.073 174.221 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.777 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.37 -28.14 18.38 Favored 'General case' 0 CA--C 1.586 2.338 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 157.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.093 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 26.9 mt -87.79 -8.41 55.99 Favored 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 163.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.16 -18.84 62.48 Favored 'General case' 0 N--CA 1.509 2.51 0 CA-C-O 124.814 2.245 . . . . 0.0 111.241 154.764 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.777 HD12 ' HA ' ' A' ' 16' ' ' ALA . 42.3 mt -76.13 -41.68 49.32 Favored 'General case' 0 CA--C 1.574 1.89 0 C-N-CA 129.502 3.121 . . . . 0.0 113.099 154.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.093 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.94 -41.47 0.55 Allowed 'General case' 0 N--CA 1.51 2.557 0 CA-C-O 125.399 2.523 . . . . 0.0 109.043 158.589 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.539 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.58 2.114 0 C-N-CA 128.22 2.608 . . . . 0.0 112.194 -173.068 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.872 ' O ' HG23 ' A' ' 11' ' ' VAL . 10.1 mt-10 . . . . . 0 CA--C 1.58 2.129 0 CA-C-O 121.369 0.604 . . . . 0.0 111.114 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -71.47 -28.76 64.17 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.289 -1.507 . . . . 0.0 112.739 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.99 -27.42 45.55 Favored Glycine 1 CA--C 1.582 4.223 0 CA-C-O 122.188 0.882 . . . . 0.0 112.323 169.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.0 t -55.46 -31.08 27.08 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.188 0 O-C-N 120.945 -1.326 . . . . 0.0 110.846 156.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.872 HG23 ' O ' ' A' ' 7' ' ' GLU . 22.4 t -77.2 -53.57 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 C-N-CA 125.504 1.521 . . . . 0.0 111.114 -177.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.447 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.2 mt -67.99 -26.77 66.07 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.223 -1.548 . . . . 0.0 113.412 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 m -72.67 -25.43 61.26 Favored 'General case' 0 CA--C 1.581 2.141 0 O-C-N 120.143 -1.598 . . . . 0.0 114.707 162.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.481 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t -66.24 -32.21 57.08 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.265 0 O-C-N 121.721 -0.612 . . . . 0.0 110.163 160.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.765 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -68.77 -33.75 74.42 Favored 'General case' 0 CA--C 1.582 2.209 0 C-N-CA 124.595 1.158 . . . . 0.0 111.579 175.513 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.777 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.33 -28.46 53.91 Favored 'General case' 0 CA--C 1.583 2.221 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 157.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.05 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 27.5 mt -87.28 -5.14 59.04 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 163.139 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.967 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.1 -18.71 60.2 Favored 'General case' 0 CA--C 1.587 2.382 0 CA-C-O 123.877 1.799 . . . . 0.0 111.291 153.886 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.777 HD12 ' HA ' ' A' ' 16' ' ' ALA . 36.1 mt -77.15 -36.57 55.14 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 129.118 2.967 . . . . 0.0 113.155 154.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.05 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.5 t -38.12 -41.25 0.57 Allowed 'General case' 0 CA--C 1.59 2.493 0 CA-C-O 124.99 2.329 . . . . 0.0 109.475 160.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.945 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.503 2.194 0 C-N-CA 127.357 2.263 . . . . 0.0 112.664 -173.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.874 ' O ' HG23 ' A' ' 11' ' ' VAL . 20.0 mt-10 . . . . . 0 N--CA 1.501 2.092 0 CA-C-O 121.057 0.456 . . . . 0.0 112.09 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -73.22 -26.63 61.22 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.825 -1.172 . . . . 0.0 113.148 167.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.93 -33.61 45.35 Favored Glycine 1 CA--C 1.581 4.2 0 CA-C-O 122.214 0.897 . . . . 0.0 112.548 166.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.663 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.9 t -53.21 -32.42 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 O-C-N 120.814 -1.404 . . . . 0.0 111.858 158.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 7' ' ' GLU . 33.7 t -76.67 -60.08 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 C-N-CA 125.23 1.412 . . . . 0.0 111.27 -175.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.09 -26.69 64.11 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.076 -1.64 . . . . 0.0 113.528 -178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.8 m -73.15 -23.92 60.52 Favored 'General case' 0 CA--C 1.58 2.108 0 O-C-N 120.122 -1.611 . . . . 0.0 114.545 162.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.825 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.34 -32.3 57.46 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.26 0 O-C-N 121.598 -0.688 . . . . 0.0 110.182 160.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.903 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.2 m-20 -67.88 -37.51 81.86 Favored 'General case' 0 CA--C 1.581 2.141 0 C-N-CA 124.538 1.135 . . . . 0.0 112.021 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.786 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.0 -28.21 16.13 Favored 'General case' 0 CA--C 1.585 2.316 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 156.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.103 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 29.1 mt -87.47 -8.73 56.1 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 164.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.903 ' HD3' ' HA ' ' A' ' 15' ' ' ASP . 0.0 OUTLIER -70.64 -20.38 62.73 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 124.891 2.282 . . . . 0.0 111.117 155.123 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.786 HD12 ' HA ' ' A' ' 16' ' ' ALA . 38.2 mt -75.52 -40.72 56.66 Favored 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 129.416 3.086 . . . . 0.0 113.286 155.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.103 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.91 -38.71 0.32 Allowed 'General case' 0 CA--C 1.59 2.506 0 CA-C-O 125.253 2.454 . . . . 0.0 109.464 160.002 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.424 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.58 2.112 0 C-N-CA 127.91 2.484 . . . . 0.0 112.353 -159.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.896 ' O ' HG23 ' A' ' 11' ' ' VAL . 8.5 mt-10 . . . . . 0 N--CA 1.502 2.163 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -73.05 -24.35 60.69 Favored 'General case' 0 N--CA 1.502 2.152 0 C-N-CA 124.308 1.043 . . . . 0.0 113.609 161.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.97 -37.21 26.16 Favored Glycine 1 CA--C 1.58 4.101 0 O-C-N 121.326 -0.859 . . . . 0.0 113.174 167.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.6 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.3 t -48.52 -32.55 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 O-C-N 120.827 -1.396 . . . . 0.0 111.431 157.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.896 HG23 ' O ' ' A' ' 7' ' ' GLU . 38.3 t -76.49 -64.5 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 C-N-CA 124.886 1.274 . . . . 0.0 111.121 -175.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.465 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.3 mt -70.58 -28.85 65.2 Favored 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 122.942 1.353 . . . . 0.0 113.568 -175.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.0 m -72.91 -24.92 60.89 Favored 'General case' 0 CA--C 1.581 2.149 0 O-C-N 120.174 -1.579 . . . . 0.0 114.523 162.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.973 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -65.86 -32.46 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.245 0 O-C-N 121.826 -0.546 . . . . 0.0 110.205 160.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.938 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 28.1 m-20 -69.67 -34.08 73.47 Favored 'General case' 0 CA--C 1.583 2.237 0 C-N-CA 124.65 1.18 . . . . 0.0 111.515 177.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.745 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -54.47 -28.61 45.7 Favored 'General case' 0 CA--C 1.583 2.222 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 157.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.979 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 26.7 mt -86.7 -8.08 57.73 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 116.221 1.934 . . . . 0.0 116.221 163.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.98 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -73.2 -17.32 61.37 Favored 'General case' 0 CA--C 1.588 2.434 0 CA-C-O 124.604 2.145 . . . . 0.0 111.485 154.471 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.745 HD12 ' HA ' ' A' ' 16' ' ' ALA . 33.6 mt -79.02 -36.67 40.76 Favored 'General case' 0 CA--C 1.574 1.888 0 C-N-CA 128.98 2.912 . . . . 0.0 113.078 155.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.979 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.4 t -38.48 -42.28 0.74 Allowed 'General case' 0 CA--C 1.59 2.513 0 CA-C-O 124.946 2.307 . . . . 0.0 109.453 160.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.98 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.501 2.096 0 C-N-CA 127.317 2.247 . . . . 0.0 112.676 -173.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.886 ' O ' HG23 ' A' ' 11' ' ' VAL . 12.8 mt-10 . . . . . 0 N--CA 1.501 2.103 0 CA-C-O 120.98 0.419 . . . . 0.0 112.054 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.461 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 0.4 OUTLIER -72.97 -27.64 61.93 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.025 -1.047 . . . . 0.0 113.132 165.603 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.9 -37.57 43.82 Favored Glycine 1 CA--C 1.584 4.406 0 CA-C-O 122.493 1.052 . . . . 0.0 112.123 167.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.648 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.0 t -49.74 -31.66 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 C-N-CA 125.19 1.396 . . . . 0.0 111.713 158.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 7' ' ' GLU . 36.1 t -76.3 -58.21 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 C-N-CA 125.106 1.362 . . . . 0.0 111.07 -176.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.435 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.5 mt -68.19 -28.25 67.11 Favored 'General case' 0 N--CA 1.503 2.217 0 CA-C-O 123.11 1.433 . . . . 0.0 113.641 -176.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 m -72.77 -26.73 61.65 Favored 'General case' 0 CA--C 1.582 2.179 0 O-C-N 120.201 -1.562 . . . . 0.0 114.715 162.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.809 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -65.56 -30.96 51.75 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 O-C-N 121.872 -0.517 . . . . 0.0 110.192 160.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.864 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 52.7 m-20 -70.02 -35.34 74.25 Favored 'General case' 0 CA--C 1.581 2.166 0 C-N-CA 124.547 1.139 . . . . 0.0 111.551 176.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.756 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.92 -28.91 25.62 Favored 'General case' 0 CA--C 1.584 2.268 0 C-N-CA 124.536 1.134 . . . . 0.0 114.033 156.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.091 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 25.9 mt -87.97 -5.29 58.61 Favored 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 163.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 1.046 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -74.58 -19.21 60.4 Favored 'General case' 0 CA--C 1.587 2.393 0 O-C-N 119.877 -1.764 . . . . 0.0 111.19 154.013 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.756 HD12 ' HA ' ' A' ' 16' ' ' ALA . 35.2 mt -76.3 -37.46 57.43 Favored 'General case' 0 CA--C 1.575 1.929 0 C-N-CA 129.124 2.969 . . . . 0.0 113.245 154.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.091 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -38.12 -41.91 0.62 Allowed 'General case' 0 CA--C 1.589 2.467 0 CA-C-O 124.789 2.233 . . . . 0.0 109.696 160.459 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 1.046 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.12 0 C-N-CA 127.24 2.216 . . . . 0.0 112.484 -173.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.88 ' O ' HG23 ' A' ' 11' ' ' VAL . 14.1 mt-10 . . . . . 0 N--CA 1.502 2.139 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.55 ' HD1' ' O ' ' A' ' 8' ' ' PHE . 0.5 OUTLIER -70.14 -29.36 66.26 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.182 -0.949 . . . . 0.0 112.66 157.186 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.83 -40.73 74.88 Favored Glycine 1 CA--C 1.585 4.433 0 CA-C-O 122.291 0.939 . . . . 0.0 111.893 166.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.695 HG23 ' HA ' ' A' ' 7' ' ' GLU . 4.0 t -51.83 -30.92 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.257 0 C-N-CA 125.487 1.515 . . . . 0.0 112.117 161.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 7' ' ' GLU . 39.8 t -75.9 -57.44 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 C-N-CA 125.011 1.324 . . . . 0.0 111.356 -176.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.46 HD21 ' HE1' ' A' ' 8' ' ' PHE . 4.6 mt -58.28 -27.64 64.23 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.352 -1.467 . . . . 0.0 114.21 175.33 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.42 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.3 m -72.91 -27.67 62.01 Favored 'General case' 0 CA--C 1.58 2.127 0 O-C-N 120.045 -1.66 . . . . 0.0 114.911 163.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.487 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -65.08 -30.21 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.273 0 O-C-N 121.736 -0.602 . . . . 0.0 110.18 161.022 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.72 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 9.1 m-20 -70.36 -35.05 73.31 Favored 'General case' 0 CA--C 1.582 2.177 0 C-N-CA 124.515 1.126 . . . . 0.0 111.328 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.797 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.49 -29.01 22.77 Favored 'General case' 0 CA--C 1.584 2.278 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 156.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.061 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 23.0 mt -88.29 -5.37 58.38 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 116.172 1.915 . . . . 0.0 116.172 163.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.992 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.91 -17.64 60.54 Favored 'General case' 0 CA--C 1.587 2.385 0 O-C-N 119.765 -1.834 . . . . 0.0 111.287 153.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.797 HD12 ' HA ' ' A' ' 16' ' ' ALA . 37.0 mt -77.49 -38.03 49.94 Favored 'General case' 0 CA--C 1.574 1.891 0 C-N-CA 129.163 2.985 . . . . 0.0 113.117 154.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.061 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -37.25 -41.87 0.42 Allowed 'General case' 0 CA--C 1.588 2.419 0 CA-C-O 124.788 2.232 . . . . 0.0 109.662 160.455 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.962 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 3.6 mmm180 . . . . . 0 N--CA 1.501 2.09 0 C-N-CA 127.365 2.266 . . . . 0.0 112.544 -173.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.877 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.2 mt-10 . . . . . 0 N--CA 1.502 2.169 0 CA-C-O 120.929 0.395 . . . . 0.0 111.95 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -72.75 -26.03 61.41 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.799 -1.188 . . . . 0.0 113.162 172.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.615 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -83.87 -24.29 49.67 Favored Glycine 1 CA--C 1.582 4.263 0 CA-C-O 122.795 1.22 . . . . 0.0 112.443 167.537 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.669 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -61.17 -28.47 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 120.651 -1.499 . . . . 0.0 111.395 156.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 7' ' ' GLU . 40.0 t -77.39 -63.08 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 C-N-CA 125.472 1.509 . . . . 0.0 111.456 -178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.495 ' N ' HD23 ' A' ' 12' ' ' LEU . 3.8 mt -61.91 -21.81 65.06 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 119.917 -1.739 . . . . 0.0 113.429 174.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.615 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 1.4 t -73.73 -29.91 62.52 Favored 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 161.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.823 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -63.18 -30.01 48.65 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.283 0 CA-C-O 119.043 -0.503 . . . . 0.0 109.777 162.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.889 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 53.5 m-20 -70.6 -36.3 73.46 Favored 'General case' 0 CA--C 1.581 2.136 0 C-N-CA 124.95 1.3 . . . . 0.0 111.5 173.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.816 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.48 -29.16 23.42 Favored 'General case' 0 CA--C 1.584 2.251 0 C-N-CA 124.893 1.277 . . . . 0.0 113.592 155.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.051 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 47.6 mt -90.0 -2.08 58.08 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 164.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.889 ' HD3' ' HA ' ' A' ' 15' ' ' ASP . 0.0 OUTLIER -75.97 -20.61 57.77 Favored 'General case' 0 CA--C 1.589 2.466 0 CA-C-O 124.881 2.277 . . . . 0.0 111.22 153.034 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.816 HD12 ' HA ' ' A' ' 16' ' ' ALA . 34.3 mt -74.63 -37.43 62.81 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 129.347 3.059 . . . . 0.0 113.166 155.12 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.051 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.8 t -37.11 -40.06 0.29 Allowed 'General case' 0 CA--C 1.587 2.399 0 CA-C-O 124.672 2.177 . . . . 0.0 109.97 160.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.821 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 4.3 mmm-85 . . . . . 0 N--CA 1.502 2.156 0 C-N-CA 126.939 2.096 . . . . 0.0 112.701 -164.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.857 ' O ' HG23 ' A' ' 11' ' ' VAL . 3.8 mt-10 . . . . . 0 N--CA 1.501 2.096 0 CA-C-O 121.313 0.577 . . . . 0.0 111.544 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.423 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 19.1 t80 -67.68 -37.7 82.7 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.313 -0.867 . . . . 0.0 113.036 163.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.59 -29.49 71.39 Favored Glycine 1 CA--C 1.581 4.192 0 CA-C-O 123.101 1.389 . . . . 0.0 112.211 167.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.744 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.7 t -63.15 -25.72 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 O-C-N 120.752 -1.44 . . . . 0.0 111.937 161.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 7' ' ' GLU . 16.4 t -76.8 -39.53 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 CA-C-O 123.275 1.512 . . . . 0.0 110.399 177.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.504 ' N ' HD23 ' A' ' 12' ' ' LEU . 3.7 mt -70.15 -26.45 63.94 Favored 'General case' 0 N--CA 1.502 2.13 0 CA-C-O 124.173 1.94 . . . . 0.0 112.733 176.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -73.01 -27.23 61.66 Favored 'General case' 0 CA--C 1.58 2.123 0 O-C-N 119.916 -1.74 . . . . 0.0 114.378 160.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.567 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -64.94 -30.94 51.84 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.245 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.26 161.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.754 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.2 m-20 -68.67 -37.08 79.34 Favored 'General case' 0 CA--C 1.582 2.178 0 C-N-CA 124.522 1.129 . . . . 0.0 111.725 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.786 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -52.5 -28.17 19.37 Favored 'General case' 0 CA--C 1.586 2.337 0 C-N-CA 124.696 1.198 . . . . 0.0 114.232 155.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.068 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 28.4 mt -87.16 -6.7 58.53 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 163.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 1.004 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -73.85 -16.96 61.12 Favored 'General case' 0 N--CA 1.507 2.417 0 CA-C-O 124.896 2.284 . . . . 0.0 111.365 154.502 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.786 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 45.8 mt -77.16 -40.47 45.38 Favored 'General case' 0 CA--C 1.575 1.913 0 C-N-CA 129.711 3.204 . . . . 0.0 112.842 153.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.068 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -39.15 -39.75 0.63 Allowed 'General case' 0 CA--C 1.589 2.472 0 CA-C-O 125.297 2.475 . . . . 0.0 109.508 158.685 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.627 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.579 2.087 0 C-N-CA 127.767 2.427 . . . . 0.0 112.369 -160.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.914 ' O ' HG23 ' A' ' 11' ' ' VAL . 8.8 mt-10 . . . . . 0 N--CA 1.501 2.117 0 CA-C-O 121.126 0.489 . . . . 0.0 111.789 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.48 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 3.6 t80 -69.49 -32.01 70.63 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.861 -1.149 . . . . 0.0 113.078 171.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -72.63 -35.23 59.27 Favored Glycine 1 CA--C 1.587 4.539 0 CA-C-O 122.878 1.265 . . . . 0.0 111.736 168.232 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.67 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.2 t -55.55 -28.43 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.252 0 C-N-CA 125.175 1.39 . . . . 0.0 111.76 160.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 7' ' ' GLU . 33.0 t -77.03 -53.14 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 C-N-CA 125.11 1.364 . . . . 0.0 110.954 -177.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.419 ' O ' ' HB2' ' A' ' 15' ' ' ASP . 5.4 mt -70.97 -33.85 70.84 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -174.412 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 7.9 t -75.18 -20.52 59.28 Favored 'General case' 0 CA--C 1.578 2.023 0 O-C-N 120.373 -1.455 . . . . 0.0 114.42 160.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.537 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -66.29 -29.11 45.61 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.251 0 O-C-N 121.631 -0.668 . . . . 0.0 110.186 157.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.819 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.1 m-20 -73.85 -34.94 64.72 Favored 'General case' 0 CA--C 1.583 2.231 0 CA-C-O 122.462 1.125 . . . . 0.0 110.806 175.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.82 -28.83 24.5 Favored 'General case' 0 CA--C 1.584 2.272 0 C-N-CA 125.135 1.374 . . . . 0.0 113.59 154.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.036 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 27.0 mt -89.34 -4.04 58.24 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 163.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.941 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -75.49 -18.17 59.91 Favored 'General case' 0 CA--C 1.588 2.435 0 CA-C-O 123.938 1.828 . . . . 0.0 111.286 153.328 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.826 HD12 ' HA ' ' A' ' 16' ' ' ALA . 34.2 mt -76.62 -37.79 55.8 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 129.269 3.028 . . . . 0.0 113.112 154.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.036 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -37.26 -40.31 0.33 Allowed 'General case' 0 CA--C 1.587 2.397 0 CA-C-O 124.527 2.108 . . . . 0.0 109.768 160.009 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.941 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 2.4 mmt180 . . . . . 0 N--CA 1.502 2.127 0 C-N-CA 127.122 2.169 . . . . 0.0 112.733 -169.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.92 ' O ' HG23 ' A' ' 11' ' ' VAL . 14.9 mt-10 . . . . . 0 N--CA 1.501 2.099 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.19 -24.49 60.54 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.971 -1.08 . . . . 0.0 113.425 171.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.531 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -77.61 -35.41 36.5 Favored Glycine 1 CA--C 1.582 4.27 0 O-C-N 121.187 -0.946 . . . . 0.0 112.762 165.092 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.599 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -53.34 -31.97 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.277 0 O-C-N 120.977 -1.308 . . . . 0.0 111.582 159.47 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 7' ' ' GLU . 40.9 t -76.91 -63.94 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 125.056 1.343 . . . . 0.0 111.025 -175.77 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.0 mt -70.74 -27.25 63.81 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.727 -1.233 . . . . 0.0 114.03 -177.528 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.531 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 29.4 t -74.4 -25.54 59.54 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.513 -1.367 . . . . 0.0 114.614 162.223 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.607 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -63.54 -33.53 62.07 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.287 0 O-C-N 122.002 -0.436 . . . . 0.0 109.944 159.618 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.828 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 14.8 m-20 -69.44 -33.99 73.76 Favored 'General case' 0 CA--C 1.583 2.216 0 C-N-CA 124.826 1.25 . . . . 0.0 111.377 174.093 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.775 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.45 -28.17 52.69 Favored 'General case' 0 CA--C 1.582 2.201 0 C-N-CA 124.236 1.014 . . . . 0.0 113.702 157.508 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.021 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 44.4 mt -89.79 -2.59 58.27 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 116.295 1.961 . . . . 0.0 116.295 163.597 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.932 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -76.3 -18.67 58.85 Favored 'General case' 0 CA--C 1.587 2.395 0 CA-C-O 124.638 2.161 . . . . 0.0 111.463 153.072 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.775 HD12 ' HA ' ' A' ' 16' ' ' ALA . 33.4 mt -76.61 -36.87 57.21 Favored 'General case' 0 CA--C 1.575 1.907 0 C-N-CA 129.222 3.009 . . . . 0.0 112.996 155.097 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.021 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.3 t -37.43 -38.83 0.26 Allowed 'General case' 0 CA--C 1.587 2.378 0 CA-C-O 124.351 2.024 . . . . 0.0 109.897 160.069 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.769 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.503 2.211 0 C-N-CA 126.599 1.96 . . . . 0.0 112.803 -165.081 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.89 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.3 mt-10 . . . . . 0 N--CA 1.502 2.135 0 CA-C-O 120.838 0.352 . . . . 0.0 111.902 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -72.92 -28.38 62.42 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 120.729 -1.232 . . . . 0.0 113.263 167.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.15 -35.19 57.48 Favored Glycine 1 CA--C 1.584 4.398 0 CA-C-O 122.697 1.165 . . . . 0.0 112.042 167.816 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.688 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -53.79 -33.83 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 C-N-CA 125.288 1.435 . . . . 0.0 111.753 160.978 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.89 HG23 ' O ' ' A' ' 7' ' ' GLU . 33.3 t -76.56 -59.11 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 C-N-CA 125.129 1.372 . . . . 0.0 111.258 -173.316 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.459 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.3 mt -67.59 -25.95 66.03 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 120.32 -1.488 . . . . 0.0 113.587 -177.337 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m -72.89 -26.46 61.44 Favored 'General case' 0 CA--C 1.581 2.161 0 O-C-N 120.233 -1.542 . . . . 0.0 114.626 162.269 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.842 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.13 -30.06 48.72 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.242 0 O-C-N 121.841 -0.537 . . . . 0.0 110.188 161.381 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.87 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.7 m-20 -70.23 -37.26 74.96 Favored 'General case' 0 CA--C 1.581 2.144 0 C-N-CA 124.616 1.166 . . . . 0.0 111.859 176.119 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.824 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -51.17 -27.17 8.09 Favored 'General case' 0 CA--C 1.587 2.387 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 156.266 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.048 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 25.5 mt -89.38 -10.62 45.92 Favored 'General case' 0 N--CA 1.505 2.276 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 164.199 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.894 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.59 -20.2 64.5 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 124.772 2.225 . . . . 0.0 111.218 155.119 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 16' ' ' ALA . 34.2 mt -76.17 -42.71 45.62 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 129.123 2.969 . . . . 0.0 113.307 155.237 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.048 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -37.34 -40.85 0.38 Allowed 'General case' 0 N--CA 1.512 2.626 0 CA-C-O 125.225 2.44 . . . . 0.0 108.802 158.183 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.54 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.579 2.089 0 C-N-CA 128.032 2.533 . . . . 0.0 112.128 -176.527 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.824 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.4 mt-10 . . . . . 0 N--CA 1.503 2.214 0 CA-C-O 121.422 0.63 . . . . 0.0 112.08 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -73.82 -27.72 61.26 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.585 -1.322 . . . . 0.0 113.217 169.497 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.67 -34.69 38.49 Favored Glycine 1 CA--C 1.583 4.29 0 CA-C-O 122.51 1.061 . . . . 0.0 112.2 171.13 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.623 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.5 t -47.07 -35.69 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.152 0 O-C-N 120.823 -1.398 . . . . 0.0 110.959 156.665 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 7' ' ' GLU . 23.5 t -76.86 -55.65 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 C-N-CA 125.329 1.451 . . . . 0.0 111.004 -173.013 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.427 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.3 mt -70.19 -28.37 65.26 Favored 'General case' 0 N--CA 1.502 2.17 0 CA-C-O 123.473 1.606 . . . . 0.0 113.321 -177.031 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.413 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.8 m -72.46 -25.58 61.5 Favored 'General case' 0 CA--C 1.582 2.184 0 O-C-N 120.076 -1.64 . . . . 0.0 114.516 163.259 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.653 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -66.34 -32.33 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.255 0 C-N-CA 123.091 0.556 . . . . 0.0 110.25 160.515 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.796 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 2.0 m-20 -69.07 -32.52 72.02 Favored 'General case' 0 CA--C 1.583 2.24 0 C-N-CA 124.526 1.13 . . . . 0.0 111.436 176.136 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.788 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.41 -28.4 53.93 Favored 'General case' 0 CA--C 1.584 2.265 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 158.068 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.023 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 25.6 mt -88.63 -4.72 58.5 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 116.317 1.969 . . . . 0.0 116.317 163.156 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.939 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.25 -18.43 60.1 Favored 'General case' 0 CA--C 1.586 2.356 0 O-C-N 119.913 -1.742 . . . . 0.0 111.283 153.681 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.788 HD12 ' HA ' ' A' ' 16' ' ' ALA . 35.3 mt -77.0 -37.27 55.45 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 129.014 2.926 . . . . 0.0 113.123 154.946 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.023 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.5 t -36.97 -40.81 0.31 Allowed 'General case' 0 CA--C 1.588 2.426 0 CA-C-O 124.927 2.298 . . . . 0.0 109.786 160.608 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.791 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 6.4 mmm180 . . . . . 0 N--CA 1.502 2.142 0 C-N-CA 127.743 2.417 . . . . 0.0 112.689 -170.677 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.906 ' O ' HG23 ' A' ' 11' ' ' VAL . 8.1 mt-10 . . . . . 0 N--CA 1.501 2.098 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.467 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 1.8 t80 -73.44 -27.61 61.52 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.136 -0.977 . . . . 0.0 113.418 177.833 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.674 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -79.0 -31.97 41.44 Favored Glycine 1 CA--C 1.584 4.382 0 CA-C-O 122.872 1.262 . . . . 0.0 111.998 165.628 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.581 HG23 ' HA ' ' A' ' 7' ' ' GLU . 1.9 t -58.27 -27.7 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 C-N-CA 124.999 1.319 . . . . 0.0 111.779 159.187 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 7' ' ' GLU . 47.3 t -76.2 -65.13 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 C-N-CA 125.268 1.427 . . . . 0.0 110.74 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.451 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.0 mt -68.43 -26.16 65.39 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 123.283 1.516 . . . . 0.0 113.236 -175.757 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.674 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -71.7 -39.56 70.12 Favored 'General case' 0 CA--C 1.583 2.228 0 O-C-N 120.516 -1.365 . . . . 0.0 114.227 162.0 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.679 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -56.47 -29.09 28.06 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.326 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.917 164.359 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.757 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 15.6 m-20 -74.05 -34.76 64.17 Favored 'General case' 0 N--CA 1.502 2.172 0 C-N-CA 124.896 1.278 . . . . 0.0 111.241 176.403 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.807 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -51.87 -27.42 12.65 Favored 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 124.596 1.158 . . . . 0.0 114.099 156.454 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.075 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 24.0 mt -90.34 -11.79 39.61 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 163.307 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.48 -16.42 63.88 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-O 124.503 2.096 . . . . 0.0 111.215 155.068 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.807 HD12 ' HA ' ' A' ' 16' ' ' ALA . 41.9 mt -78.89 -43.46 24.88 Favored 'General case' 0 CA--C 1.575 1.941 0 C-N-CA 129.502 3.121 . . . . 0.0 113.154 155.555 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.075 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -35.39 -39.48 0.13 Allowed 'General case' 0 N--CA 1.509 2.482 0 CA-C-O 125.321 2.486 . . . . 0.0 109.506 158.331 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.562 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 1.2 tpp180 . . . . . 0 CA--C 1.58 2.103 0 C-N-CA 128.34 2.656 . . . . 0.0 112.262 -157.569 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.906 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.9 mt-10 . . . . . 0 N--CA 1.502 2.144 0 CA-C-O 121.103 0.478 . . . . 0.0 111.453 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.464 ' HA ' ' CG2' ' A' ' 11' ' ' VAL . 1.6 t80 -73.47 -26.36 60.88 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.113 -0.992 . . . . 0.0 113.186 173.95 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.16 -33.52 32.32 Favored Glycine 1 CA--C 1.583 4.295 0 CA-C-O 122.701 1.167 . . . . 0.0 112.203 166.157 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.661 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.1 t -53.38 -28.41 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.248 0 O-C-N 120.788 -1.419 . . . . 0.0 111.675 157.493 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 7' ' ' GLU . 41.7 t -77.18 -62.94 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 C-N-CA 125.225 1.41 . . . . 0.0 110.956 -179.812 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.435 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.6 mt -70.05 -29.26 66.23 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-O 123.074 1.416 . . . . 0.0 113.377 -173.83 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m -72.94 -25.91 61.2 Favored 'General case' 0 CA--C 1.581 2.164 0 O-C-N 120.302 -1.499 . . . . 0.0 114.672 162.618 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.498 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -65.74 -30.48 50.21 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.263 0 O-C-N 121.764 -0.585 . . . . 0.0 110.173 160.466 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.732 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 2.5 m-20 -71.95 -34.35 68.95 Favored 'General case' 0 CA--C 1.582 2.197 0 C-N-CA 124.559 1.144 . . . . 0.0 111.399 177.884 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.783 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.39 -27.53 16.11 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 157.113 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.067 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 30.6 mt -88.22 -13.77 40.2 Favored 'General case' 0 N--CA 1.505 2.284 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 163.255 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.968 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.0 -14.55 63.05 Favored 'General case' 0 N--CA 1.512 2.646 0 CA-C-O 124.447 2.07 . . . . 0.0 111.382 155.049 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.783 HD12 ' HA ' ' A' ' 16' ' ' ALA . 48.0 mt -81.83 -43.13 18.69 Favored 'General case' 0 CA--C 1.575 1.905 0 C-N-CA 129.238 3.015 . . . . 0.0 113.086 155.6 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 1.067 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -35.37 -38.62 0.1 Allowed 'General case' 0 N--CA 1.511 2.617 0 CA-C-O 125.497 2.57 . . . . 0.0 109.225 158.015 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.567 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.58 2.115 0 C-N-CA 129.52 3.128 . . . . 0.0 111.756 -162.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 tmm? . . . . . 0 N--CA 1.499 2.018 0 CA-C-O 120.803 0.335 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.631 ' HG2' ' HE3' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -163.32 -102.8 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.931 -1.106 . . . . 0.0 112.531 -157.369 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.42 ' H ' ' HB3' ' A' ' 2' ' ' GLU . 0.6 OUTLIER 35.82 41.5 0.12 Allowed 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 125.381 1.473 . . . . 0.0 114.405 168.032 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.631 ' HE3' ' HG2' ' A' ' 2' ' ' GLU . 0.0 OUTLIER -21.47 88.3 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.222 0 C-N-CA 125.045 1.338 . . . . 0.0 113.71 156.366 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.806 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -120.75 -27.09 5.13 Favored 'General case' 0 N--CA 1.509 2.485 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 164.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.37 7.32 0.46 Allowed 'General case' 0 CA--C 1.583 2.24 0 O-C-N 120.811 -1.18 . . . . 0.0 112.671 153.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.866 ' O ' HG23 ' A' ' 11' ' ' VAL . 13.5 mt-10 -140.8 -2.09 1.37 Allowed 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 126.507 1.923 . . . . 0.0 112.64 170.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.806 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.1 OUTLIER -73.24 -26.65 61.21 Favored 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 124.239 1.015 . . . . 0.0 113.551 169.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.76 -36.37 29.22 Favored Glycine 1 CA--C 1.581 4.173 0 O-C-N 121.061 -1.024 . . . . 0.0 112.535 170.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.554 ' CG2' ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -47.4 -33.46 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 120.805 -1.409 . . . . 0.0 111.294 156.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.866 HG23 ' O ' ' A' ' 7' ' ' GLU . 32.6 t -76.21 -62.13 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 C-N-CA 125.006 1.322 . . . . 0.0 110.911 -174.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.482 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.1 mt -70.37 -28.42 65.1 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 120.598 -1.314 . . . . 0.0 113.583 -175.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 m -72.88 -26.46 61.45 Favored 'General case' 0 CA--C 1.58 2.106 0 O-C-N 120.368 -1.457 . . . . 0.0 114.486 162.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.589 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -65.16 -31.52 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.241 0 O-C-N 121.808 -0.557 . . . . 0.0 110.031 161.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.778 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 56.0 m-20 -70.36 -36.93 74.48 Favored 'General case' 0 CA--C 1.581 2.163 0 C-N-CA 124.578 1.151 . . . . 0.0 111.823 178.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.806 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -50.78 -27.66 7.69 Favored 'General case' 0 CA--C 1.587 2.386 0 C-N-CA 124.98 1.312 . . . . 0.0 114.283 156.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.027 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 28.6 mt -87.28 -13.27 44.17 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 116.188 1.921 . . . . 0.0 116.188 164.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.978 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -69.9 -13.29 62.18 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 119.856 -1.778 . . . . 0.0 111.593 155.461 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.923 ' HA ' ' HG2' ' A' ' 22' ' ' GLN . 29.9 mt -85.51 -36.96 20.19 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 130.6 3.56 . . . . 0.0 113.36 154.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.027 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -38.29 -36.97 0.26 Allowed 'General case' 0 N--CA 1.515 2.776 0 CA-C-O 125.882 2.753 . . . . 0.0 108.424 158.525 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.707 ' HG3' ' H ' ' A' ' 23' ' ' SER . 0.0 OUTLIER -93.96 -54.32 3.64 Favored 'General case' 0 CA--C 1.582 2.174 1 C-N-CA 132.626 4.371 . . . . 0.0 111.992 173.129 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.923 ' HG2' ' HA ' ' A' ' 19' ' ' LEU . 9.0 mt-30 53.52 -28.04 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.525 1 C-N-CA 132.728 4.411 . . . . 0.0 117.211 -159.629 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.707 ' H ' ' HG3' ' A' ' 21' ' ' ARG . 0.4 OUTLIER 176.5 98.8 0.11 Allowed Pre-proline 0 CA--C 1.584 2.271 0 N-CA-C 116.647 2.091 . . . . 0.0 116.647 -160.013 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.688 ' C ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -5.27 66.19 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.255 1 C-N-CA 128.237 5.958 . . . . 0.0 117.922 172.418 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.723 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER 27.64 -157.4 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 127.024 2.13 . . . . 0.0 115.714 179.456 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -29.75 -98.73 0.01 OUTLIER Glycine 0 CA--C 1.572 3.625 0 O-C-N 120.322 -1.486 . . . . 0.0 115.519 164.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.351 0.662 0 O-C-N 120.717 -1.461 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.033 0 CA-C-O 120.741 0.305 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.724 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 4.3 pm0 -120.75 20.37 11.7 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.983 -1.073 . . . . 0.0 112.827 -168.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.724 ' HB2' ' O ' ' A' ' 2' ' ' GLU . 0.0 OUTLIER 142.74 51.69 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 127.321 2.248 . . . . 0.0 113.206 -175.176 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.98 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 4.4 mptt 52.61 59.04 4.76 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.634 -1.291 . . . . 0.0 113.354 157.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.495 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -74.26 -28.56 61.27 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.727 -1.233 . . . . 0.0 113.976 156.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.644 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 1.5 t -68.22 9.72 0.29 Allowed 'General case' 0 CA--C 1.583 2.234 0 O-C-N 120.709 -1.244 . . . . 0.0 112.735 154.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.98 ' HB2' ' HB3' ' A' ' 4' ' ' LYS . 6.5 mt-10 -145.22 21.2 1.56 Allowed 'General case' 0 N--CA 1.501 2.094 0 C-N-CA 126.468 1.907 . . . . 0.0 111.642 166.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.495 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.9 OUTLIER -70.09 -30.58 67.83 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.39 -0.819 . . . . 0.0 112.865 157.418 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.69 -28.07 52.34 Favored Glycine 1 CA--C 1.584 4.355 0 CA-C-O 122.435 1.019 . . . . 0.0 111.79 171.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.712 HG23 ' HA ' ' A' ' 7' ' ' GLU . 5.1 t -56.67 -29.56 30.06 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 C-N-CA 125.24 1.416 . . . . 0.0 111.705 156.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.852 HG23 ' O ' ' A' ' 7' ' ' GLU . 18.4 t -76.5 -45.3 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 C-N-CA 124.987 1.315 . . . . 0.0 110.581 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.427 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.0 mt -67.88 -27.52 66.74 Favored 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 123.208 1.48 . . . . 0.0 113.546 178.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.74 -27.51 62.08 Favored 'General case' 0 CA--C 1.582 2.177 0 O-C-N 120.226 -1.546 . . . . 0.0 114.546 163.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.99 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -65.35 -31.93 55.99 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 C-N-CA 122.87 0.468 . . . . 0.0 110.318 161.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.947 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 12.6 m-20 -68.08 -35.66 78.54 Favored 'General case' 0 CA--C 1.581 2.157 0 C-N-CA 124.837 1.255 . . . . 0.0 111.667 175.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.815 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.64 -28.5 55.68 Favored 'General case' 0 CA--C 1.584 2.269 0 C-N-CA 124.1 0.96 . . . . 0.0 113.521 156.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.049 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 23.4 mt -89.08 -0.6 57.57 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 164.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 1.028 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -74.39 -29.68 61.64 Favored 'General case' 0 CA--C 1.592 2.574 0 CA-C-O 125.8 2.714 . . . . 0.0 110.818 153.734 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.815 HD12 ' HA ' ' A' ' 16' ' ' ALA . 35.2 mt -64.99 -40.12 94.48 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 128.704 2.802 . . . . 0.0 113.882 154.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.049 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.2 t -37.67 -43.18 0.61 Allowed 'General case' 0 CA--C 1.589 2.469 0 CA-C-O 124.971 2.319 . . . . 0.0 109.732 161.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 1.028 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -81.73 -43.28 18.64 Favored 'General case' 0 N--CA 1.504 2.248 0 C-N-CA 127.268 2.227 . . . . 0.0 112.596 -168.446 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.504 ' HG3' ' HA ' ' A' ' 19' ' ' LEU . 5.9 mt-30 -38.05 -77.48 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.276 0 CA-C-O 123.087 1.422 . . . . 0.0 111.41 157.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 84.7 p -47.09 92.38 0.05 OUTLIER Pre-proline 0 N--CA 1.502 2.151 0 C-N-CA 124.89 1.276 . . . . 0.0 113.385 173.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -64.54 -144.43 0.01 OUTLIER 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 124.105 3.203 . . . . 0.0 115.16 -174.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.689 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -83.15 -177.48 6.77 Favored 'General case' 0 N--CA 1.502 2.16 0 C-N-CA 125.29 1.436 . . . . 0.0 114.043 -158.251 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 28.02 94.02 0.01 OUTLIER Glycine 0 CA--C 1.571 3.575 0 N-CA-C 117.091 1.597 . . . . 0.0 117.091 156.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.553 0 O-C-N 120.83 -1.394 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.499 2.015 0 CA-C-O 120.809 0.338 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.453 ' HB3' ' H ' ' A' ' 3' ' ' LEU . 2.1 mt-10 61.95 -136.07 0.52 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.002 -1.061 . . . . 0.0 112.514 -162.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.575 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 0.1 OUTLIER 61.4 67.39 0.79 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.598 -1.314 . . . . 0.0 113.124 -173.049 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.834 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 0.2 OUTLIER 114.09 69.58 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 127.498 2.319 . . . . 0.0 112.391 -158.688 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.746 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -83.73 -30.77 26.43 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 156.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.464 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 0.6 OUTLIER -66.95 5.83 0.6 Allowed 'General case' 0 N--CA 1.505 2.291 0 O-C-N 120.464 -1.398 . . . . 0.0 112.931 155.601 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.889 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.2 mt-10 -143.26 15.97 1.87 Allowed 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 126.064 1.745 . . . . 0.0 112.008 168.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.746 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 3.0 t80 -71.08 -27.83 63.9 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.263 -0.898 . . . . 0.0 113.136 164.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.28 -36.61 30.38 Favored Glycine 1 CA--C 1.584 4.396 0 CA-C-O 122.77 1.205 . . . . 0.0 111.939 169.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.649 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.8 t -50.25 -29.99 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 C-N-CA 125.158 1.383 . . . . 0.0 111.751 157.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.889 HG23 ' O ' ' A' ' 7' ' ' GLU . 38.5 t -75.83 -61.7 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.915 0 C-N-CA 124.747 1.219 . . . . 0.0 111.005 -178.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.48 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.0 mt -64.4 -24.9 67.79 Favored 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 123.118 1.437 . . . . 0.0 113.675 -174.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.849 ' O ' HD13 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -73.17 -29.01 62.54 Favored 'General case' 0 CA--C 1.579 2.083 0 O-C-N 120.304 -1.498 . . . . 0.0 114.557 162.029 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.872 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -70.45 -19.32 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.586 2.342 0 CA-C-O 117.124 -1.417 . . . . 0.0 110.935 162.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.873 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 38.6 m-20 -73.65 -38.46 64.97 Favored 'General case' 0 CA--C 1.581 2.148 0 O-C-N 124.372 1.045 . . . . 0.0 110.908 167.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.82 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -50.78 -28.84 10.11 Favored 'General case' 0 CA--C 1.59 2.51 0 C-N-CA 125.285 1.434 . . . . 0.0 112.465 151.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.874 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.2 OUTLIER -88.94 -5.01 58.28 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 125.641 1.576 . . . . 0.0 114.981 168.131 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.962 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -77.6 -19.13 56.07 Favored 'General case' 0 CA--C 1.588 2.405 0 CA-C-O 124.683 2.182 . . . . 0.0 111.708 153.263 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.82 HD12 ' HA ' ' A' ' 16' ' ' ALA . 36.3 mt -76.08 -32.3 59.18 Favored 'General case' 0 CA--C 1.575 1.923 0 C-N-CA 129.073 2.949 . . . . 0.0 112.581 154.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.874 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -40.33 -40.73 1.22 Allowed 'General case' 0 N--CA 1.507 2.401 0 CA-C-O 124.563 2.125 . . . . 0.0 110.179 160.037 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.962 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -96.17 -53.99 3.45 Favored 'General case' 0 N--CA 1.502 2.132 0 C-N-CA 127.176 2.19 . . . . 0.0 112.527 -160.47 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.834 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 13.4 mt-30 -37.43 -81.25 0.01 OUTLIER 'General case' 0 CA--C 1.582 2.194 0 C-N-CA 124.345 1.058 . . . . 0.0 112.175 161.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t 13.97 98.82 0.02 OUTLIER Pre-proline 0 CA--C 1.581 2.17 0 C-N-CA 126.61 1.964 . . . . 0.0 114.96 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.462 ' HB3' HD22 ' A' ' 25' ' ' LEU . 88.1 Cg_exo -62.11 -142.34 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.586 0 C-N-CA 124.535 3.49 . . . . 0.0 115.124 -176.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.472 HD22 ' N ' ' A' ' 25' ' ' LEU . 1.5 mm? -83.96 24.6 0.9 Allowed 'General case' 0 CA--C 1.602 2.953 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 -156.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -37.83 -59.39 1.38 Allowed Glycine 0 CA--C 1.577 3.957 0 CA-C-N 114.12 -1.4 . . . . 0.0 113.737 174.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.59 0 O-C-N 121.148 -1.207 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 120.65 0.262 . . . . 0.0 111.303 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -125.71 -156.56 0.74 Allowed 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.003 -1.06 . . . . 0.0 113.048 -178.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.716 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 2.7 mt -49.44 -4.23 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 125.426 1.49 . . . . 0.0 114.76 173.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 1.055 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 1.4 mtpp 91.43 66.64 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 C-N-CA 125.382 1.473 . . . . 0.0 112.277 175.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.683 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -75.46 -28.86 59.44 Favored 'General case' 0 N--CA 1.504 2.256 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 159.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.477 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 2.7 m -68.42 7.31 0.63 Allowed 'General case' 0 CA--C 1.582 2.182 0 O-C-N 120.511 -1.368 . . . . 0.0 113.021 154.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 1.055 ' HB2' ' HB3' ' A' ' 4' ' ' LYS . 4.7 mt-10 -142.35 14.43 2.01 Favored 'General case' 0 N--CA 1.502 2.161 0 C-N-CA 126.694 1.998 . . . . 0.0 111.865 171.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.683 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 2.3 t80 -73.35 -29.3 62.57 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.93 -1.106 . . . . 0.0 113.028 170.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.55 -35.06 37.78 Favored Glycine 1 CA--C 1.584 4.385 0 CA-C-O 122.763 1.202 . . . . 0.0 111.925 170.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.601 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -49.05 -32.41 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 C-N-CA 125.306 1.442 . . . . 0.0 111.441 157.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.871 HG23 ' O ' ' A' ' 7' ' ' GLU . 28.6 t -76.55 -58.26 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 C-N-CA 124.839 1.256 . . . . 0.0 110.971 -176.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.42 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.2 mt -59.79 -28.4 67.4 Favored 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 125.274 1.43 . . . . 0.0 114.196 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.722 ' O ' HD13 ' A' ' 17' ' ' LEU . 1.0 OUTLIER -72.75 -27.53 62.08 Favored 'General case' 0 CA--C 1.582 2.179 0 O-C-N 120.378 -1.451 . . . . 0.0 114.664 163.596 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.871 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -70.62 -20.56 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.25 0 CA-C-O 117.487 -1.244 . . . . 0.0 111.164 161.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.871 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 5.5 m-20 -74.96 -38.66 61.64 Favored 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 124.448 1.099 . . . . 0.0 111.398 171.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.741 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -52.41 -27.98 18.02 Favored 'General case' 0 CA--C 1.59 2.507 0 C-N-CA 124.902 1.281 . . . . 0.0 112.403 152.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.835 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.71 -6.57 58.8 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 125.941 1.696 . . . . 0.0 114.623 167.413 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.915 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -77.39 -19.03 56.79 Favored 'General case' 0 CA--C 1.586 2.355 0 CA-C-O 124.445 2.069 . . . . 0.0 111.863 153.467 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.741 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 37.9 mt -77.2 -30.95 54.98 Favored 'General case' 0 CA--C 1.575 1.909 0 C-N-CA 128.721 2.808 . . . . 0.0 112.629 154.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.835 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -40.91 -39.31 1.12 Allowed 'General case' 0 CA--C 1.59 2.49 0 CA-C-O 124.783 2.23 . . . . 0.0 109.861 159.822 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.915 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 1.3 mmt180 -94.82 -54.41 3.49 Favored 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 127.603 2.361 . . . . 0.0 112.498 -163.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 28.3 mt-30 -42.14 -83.39 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.163 0 C-N-CA 124.37 1.068 . . . . 0.0 112.131 164.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.3 t -30.83 111.95 0.3 Allowed Pre-proline 0 CA--C 1.58 2.134 0 C-N-CA 125.694 1.598 . . . . 0.0 114.265 -172.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.564 ' C ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -1.41 61.3 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.231 1 C-N-CA 128.006 5.804 . . . . 0.0 117.857 177.812 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.709 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER 23.82 -161.43 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 127.051 2.14 . . . . 0.0 115.43 -166.739 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.08 107.53 3.26 Favored Glycine 0 CA--C 1.575 3.84 0 O-C-N 120.243 -1.536 . . . . 0.0 114.179 171.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.59 0 O-C-N 121.006 -1.29 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.484 ' HG2' ' N ' ' A' ' 2' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.0 0 CA-C-O 120.675 0.274 . . . . 0.0 111.342 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.484 ' N ' ' HG2' ' A' ' 1' ' ' MET . 5.5 mm-40 -120.2 61.26 0.86 Allowed 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.962 -1.087 . . . . 0.0 112.723 159.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.607 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 1.1 mt -62.76 21.18 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.394 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 -178.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 1.094 ' CB ' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 84.31 97.18 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 119.754 -1.841 . . . . 0.0 112.502 167.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.75 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -88.39 -29.77 20.0 Favored 'General case' 0 N--CA 1.506 2.344 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 160.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.504 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 15.3 m -69.17 7.95 0.66 Allowed 'General case' 0 CA--C 1.582 2.174 0 O-C-N 120.475 -1.391 . . . . 0.0 112.98 154.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 1.094 ' HB2' ' CB ' ' A' ' 4' ' ' LYS . 7.5 mt-10 -147.59 12.61 1.03 Allowed 'General case' 0 N--CA 1.501 2.109 0 C-N-CA 126.46 1.904 . . . . 0.0 111.874 174.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.75 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 13.8 t80 -73.68 -26.82 60.91 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.933 -1.104 . . . . 0.0 113.219 177.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.09 -34.62 32.82 Favored Glycine 1 CA--C 1.582 4.249 0 CA-C-O 122.303 0.946 . . . . 0.0 112.504 165.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.617 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.0 t -51.74 -31.63 13.28 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 O-C-N 120.884 -1.362 . . . . 0.0 111.422 158.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 7' ' ' GLU . 41.5 t -77.09 -63.89 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 C-N-CA 125.152 1.381 . . . . 0.0 110.846 -176.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 15' ' ' ASP . 5.2 mt -70.18 -29.94 66.94 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 123.51 1.624 . . . . 0.0 113.601 -175.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.416 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 3.6 m -73.19 -24.77 60.58 Favored 'General case' 0 CA--C 1.581 2.153 0 O-C-N 119.739 -1.851 . . . . 0.0 114.422 162.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.934 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.37 -30.39 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.239 0 O-C-N 121.794 -0.566 . . . . 0.0 110.283 160.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.9 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 20.5 m-20 -69.95 -35.34 74.43 Favored 'General case' 0 CA--C 1.581 2.17 0 C-N-CA 124.291 1.037 . . . . 0.0 111.55 176.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.755 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -52.03 -28.49 17.36 Favored 'General case' 0 CA--C 1.585 2.3 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 156.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.07 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 26.7 mt -88.16 -8.81 54.83 Favored 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 163.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.934 ' HE3' HG12 ' A' ' 14' ' ' VAL . 0.0 OUTLIER -71.0 -18.47 62.6 Favored 'General case' 0 N--CA 1.508 2.452 0 CA-C-O 124.894 2.283 . . . . 0.0 111.268 154.654 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.755 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 42.9 mt -76.46 -41.34 47.67 Favored 'General case' 0 CA--C 1.575 1.932 0 C-N-CA 129.498 3.119 . . . . 0.0 113.124 154.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.07 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.86 -40.67 0.47 Allowed 'General case' 0 CA--C 1.59 2.498 0 CA-C-O 125.315 2.483 . . . . 0.0 109.343 158.786 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.512 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -84.18 -45.23 13.16 Favored 'General case' 0 CA--C 1.579 2.079 0 C-N-CA 128.032 2.533 . . . . 0.0 112.508 -168.532 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.44 ' N ' ' HG3' ' A' ' 21' ' ' ARG . 1.6 mt-30 -54.32 -80.09 0.02 OUTLIER 'General case' 0 CA--C 1.581 2.137 0 C-N-CA 125.548 1.539 . . . . 0.0 112.414 166.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.9 t -26.07 93.31 0.05 OUTLIER Pre-proline 0 CA--C 1.581 2.137 0 C-N-CA 125.28 1.432 . . . . 0.0 113.449 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.66 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -6.72 61.76 0.0 OUTLIER 'Trans proline' 0 CA--C 1.57 2.303 1 C-N-CA 127.764 5.643 . . . . 0.0 118.207 -175.721 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.683 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER 26.4 -157.47 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 C-N-CA 127.977 2.511 . . . . 0.0 116.57 173.749 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.8 -131.23 3.05 Favored Glycine 0 CA--C 1.576 3.847 0 O-C-N 119.961 -1.712 . . . . 0.0 114.056 165.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.624 0 O-C-N 121.014 -1.286 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.018 0 CA-C-O 120.844 0.354 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -11.84 61.17 Favored 'General case' 0 N--CA 1.501 2.093 0 C-N-CA 124.196 0.998 . . . . 0.0 112.72 -172.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 57.41 14.33 2.16 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 124.453 1.101 . . . . 0.0 113.621 -164.48 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.851 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 39.98 67.34 0.49 Allowed 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 124.863 1.265 . . . . 0.0 113.732 163.352 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.726 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -82.13 -30.94 30.84 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 161.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 33.3 t -68.87 6.66 0.83 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 120.324 -1.485 . . . . 0.0 113.316 155.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.914 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.6 mt-10 -144.25 16.5 1.7 Allowed 'General case' 0 N--CA 1.502 2.161 0 C-N-CA 126.131 1.772 . . . . 0.0 111.829 172.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.726 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 2.0 t80 -73.28 -27.5 61.6 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.811 -1.181 . . . . 0.0 113.205 177.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.79 -38.03 28.46 Favored Glycine 1 CA--C 1.582 4.257 0 CA-C-O 122.71 1.172 . . . . 0.0 112.371 166.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 7' ' ' GLU . 1.9 t -48.31 -31.09 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.198 0 O-C-N 120.732 -1.452 . . . . 0.0 111.298 158.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 7' ' ' GLU . 42.3 t -77.07 -66.08 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 C-N-CA 125.08 1.352 . . . . 0.0 110.915 -178.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.447 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.4 mt -66.26 -28.47 68.74 Favored 'General case' 0 N--CA 1.503 2.206 0 CA-C-O 122.759 1.266 . . . . 0.0 113.588 -173.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.733 ' O ' HD13 ' A' ' 17' ' ' LEU . 19.2 m -72.67 -24.97 61.1 Favored 'General case' 0 CA--C 1.582 2.174 0 O-C-N 120.334 -1.479 . . . . 0.0 114.366 162.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.785 ' HA ' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t -72.39 -20.2 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.263 0 CA-C-O 117.38 -1.295 . . . . 0.0 111.088 161.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.739 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.5 m-20 -74.92 -38.74 61.72 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 124.316 1.01 . . . . 0.0 111.363 170.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.738 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -51.78 -27.3 11.76 Favored 'General case' 0 CA--C 1.59 2.512 0 C-N-CA 125.072 1.349 . . . . 0.0 112.528 151.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.874 ' CA ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -87.86 -7.64 56.94 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 125.836 1.654 . . . . 0.0 114.814 167.007 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.972 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -76.09 -17.77 59.47 Favored 'General case' 0 CA--C 1.588 2.417 0 O-C-N 118.88 -2.387 . . . . 0.0 111.739 153.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.738 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 37.8 mt -78.43 -33.89 48.29 Favored 'General case' 0 CA--C 1.575 1.908 0 C-N-CA 129.102 2.961 . . . . 0.0 112.744 154.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.874 ' HB2' ' CA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -39.72 -38.62 0.66 Allowed 'General case' 0 CA--C 1.591 2.54 0 CA-C-O 125.643 2.64 . . . . 0.0 109.591 158.645 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -99.5 -44.69 6.07 Favored 'General case' 0 CA--C 1.58 2.12 0 C-N-CA 128.731 2.812 . . . . 0.0 112.206 -156.799 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -58.92 -92.83 0.0 OUTLIER 'General case' 0 CA--C 1.578 2.046 0 C-N-CA 126.073 1.749 . . . . 0.0 112.539 177.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -31.73 94.74 0.07 OUTLIER Pre-proline 0 CA--C 1.581 2.166 0 C-N-CA 125.976 1.71 . . . . 0.0 114.665 -159.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -7.16 69.39 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.268 1 C-N-CA 127.464 5.443 . . . . 0.0 117.442 174.378 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.446 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 2.3 mp 48.82 126.85 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 155.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.07 -147.35 0.65 Allowed Glycine 0 CA--C 1.575 3.841 0 O-C-N 119.188 -2.195 . . . . 0.0 114.114 -164.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.578 0 O-C-N 120.937 -1.331 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.035 0 CA-C-O 120.861 0.362 . . . . 0.0 111.302 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 68.27 46.1 1.14 Allowed 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 124.283 1.033 . . . . 0.0 112.891 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 70.57 -2.33 2.25 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.967 -1.083 . . . . 0.0 113.493 168.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.573 ' HG2' ' OE1' ' A' ' 7' ' ' GLU . 2.7 mtpp 40.15 72.05 0.16 Allowed 'General case' 0 N--CA 1.504 2.254 0 C-N-CA 124.847 1.259 . . . . 0.0 113.663 169.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.56 -26.52 14.77 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 157.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.4 m -66.52 7.34 0.34 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.875 -1.141 . . . . 0.0 112.402 154.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.622 ' HA ' HG23 ' A' ' 10' ' ' VAL . 13.0 mt-10 -145.5 2.12 0.95 Allowed 'General case' 0 N--CA 1.501 2.125 0 C-N-CA 125.633 1.573 . . . . 0.0 113.105 168.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.528 ' CE1' HD21 ' A' ' 12' ' ' LEU . 3.2 t80 -73.33 -34.82 65.86 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.701 -1.249 . . . . 0.0 113.398 157.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.07 -41.82 98.36 Favored Glycine 1 CA--C 1.585 4.458 0 CA-C-O 122.414 1.008 . . . . 0.0 112.322 172.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.5 t -42.26 -37.67 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.25 0 C-N-CA 125.2 1.4 . . . . 0.0 111.243 159.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 7' ' ' GLU . 16.2 t -76.82 -50.39 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 C-N-CA 125.439 1.496 . . . . 0.0 110.737 -172.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.528 HD21 ' CE1' ' A' ' 8' ' ' PHE . 3.8 mt -70.07 -19.71 63.26 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 120.408 -1.432 . . . . 0.0 113.081 -175.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.748 ' O ' HD13 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -73.21 -30.04 63.23 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 162.601 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.782 ' HA ' HD22 ' A' ' 17' ' ' LEU . 2.1 t -67.43 -26.76 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.322 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.619 162.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.799 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 59.4 m-20 -70.39 -37.96 74.59 Favored 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 124.291 1.036 . . . . 0.0 111.553 169.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.744 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -53.5 -26.8 22.3 Favored 'General case' 0 CA--C 1.588 2.438 0 CA-C-O 122.847 1.308 . . . . 0.0 112.496 153.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.871 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.0 OUTLIER -88.02 -6.67 57.85 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 126.883 2.073 . . . . 0.0 114.654 167.634 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.964 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -79.24 -20.32 48.49 Favored 'General case' 0 CA--C 1.584 2.264 0 O-C-N 119.552 -1.967 . . . . 0.0 112.014 154.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.744 HD12 ' HA ' ' A' ' 16' ' ' ALA . 28.8 mt -77.33 -29.38 53.48 Favored 'General case' 0 N--CA 1.498 1.975 0 C-N-CA 128.632 2.773 . . . . 0.0 112.681 155.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.871 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.17 -37.97 0.19 Allowed 'General case' 0 CA--C 1.59 2.487 0 CA-C-O 125.289 2.471 . . . . 0.0 109.65 157.597 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.85 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -102.58 -55.82 2.37 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 128.014 2.525 . . . . 0.0 112.359 -158.266 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.68 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 3.6 mt-30 -47.61 -37.45 12.6 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 125.383 1.473 . . . . 0.0 112.844 176.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.6 t 35.52 79.69 0.29 Allowed Pre-proline 0 CA--C 1.582 2.199 0 CA-C-O 117.556 -1.211 . . . . 0.0 113.948 177.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -7.32 70.94 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.268 1 C-N-CA 127.409 5.406 . . . . 0.0 117.52 175.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.724 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -28.0 149.75 0.0 OUTLIER 'General case' 0 CA--C 1.577 2.019 0 C-N-CA 124.808 1.243 . . . . 0.0 113.676 168.843 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 82.57 101.6 0.47 Allowed Glycine 0 CA--C 1.575 3.803 0 O-C-N 120.956 -1.09 . . . . 0.0 113.936 170.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.581 0 O-C-N 120.98 -1.306 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.501 ' O ' ' HB2' ' A' ' 2' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.577 2.0 0 CA-C-O 120.705 0.288 . . . . 0.0 111.277 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.513 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 14.2 mt-10 75.23 85.94 0.09 Allowed 'General case' 0 N--CA 1.501 2.116 0 C-N-CA 124.155 0.982 . . . . 0.0 112.87 -171.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.513 ' HB2' ' O ' ' A' ' 2' ' ' GLU . 0.1 OUTLIER 152.14 -79.01 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 126.34 1.856 . . . . 0.0 113.0 -168.166 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 25.05 50.4 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 125.747 1.619 . . . . 0.0 114.4 -177.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.822 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -82.53 -31.53 29.11 Favored 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 159.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.54 9.53 0.34 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.256 -1.528 . . . . 0.0 113.035 155.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.915 ' O ' HG23 ' A' ' 11' ' ' VAL . 13.0 mt-10 -142.93 12.67 1.85 Allowed 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 125.953 1.701 . . . . 0.0 112.098 167.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.822 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.7 OUTLIER -72.36 -25.3 61.48 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 124.107 0.963 . . . . 0.0 113.166 170.788 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.09 -36.25 25.15 Favored Glycine 1 CA--C 1.581 4.206 0 CA-C-O 122.212 0.895 . . . . 0.0 112.444 166.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.614 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.5 t -51.13 -29.39 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 O-C-N 120.827 -1.396 . . . . 0.0 111.712 157.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.915 HG23 ' O ' ' A' ' 7' ' ' GLU . 45.4 t -76.16 -64.47 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 C-N-CA 125.056 1.342 . . . . 0.0 110.93 -178.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.41 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.4 mt -70.29 -29.4 66.15 Favored 'General case' 0 N--CA 1.502 2.152 0 CA-C-O 122.934 1.35 . . . . 0.0 113.515 -174.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.7 m -73.0 -26.48 61.34 Favored 'General case' 0 CA--C 1.58 2.134 0 O-C-N 120.338 -1.476 . . . . 0.0 114.538 162.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.613 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -65.19 -30.16 49.46 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.259 0 O-C-N 121.759 -0.588 . . . . 0.0 110.192 160.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.731 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 56.0 m-20 -71.91 -35.8 69.79 Favored 'General case' 0 CA--C 1.582 2.174 0 C-N-CA 124.589 1.155 . . . . 0.0 111.548 177.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.775 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.17 -28.4 18.03 Favored 'General case' 0 CA--C 1.585 2.296 0 C-N-CA 124.765 1.226 . . . . 0.0 113.823 155.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.006 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 27.7 mt -86.27 -11.29 52.7 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 116.384 1.994 . . . . 0.0 116.384 163.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 1.004 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.08 -14.95 62.49 Favored 'General case' 0 N--CA 1.508 2.473 0 CA-C-O 124.317 2.008 . . . . 0.0 111.606 154.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.775 HD12 ' HA ' ' A' ' 16' ' ' ALA . 36.9 mt -81.15 -39.06 26.12 Favored 'General case' 0 CA--C 1.574 1.9 0 C-N-CA 128.857 2.863 . . . . 0.0 113.079 154.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.006 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -37.02 -39.91 0.26 Allowed 'General case' 0 CA--C 1.59 2.496 0 CA-C-O 124.806 2.241 . . . . 0.0 109.261 161.022 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.788 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -83.23 -48.32 10.6 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 127.327 2.251 . . . . 0.0 112.349 179.908 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.85 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 15.7 mt-30 -74.34 -95.42 0.02 OUTLIER 'General case' 0 CA--C 1.576 1.98 0 C-N-CA 126.069 1.748 . . . . 0.0 113.154 168.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.4 p 4.25 110.18 0.0 OUTLIER Pre-proline 0 CA--C 1.581 2.156 0 C-N-CA 128.114 2.566 . . . . 0.0 115.545 -167.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -59.34 -143.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.577 2.66 0 C-N-CA 124.927 3.751 . . . . 0.0 115.076 174.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.678 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -80.18 156.07 27.11 Favored 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 125.303 1.441 . . . . 0.0 114.279 -156.641 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 43.42 78.58 0.07 OUTLIER Glycine 0 CA--C 1.575 3.831 0 O-C-N 120.821 -1.174 . . . . 0.0 113.884 -171.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.603 0 O-C-N 121.019 -1.283 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.012 0 CA-C-O 120.8 0.333 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -117.83 41.75 2.8 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.035 -1.04 . . . . 0.0 112.828 171.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -47.34 -59.45 3.19 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.039 -1.038 . . . . 0.0 112.881 -168.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -54.76 -19.8 7.1 Favored 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 176.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.802 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -74.81 -30.16 61.32 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 119.877 -1.765 . . . . 0.0 113.789 159.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 t -68.89 13.2 0.11 Allowed 'General case' 0 CA--C 1.584 2.264 0 O-C-N 120.93 -1.106 . . . . 0.0 112.747 153.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.906 ' O ' HG23 ' A' ' 11' ' ' VAL . 4.8 mt-10 -136.64 1.32 2.56 Favored 'General case' 0 N--CA 1.502 2.154 0 C-N-CA 126.187 1.795 . . . . 0.0 112.586 164.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.802 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 2.4 t80 -73.2 -24.42 60.52 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 124.416 1.086 . . . . 0.0 113.087 175.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.43 -35.48 22.99 Favored Glycine 1 CA--C 1.579 4.046 0 O-C-N 121.513 -0.742 . . . . 0.0 113.057 165.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.573 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -49.81 -30.94 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 O-C-N 120.851 -1.382 . . . . 0.0 111.197 157.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 7' ' ' GLU . 40.7 t -77.07 -67.18 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 C-N-CA 125.25 1.42 . . . . 0.0 110.924 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.1 mt -70.18 -27.69 64.72 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-O 123.227 1.489 . . . . 0.0 113.344 -174.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.722 ' O ' HD13 ' A' ' 17' ' ' LEU . 3.8 m -72.94 -24.16 60.77 Favored 'General case' 0 CA--C 1.581 2.136 0 O-C-N 120.169 -1.582 . . . . 0.0 114.401 161.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.999 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -70.56 -23.59 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.276 0 CA-C-O 117.233 -1.365 . . . . 0.0 110.868 160.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.914 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.2 m-20 -72.92 -39.62 66.13 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 124.485 1.116 . . . . 0.0 111.535 172.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.798 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.66 -27.94 19.47 Favored 'General case' 0 CA--C 1.59 2.5 0 C-N-CA 124.781 1.232 . . . . 0.0 112.454 152.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.898 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.19 -6.08 59.06 Favored 'General case' 0 N--CA 1.5 2.072 0 C-N-CA 125.719 1.608 . . . . 0.0 115.151 166.275 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.999 ' HE3' HG12 ' A' ' 14' ' ' VAL . 0.1 OUTLIER -77.12 -17.45 58.64 Favored 'General case' 0 CA--C 1.588 2.407 0 CA-C-O 124.519 2.104 . . . . 0.0 111.819 152.661 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' A' ' 16' ' ' ALA . 38.4 mt -78.38 -32.02 48.68 Favored 'General case' 0 CA--C 1.574 1.894 0 C-N-CA 128.692 2.797 . . . . 0.0 112.593 154.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.898 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -41.01 -39.87 1.29 Allowed 'General case' 0 CA--C 1.59 2.481 0 CA-C-O 124.7 2.19 . . . . 0.0 109.957 160.499 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.902 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -94.52 -55.44 3.15 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 127.466 2.307 . . . . 0.0 112.557 -164.107 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.697 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 3.5 mt-30 -42.33 -86.95 0.0 OUTLIER 'General case' 0 CA--C 1.578 2.053 0 CA-C-O 123.342 1.544 . . . . 0.0 112.394 165.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.18 159.54 21.27 Favored Pre-proline 0 CA--C 1.587 2.369 0 C-N-CA 126.1 1.76 . . . . 0.0 115.356 -178.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -71.67 48.71 1.08 Allowed 'Trans proline' 0 CA--C 1.575 2.537 1 C-N-CA 126.187 4.591 . . . . 0.0 118.323 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.59 HD11 ' HB3' ' A' ' 19' ' ' LEU . 2.1 mp 54.91 -169.4 0.07 Allowed 'General case' 0 N--CA 1.505 2.313 0 O-C-N 119.247 -2.158 . . . . 0.0 114.33 155.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.67 -141.08 34.38 Favored Glycine 0 CA--C 1.575 3.793 0 O-C-N 120.734 -1.229 . . . . 0.0 114.166 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.587 0 O-C-N 120.901 -1.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 120.58 0.229 . . . . 0.0 111.218 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.618 ' O ' ' HG2' ' A' ' 2' ' ' GLU . 1.5 pm0 -158.6 108.77 2.05 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.02 -1.05 . . . . 0.0 113.177 -176.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.703 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -41.19 -39.54 1.34 Allowed 'General case' 0 N--CA 1.504 2.234 0 C-N-CA 125.104 1.362 . . . . 0.0 114.284 179.27 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.775 ' HG2' ' OE2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 85.76 45.85 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 125.813 1.645 . . . . 0.0 113.064 -156.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.793 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -77.19 -30.07 54.64 Favored 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 157.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.0 t -68.5 11.93 0.15 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.325 -1.484 . . . . 0.0 113.02 155.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.921 ' O ' HG23 ' A' ' 11' ' ' VAL . 9.9 mt-10 -142.17 10.16 1.91 Allowed 'General case' 0 N--CA 1.503 2.212 0 C-N-CA 125.847 1.659 . . . . 0.0 112.187 164.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.793 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.5 OUTLIER -72.97 -25.95 61.19 Favored 'General case' 0 N--CA 1.503 2.205 0 C-N-CA 124.221 1.008 . . . . 0.0 113.25 170.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.511 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -78.25 -35.94 32.41 Favored Glycine 1 CA--C 1.582 4.279 0 CA-C-O 122.484 1.047 . . . . 0.0 112.439 166.621 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.611 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -51.99 -31.12 13.48 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 120.904 -1.35 . . . . 0.0 111.93 158.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.921 HG23 ' O ' ' A' ' 7' ' ' GLU . 41.6 t -75.9 -62.64 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 C-N-CA 125.103 1.361 . . . . 0.0 111.061 -177.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.43 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.5 mt -70.6 -27.2 63.91 Favored 'General case' 0 N--CA 1.502 2.161 0 CA-C-O 122.801 1.286 . . . . 0.0 113.493 -174.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.4 t -73.39 -30.44 63.27 Favored 'General case' 0 CA--C 1.579 2.073 0 O-C-N 120.507 -1.371 . . . . 0.0 114.643 162.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.976 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -61.16 -32.11 51.94 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.29 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 161.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.888 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 29.5 m-20 -71.57 -31.73 67.3 Favored 'General case' 0 CA--C 1.582 2.21 0 C-N-CA 125.007 1.323 . . . . 0.0 111.101 174.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.933 ' HA ' HD23 ' A' ' 19' ' ' LEU . . . -57.08 -25.7 59.17 Favored 'General case' 0 CA--C 1.581 2.16 0 C-N-CA 124.67 1.188 . . . . 0.0 113.59 156.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.053 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 23.9 mt -91.36 -4.68 55.51 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 117.363 2.357 . . . . 0.0 117.363 163.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.976 ' HE3' HG12 ' A' ' 14' ' ' VAL . 0.0 OUTLIER -75.34 -26.88 58.94 Favored 'General case' 0 CA--C 1.587 2.39 0 CA-C-O 124.674 2.178 . . . . 0.0 111.418 154.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.933 HD23 ' HA ' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -80.22 -18.11 50.45 Favored 'General case' 0 CA--C 1.586 2.357 0 C-N-CA 129.691 3.196 . . . . 0.0 112.595 157.722 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.053 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -52.36 -43.31 64.59 Favored 'General case' 0 CA--C 1.592 2.565 0 CA-C-O 125.425 2.536 . . . . 0.0 109.651 156.322 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.757 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -80.11 -60.16 2.44 Favored 'General case' 0 CA--C 1.58 2.108 0 C-N-CA 128.101 2.561 . . . . 0.0 112.0 -168.422 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 4.8 mt-30 -45.03 -86.28 0.0 OUTLIER 'General case' 0 CA--C 1.577 2.007 0 CA-C-N 114.204 -1.362 . . . . 0.0 112.441 168.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -37.83 104.83 0.3 Allowed Pre-proline 0 N--CA 1.502 2.128 0 C-N-CA 125.555 1.542 . . . . 0.0 114.096 -170.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -7.45 73.03 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.249 1 C-N-CA 127.322 5.348 . . . . 0.0 117.165 174.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.725 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -24.06 133.09 0.02 OUTLIER 'General case' 0 CA--C 1.577 1.982 0 C-N-CA 124.684 1.194 . . . . 0.0 113.465 165.228 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.75 94.17 0.07 OUTLIER Glycine 0 CA--C 1.575 3.801 0 O-C-N 121.141 -0.974 . . . . 0.0 113.911 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.613 0 O-C-N 120.955 -1.321 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 ttt . . . . . 0 N--CA 1.499 2.017 0 N-CA-C 111.1 0.037 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.413 ' O ' ' HD3' ' A' ' 4' ' ' LYS . 2.0 mt-10 72.19 140.67 0.06 Allowed 'General case' 0 N--CA 1.503 2.221 0 O-C-N 120.656 -1.277 . . . . 0.0 113.095 175.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.61 -6.82 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 124.958 1.303 . . . . 0.0 114.181 166.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.768 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 75.61 82.42 0.1 Allowed 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.078 -1.639 . . . . 0.0 112.955 164.751 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.884 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -94.03 -31.22 14.32 Favored 'General case' 0 N--CA 1.505 2.31 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 157.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.728 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 1.3 t -67.92 7.05 0.58 Allowed 'General case' 0 N--CA 1.503 2.217 0 O-C-N 120.399 -1.438 . . . . 0.0 112.985 155.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.905 ' O ' HG23 ' A' ' 11' ' ' VAL . 5.4 mt-10 -148.43 15.55 1.01 Allowed 'General case' 0 N--CA 1.501 2.1 0 C-N-CA 125.994 1.718 . . . . 0.0 111.987 167.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.884 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 1.7 t80 -73.06 -23.77 60.61 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.111 -0.993 . . . . 0.0 113.144 164.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.21 -38.62 25.37 Favored Glycine 1 CA--C 1.581 4.192 0 O-C-N 121.357 -0.839 . . . . 0.0 112.799 163.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.672 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.5 t -50.03 -29.47 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.334 0 O-C-N 120.852 -1.381 . . . . 0.0 111.742 158.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.905 HG23 ' O ' ' A' ' 7' ' ' GLU . 42.0 t -76.09 -68.32 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 C-N-CA 125.035 1.334 . . . . 0.0 111.26 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.9 mt -68.65 -27.27 65.85 Favored 'General case' 0 N--CA 1.503 2.218 0 CA-C-O 123.642 1.687 . . . . 0.0 113.432 -173.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.777 ' O ' HD13 ' A' ' 17' ' ' LEU . 2.5 m -72.48 -25.0 61.26 Favored 'General case' 0 CA--C 1.581 2.144 0 O-C-N 119.902 -1.749 . . . . 0.0 114.192 161.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.845 ' HA ' HD22 ' A' ' 17' ' ' LEU . 2.1 t -71.99 -20.22 20.24 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.3 0 CA-C-O 117.132 -1.413 . . . . 0.0 111.203 161.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.834 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 58.1 m-20 -74.05 -39.76 63.28 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 124.423 1.077 . . . . 0.0 111.547 170.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.776 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -53.26 -25.4 14.33 Favored 'General case' 0 CA--C 1.59 2.507 0 C-N-CA 125.18 1.392 . . . . 0.0 113.059 152.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.992 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.1 OUTLIER -86.5 -10.34 54.31 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 164.559 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.914 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.52 -13.78 60.72 Favored 'General case' 0 CA--C 1.587 2.391 0 O-C-N 119.461 -2.024 . . . . 0.0 111.695 154.299 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.869 ' O ' ' HG3' ' A' ' 22' ' ' GLN . 33.2 mt -84.27 -33.95 23.9 Favored 'General case' 0 CA--C 1.573 1.858 0 C-N-CA 129.519 3.128 . . . . 0.0 112.922 154.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.992 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -41.38 -38.97 1.33 Allowed 'General case' 0 CA--C 1.602 2.954 0 CA-C-O 126.762 3.172 . . . . 0.0 108.075 156.624 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.658 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -95.56 -35.19 11.74 Favored 'General case' 0 CA--C 1.588 2.408 1 C-N-CA 134.502 5.121 . . . . 0.0 110.898 -177.447 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.869 ' HG3' ' O ' ' A' ' 19' ' ' LEU . 51.6 mt-30 31.31 105.02 0.0 OUTLIER 'General case' 0 CA--C 1.573 1.842 0 C-N-CA 129.466 3.106 . . . . 0.0 112.917 -155.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 16.15 97.21 0.03 OUTLIER Pre-proline 0 CA--C 1.582 2.178 0 C-N-CA 128.302 2.641 . . . . 0.0 115.638 164.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.606 ' HD3' ' HD2' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -9.66 75.25 0.0 OUTLIER 'Trans proline' 0 CA--C 1.57 2.278 1 C-N-CA 127.557 5.505 . . . . 0.0 116.78 172.0 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.729 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -11.28 125.17 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 C-N-CA 126.174 1.789 . . . . 0.0 114.344 165.372 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -58.95 -94.55 0.01 OUTLIER Glycine 0 CA--C 1.576 3.851 0 O-C-N 120.953 -1.092 . . . . 0.0 113.857 -166.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.529 0 O-C-N 121.098 -1.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 119.462 -0.304 . . . . 0.0 110.997 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -155.87 46.69 0.48 Allowed 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.266 -1.521 . . . . 0.0 113.253 171.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mt -42.6 -66.05 0.4 Allowed 'General case' 0 N--CA 1.503 2.222 0 O-C-N 120.515 -1.365 . . . . 0.0 112.79 159.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 1.24 ' CB ' ' HB2' ' A' ' 7' ' ' GLU . 0.7 OUTLIER 60.93 150.36 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 125.015 1.326 . . . . 0.0 113.177 177.949 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.637 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -92.38 -30.77 15.62 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.575 -1.328 . . . . 0.0 114.12 162.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.514 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 7.1 m -68.99 10.52 0.28 Allowed 'General case' 0 CA--C 1.585 2.322 0 O-C-N 120.419 -1.425 . . . . 0.0 112.543 151.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 1.24 ' HB2' ' CB ' ' A' ' 4' ' ' LYS . 4.9 mt-10 -147.87 9.87 0.9 Allowed 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 127.57 2.348 . . . . 0.0 111.867 176.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.637 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 9.5 t80 -72.65 -30.58 64.41 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.26 1.024 . . . . 0.0 112.819 169.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.34 -23.54 58.52 Favored Glycine 1 CA--C 1.583 4.296 0 CA-C-O 122.139 0.855 . . . . 0.0 112.237 170.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.7 t -60.83 -29.77 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.188 0 C-N-CA 125.073 1.349 . . . . 0.0 111.444 156.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.87 HG23 ' O ' ' A' ' 7' ' ' GLU . 21.8 t -76.67 -47.87 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 CA-C-O 123.39 1.567 . . . . 0.0 110.781 -177.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.7 mt -69.01 -24.72 64.24 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 119.979 -1.701 . . . . 0.0 113.228 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 10.7 m -73.04 -24.85 60.76 Favored 'General case' 0 CA--C 1.58 2.116 0 O-C-N 120.121 -1.612 . . . . 0.0 114.558 162.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.498 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.42 -33.41 63.27 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.266 0 O-C-N 121.658 -0.651 . . . . 0.0 110.202 160.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.797 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 0.7 OUTLIER -65.81 -36.93 84.89 Favored 'General case' 0 CA--C 1.58 2.126 0 C-N-CA 124.488 1.115 . . . . 0.0 112.073 174.221 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.777 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.37 -28.14 18.38 Favored 'General case' 0 CA--C 1.586 2.338 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 157.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.093 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 26.9 mt -87.79 -8.41 55.99 Favored 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 163.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.93 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -71.16 -18.84 62.48 Favored 'General case' 0 N--CA 1.509 2.51 0 CA-C-O 124.814 2.245 . . . . 0.0 111.241 154.764 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.777 HD12 ' HA ' ' A' ' 16' ' ' ALA . 42.3 mt -76.13 -41.68 49.32 Favored 'General case' 0 CA--C 1.574 1.89 0 C-N-CA 129.502 3.121 . . . . 0.0 113.099 154.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.093 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.94 -41.47 0.55 Allowed 'General case' 0 N--CA 1.51 2.557 0 CA-C-O 125.399 2.523 . . . . 0.0 109.043 158.589 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.539 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -78.54 -42.02 30.56 Favored 'General case' 0 CA--C 1.58 2.114 0 C-N-CA 128.22 2.608 . . . . 0.0 112.194 -173.068 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 5.2 mt-30 -73.75 -88.12 0.03 OUTLIER 'General case' 0 CA--C 1.578 2.047 0 C-N-CA 125.928 1.691 . . . . 0.0 112.526 165.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -30.47 110.86 0.28 Allowed Pre-proline 0 CA--C 1.582 2.21 0 C-N-CA 125.822 1.649 . . . . 0.0 114.32 -177.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.903 ' C ' HD22 ' A' ' 25' ' ' LEU . 52.5 Cg_exo -70.75 29.57 0.21 Allowed 'Trans proline' 0 CA--C 1.573 2.474 1 C-N-CA 125.83 4.353 . . . . 0.0 117.806 179.084 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.903 HD22 ' C ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER 31.28 -176.7 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 126.444 1.898 . . . . 0.0 115.141 -162.922 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 29.58 -95.4 0.01 OUTLIER Glycine 0 CA--C 1.575 3.831 0 O-C-N 120.307 -1.496 . . . . 0.0 114.011 -157.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.608 0 O-C-N 121.008 -1.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 2.019 0 CA-C-O 120.907 0.384 . . . . 0.0 111.345 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.457 ' HG2' HD13 ' A' ' 3' ' ' LEU . 0.7 OUTLIER -121.19 -127.16 0.27 Allowed 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.139 -0.976 . . . . 0.0 112.48 -162.243 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.457 HD13 ' HG2' ' A' ' 2' ' ' GLU . 1.1 mp 42.36 48.42 4.4 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 120.538 -1.352 . . . . 0.0 113.164 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 5' ' ' ALA . 4.9 mtpt 57.99 -163.34 0.2 Allowed 'General case' 0 N--CA 1.501 2.122 0 CA-C-O 122.609 1.195 . . . . 0.0 113.074 -177.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.496 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . 61.25 -9.41 0.07 Allowed 'General case' 0 N--CA 1.529 3.501 0 C-N-CA 127.93 2.492 . . . . 0.0 113.66 -158.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.5 m -70.35 -4.84 24.18 Favored 'General case' 0 CA--C 1.584 2.287 0 CA-C-O 122.846 1.308 . . . . 0.0 112.468 153.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.872 ' O ' HG23 ' A' ' 11' ' ' VAL . 10.1 mt-10 -146.25 9.52 1.1 Allowed 'General case' 0 CA--C 1.58 2.129 0 C-N-CA 129.44 3.096 . . . . 0.0 111.114 -164.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.496 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 5.4 t80 -71.47 -28.76 64.17 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.289 -1.507 . . . . 0.0 112.739 178.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -81.99 -27.42 45.55 Favored Glycine 1 CA--C 1.582 4.223 0 CA-C-O 122.188 0.882 . . . . 0.0 112.323 169.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.0 t -55.46 -31.08 27.08 Favored 'Isoleucine or valine' 0 CA--C 1.582 2.188 0 O-C-N 120.945 -1.326 . . . . 0.0 110.846 156.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.872 HG23 ' O ' ' A' ' 7' ' ' GLU . 22.4 t -77.2 -53.57 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 C-N-CA 125.504 1.521 . . . . 0.0 111.114 -177.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.447 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.2 mt -67.99 -26.77 66.07 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.223 -1.548 . . . . 0.0 113.412 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.7 m -72.67 -25.43 61.26 Favored 'General case' 0 CA--C 1.581 2.141 0 O-C-N 120.143 -1.598 . . . . 0.0 114.707 162.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.481 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t -66.24 -32.21 57.08 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.265 0 O-C-N 121.721 -0.612 . . . . 0.0 110.163 160.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.765 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.0 OUTLIER -68.77 -33.75 74.42 Favored 'General case' 0 CA--C 1.582 2.209 0 C-N-CA 124.595 1.158 . . . . 0.0 111.579 175.513 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.777 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.33 -28.46 53.91 Favored 'General case' 0 CA--C 1.583 2.221 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 157.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.05 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 27.5 mt -87.28 -5.14 59.04 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 163.139 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.967 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.1 -18.71 60.2 Favored 'General case' 0 CA--C 1.587 2.382 0 CA-C-O 123.877 1.799 . . . . 0.0 111.291 153.886 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.777 HD12 ' HA ' ' A' ' 16' ' ' ALA . 36.1 mt -77.15 -36.57 55.14 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 129.118 2.967 . . . . 0.0 113.155 154.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.05 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.5 t -38.12 -41.25 0.57 Allowed 'General case' 0 CA--C 1.59 2.493 0 CA-C-O 124.99 2.329 . . . . 0.0 109.475 160.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.945 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.1 OUTLIER -84.33 -53.22 5.62 Favored 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 127.357 2.263 . . . . 0.0 112.664 -173.203 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.724 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 11.0 mt-30 -50.57 -31.52 16.0 Favored 'General case' 0 N--CA 1.507 2.405 0 CA-C-O 121.634 0.731 . . . . 0.0 111.952 176.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.6 t 29.88 96.88 0.03 OUTLIER Pre-proline 0 CA--C 1.583 2.237 0 C-N-CA 125.775 1.63 . . . . 0.0 114.531 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.424 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -6.96 72.09 0.0 OUTLIER 'Trans proline' 0 CA--C 1.57 2.296 1 C-N-CA 127.139 5.226 . . . . 0.0 116.918 175.04 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.768 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -16.32 129.63 0.01 OUTLIER 'General case' 0 CA--C 1.577 1.994 0 C-N-CA 126.437 1.895 . . . . 0.0 114.242 169.23 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.34 145.39 18.7 Favored Glycine 0 CA--C 1.575 3.794 0 O-C-N 120.928 -1.108 . . . . 0.0 113.936 -157.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.551 0 O-C-N 120.969 -1.312 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.474 ' O ' ' HB2' ' A' ' 2' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.023 0 CA-C-O 120.825 0.345 . . . . 0.0 111.206 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.679 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 9.2 mp0 68.27 136.89 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.032 -1.042 . . . . 0.0 112.759 -175.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.679 ' HB2' ' O ' ' A' ' 2' ' ' GLU . 0.3 OUTLIER 149.15 38.19 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 127.303 2.241 . . . . 0.0 112.787 159.363 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.507 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 34.78 66.74 0.28 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.21 -0.931 . . . . 0.0 113.166 -169.993 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.765 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -92.18 -28.26 17.17 Favored 'General case' 0 N--CA 1.505 2.283 0 N-CA-C 114.606 1.335 . . . . 0.0 114.606 156.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.45 1.22 2.41 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.63 -1.294 . . . . 0.0 113.042 155.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.874 ' O ' HG23 ' A' ' 11' ' ' VAL . 20.0 mt-10 -141.96 11.82 2.02 Favored 'General case' 0 N--CA 1.501 2.092 0 C-N-CA 126.308 1.843 . . . . 0.0 112.09 171.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.765 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 8.9 t80 -73.22 -26.63 61.22 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.825 -1.172 . . . . 0.0 113.148 167.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.93 -33.61 45.35 Favored Glycine 1 CA--C 1.581 4.2 0 CA-C-O 122.214 0.897 . . . . 0.0 112.548 166.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.663 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.9 t -53.21 -32.42 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 O-C-N 120.814 -1.404 . . . . 0.0 111.858 158.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 7' ' ' GLU . 33.7 t -76.67 -60.08 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 C-N-CA 125.23 1.412 . . . . 0.0 111.27 -175.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.0 mt -70.09 -26.69 64.11 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.076 -1.64 . . . . 0.0 113.528 -178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.8 m -73.15 -23.92 60.52 Favored 'General case' 0 CA--C 1.58 2.108 0 O-C-N 120.122 -1.611 . . . . 0.0 114.545 162.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.825 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.34 -32.3 57.46 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.26 0 O-C-N 121.598 -0.688 . . . . 0.0 110.182 160.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.903 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.2 m-20 -67.88 -37.51 81.86 Favored 'General case' 0 CA--C 1.581 2.141 0 C-N-CA 124.538 1.135 . . . . 0.0 112.021 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.786 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.0 -28.21 16.13 Favored 'General case' 0 CA--C 1.585 2.316 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 156.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.103 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 29.1 mt -87.47 -8.73 56.1 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 164.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.903 ' HD3' ' HA ' ' A' ' 15' ' ' ASP . 0.0 OUTLIER -70.64 -20.38 62.73 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 124.891 2.282 . . . . 0.0 111.117 155.123 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.786 HD12 ' HA ' ' A' ' 16' ' ' ALA . 38.2 mt -75.52 -40.72 56.66 Favored 'General case' 0 CA--C 1.575 1.915 0 C-N-CA 129.416 3.086 . . . . 0.0 113.286 155.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.103 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -37.91 -38.71 0.32 Allowed 'General case' 0 CA--C 1.59 2.506 0 CA-C-O 125.253 2.454 . . . . 0.0 109.464 160.002 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.424 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -95.32 -45.14 7.27 Favored 'General case' 0 CA--C 1.58 2.112 0 C-N-CA 127.91 2.484 . . . . 0.0 112.353 -159.194 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.424 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 6.6 mt-30 -49.24 -95.83 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 125.709 1.603 . . . . 0.0 112.5 166.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.4 t 43.87 98.64 0.03 OUTLIER Pre-proline 0 CA--C 1.585 2.319 0 C-N-CA 125.869 1.668 . . . . 0.0 114.965 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.783 ' C ' HD22 ' A' ' 25' ' ' LEU . 52.9 Cg_exo -70.79 31.74 0.22 Allowed 'Trans proline' 0 CA--C 1.575 2.527 1 C-N-CA 125.877 4.385 . . . . 0.0 118.617 179.28 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.783 HD22 ' C ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER 28.83 -165.43 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.443 0 C-N-CA 126.621 1.969 . . . . 0.0 115.783 -169.198 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 104.25 -64.71 0.34 Allowed Glycine 0 CA--C 1.574 3.754 0 O-C-N 120.461 -1.399 . . . . 0.0 114.08 170.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.604 0 O-C-N 120.881 -1.364 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 120.862 0.363 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -84.87 -43.05 14.47 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.108 -0.995 . . . . 0.0 112.737 -173.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.3 mp -46.97 -60.88 2.15 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 124.387 1.075 . . . . 0.0 113.25 -176.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.571 ' HE2' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -51.51 9.3 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.545 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -177.106 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.771 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -74.55 -26.05 59.7 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 119.691 -1.88 . . . . 0.0 113.96 162.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.1 t -66.37 14.04 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.226 0 CA-C-O 122.093 0.949 . . . . 0.0 112.741 154.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.896 ' O ' HG23 ' A' ' 11' ' ' VAL . 8.5 mt-10 -138.27 -0.39 2.03 Favored 'General case' 0 N--CA 1.502 2.163 0 C-N-CA 125.361 1.464 . . . . 0.0 112.861 158.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.771 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 1.4 t80 -73.05 -24.35 60.69 Favored 'General case' 0 N--CA 1.502 2.152 0 C-N-CA 124.308 1.043 . . . . 0.0 113.609 161.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.97 -37.21 26.16 Favored Glycine 1 CA--C 1.58 4.101 0 O-C-N 121.326 -0.859 . . . . 0.0 113.174 167.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.6 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.3 t -48.52 -32.55 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 O-C-N 120.827 -1.396 . . . . 0.0 111.431 157.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.896 HG23 ' O ' ' A' ' 7' ' ' GLU . 38.3 t -76.49 -64.5 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 C-N-CA 124.886 1.274 . . . . 0.0 111.121 -175.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.465 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.3 mt -70.58 -28.85 65.2 Favored 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 122.942 1.353 . . . . 0.0 113.568 -175.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.0 m -72.91 -24.92 60.89 Favored 'General case' 0 CA--C 1.581 2.149 0 O-C-N 120.174 -1.579 . . . . 0.0 114.523 162.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.973 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -65.86 -32.46 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.245 0 O-C-N 121.826 -0.546 . . . . 0.0 110.205 160.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.938 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 28.1 m-20 -69.67 -34.08 73.47 Favored 'General case' 0 CA--C 1.583 2.237 0 C-N-CA 124.65 1.18 . . . . 0.0 111.515 177.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.745 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -54.47 -28.61 45.7 Favored 'General case' 0 CA--C 1.583 2.222 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 157.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.979 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 26.7 mt -86.7 -8.08 57.73 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 116.221 1.934 . . . . 0.0 116.221 163.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.98 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -73.2 -17.32 61.37 Favored 'General case' 0 CA--C 1.588 2.434 0 CA-C-O 124.604 2.145 . . . . 0.0 111.485 154.471 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.745 HD12 ' HA ' ' A' ' 16' ' ' ALA . 33.6 mt -79.02 -36.67 40.76 Favored 'General case' 0 CA--C 1.574 1.888 0 C-N-CA 128.98 2.912 . . . . 0.0 113.078 155.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.979 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.4 t -38.48 -42.28 0.74 Allowed 'General case' 0 CA--C 1.59 2.513 0 CA-C-O 124.946 2.307 . . . . 0.0 109.453 160.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.98 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.4 OUTLIER -82.62 -58.75 2.77 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 127.317 2.247 . . . . 0.0 112.676 -173.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.672 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 8.6 mt-30 -48.82 -85.55 0.0 OUTLIER 'General case' 0 CA--C 1.58 2.11 0 C-N-CA 124.59 1.156 . . . . 0.0 112.364 172.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.408 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 46.8 t 24.69 101.08 0.02 OUTLIER Pre-proline 0 CA--C 1.582 2.194 0 C-N-CA 126.446 1.898 . . . . 0.0 114.97 167.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.528 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -6.95 71.54 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.271 1 C-N-CA 127.233 5.288 . . . . 0.0 117.173 177.015 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.76 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -13.22 129.81 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 126.22 1.808 . . . . 0.0 114.269 163.734 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.21 72.19 0.84 Allowed Glycine 0 CA--C 1.575 3.829 0 O-C-N 121.108 -0.995 . . . . 0.0 113.878 -172.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.566 0 O-C-N 121.021 -1.282 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.559 ' O ' ' HG3' ' A' ' 2' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.499 2.025 0 CA-C-O 120.773 0.32 . . . . 0.0 111.256 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 1' ' ' MET . 5.1 mt-10 -177.94 159.25 1.34 Allowed 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.096 -1.002 . . . . 0.0 112.713 174.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.952 HD13 ' N ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER 175.26 -27.75 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 124.563 1.145 . . . . 0.0 113.582 163.772 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.952 ' N ' HD13 ' A' ' 3' ' ' LEU . 2.0 mtmp? 56.17 67.44 1.0 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.77 -1.206 . . . . 0.0 113.017 160.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.825 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -93.03 -34.44 13.71 Favored 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 159.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 m -68.45 7.91 0.55 Allowed 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.174 -1.579 . . . . 0.0 112.999 155.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.886 ' O ' HG23 ' A' ' 11' ' ' VAL . 12.8 mt-10 -143.74 12.92 1.69 Allowed 'General case' 0 N--CA 1.501 2.103 0 C-N-CA 126.298 1.839 . . . . 0.0 112.054 165.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.825 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.4 OUTLIER -72.97 -27.64 61.93 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.025 -1.047 . . . . 0.0 113.132 165.603 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.9 -37.57 43.82 Favored Glycine 1 CA--C 1.584 4.406 0 CA-C-O 122.493 1.052 . . . . 0.0 112.123 167.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.648 HG23 ' HA ' ' A' ' 7' ' ' GLU . 3.0 t -49.74 -31.66 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 C-N-CA 125.19 1.396 . . . . 0.0 111.713 158.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 7' ' ' GLU . 36.1 t -76.3 -58.21 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 C-N-CA 125.106 1.362 . . . . 0.0 111.07 -176.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.435 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.5 mt -68.19 -28.25 67.11 Favored 'General case' 0 N--CA 1.503 2.217 0 CA-C-O 123.11 1.433 . . . . 0.0 113.641 -176.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 m -72.77 -26.73 61.65 Favored 'General case' 0 CA--C 1.582 2.179 0 O-C-N 120.201 -1.562 . . . . 0.0 114.715 162.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.809 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -65.56 -30.96 51.75 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.249 0 O-C-N 121.872 -0.517 . . . . 0.0 110.192 160.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.864 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 52.7 m-20 -70.02 -35.34 74.25 Favored 'General case' 0 CA--C 1.581 2.166 0 C-N-CA 124.547 1.139 . . . . 0.0 111.551 176.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.756 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.92 -28.91 25.62 Favored 'General case' 0 CA--C 1.584 2.268 0 C-N-CA 124.536 1.134 . . . . 0.0 114.033 156.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.091 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 25.9 mt -87.97 -5.29 58.61 Favored 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 163.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 1.046 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -74.58 -19.21 60.4 Favored 'General case' 0 CA--C 1.587 2.393 0 O-C-N 119.877 -1.764 . . . . 0.0 111.19 154.013 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.756 HD12 ' HA ' ' A' ' 16' ' ' ALA . 35.2 mt -76.3 -37.46 57.43 Favored 'General case' 0 CA--C 1.575 1.929 0 C-N-CA 129.124 2.969 . . . . 0.0 113.245 154.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.091 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -38.12 -41.91 0.62 Allowed 'General case' 0 CA--C 1.589 2.467 0 CA-C-O 124.789 2.233 . . . . 0.0 109.696 160.459 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 1.046 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -82.44 -57.91 3.15 Favored 'General case' 0 N--CA 1.501 2.12 0 C-N-CA 127.24 2.216 . . . . 0.0 112.484 -173.312 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.544 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 4.5 mt-30 -44.87 -27.6 0.54 Allowed 'General case' 0 N--CA 1.507 2.406 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.009 -176.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t 34.56 88.37 0.1 OUTLIER Pre-proline 0 CA--C 1.582 2.197 0 C-N-CA 124.938 1.295 . . . . 0.0 113.763 172.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -62.69 -144.11 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.58 0 C-N-CA 124.59 3.527 . . . . 0.0 115.359 -174.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.675 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -79.92 154.69 28.13 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.243 -1.536 . . . . 0.0 114.486 -156.069 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.8 60.54 8.28 Favored Glycine 0 CA--C 1.574 3.748 0 O-C-N 120.821 -1.174 . . . . 0.0 113.827 159.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.352 0.689 0 O-C-N 121.078 -1.248 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.518 ' HE2' ' HB2' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.024 0 CA-C-O 120.687 0.279 . . . . 0.0 111.383 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -47.3 -59.56 3.1 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.007 -1.058 . . . . 0.0 112.907 173.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 47.82 19.46 0.17 Allowed 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.428 1.091 . . . . 0.0 113.459 -165.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.3 mtpp 39.71 44.53 1.3 Allowed 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 124.664 1.186 . . . . 0.0 113.459 173.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.729 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -92.9 -32.77 14.46 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.741 -1.225 . . . . 0.0 114.072 156.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.1 t -67.82 5.01 0.95 Allowed 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.464 -1.398 . . . . 0.0 112.8 154.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.88 ' O ' HG23 ' A' ' 11' ' ' VAL . 14.1 mt-10 -140.89 13.56 2.27 Favored 'General case' 0 N--CA 1.502 2.139 0 C-N-CA 126.085 1.754 . . . . 0.0 112.047 165.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.729 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.5 OUTLIER -70.14 -29.36 66.26 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.182 -0.949 . . . . 0.0 112.66 157.186 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.83 -40.73 74.88 Favored Glycine 1 CA--C 1.585 4.433 0 CA-C-O 122.291 0.939 . . . . 0.0 111.893 166.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.695 HG23 ' HA ' ' A' ' 7' ' ' GLU . 4.0 t -51.83 -30.92 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.257 0 C-N-CA 125.487 1.515 . . . . 0.0 112.117 161.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 7' ' ' GLU . 39.8 t -75.9 -57.44 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 C-N-CA 125.011 1.324 . . . . 0.0 111.356 -176.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.46 HD21 ' HE1' ' A' ' 8' ' ' PHE . 4.6 mt -58.28 -27.64 64.23 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.352 -1.467 . . . . 0.0 114.21 175.33 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.42 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.3 m -72.91 -27.67 62.01 Favored 'General case' 0 CA--C 1.58 2.127 0 O-C-N 120.045 -1.66 . . . . 0.0 114.911 163.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.487 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -65.08 -30.21 49.68 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.273 0 O-C-N 121.736 -0.602 . . . . 0.0 110.18 161.022 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.72 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 9.1 m-20 -70.36 -35.05 73.31 Favored 'General case' 0 CA--C 1.582 2.177 0 C-N-CA 124.515 1.126 . . . . 0.0 111.328 176.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.797 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.49 -29.01 22.77 Favored 'General case' 0 CA--C 1.584 2.278 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 156.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.061 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 23.0 mt -88.29 -5.37 58.38 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 116.172 1.915 . . . . 0.0 116.172 163.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.992 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -74.91 -17.64 60.54 Favored 'General case' 0 CA--C 1.587 2.385 0 O-C-N 119.765 -1.834 . . . . 0.0 111.287 153.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.797 HD12 ' HA ' ' A' ' 16' ' ' ALA . 37.0 mt -77.49 -38.03 49.94 Favored 'General case' 0 CA--C 1.574 1.891 0 C-N-CA 129.163 2.985 . . . . 0.0 113.117 154.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.061 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -37.25 -41.87 0.42 Allowed 'General case' 0 CA--C 1.588 2.419 0 CA-C-O 124.788 2.232 . . . . 0.0 109.662 160.455 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.962 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 3.6 mmm180 -83.59 -59.39 2.45 Favored 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 127.365 2.266 . . . . 0.0 112.544 -173.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.684 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 12.2 mt-30 -44.05 -59.66 2.21 Favored 'General case' 0 CA--C 1.584 2.266 0 CA-C-O 122.484 1.135 . . . . 0.0 112.543 -175.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t 41.24 80.41 0.28 Allowed Pre-proline 0 CA--C 1.582 2.18 0 C-N-CA 124.427 1.091 . . . . 0.0 113.44 -166.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -62.13 -143.05 0.01 OUTLIER 'Trans proline' 0 CA--C 1.577 2.64 0 C-N-CA 124.325 3.35 . . . . 0.0 115.136 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.696 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -80.19 173.92 12.11 Favored 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 125.327 1.451 . . . . 0.0 114.289 -156.627 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.06 94.81 0.02 OUTLIER Glycine 0 CA--C 1.574 3.773 0 O-C-N 120.86 -1.15 . . . . 0.0 113.831 -170.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.544 0 O-C-N 121.042 -1.269 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tpp . . . . . 0 CA--C 1.578 2.036 0 CA-C-O 120.863 0.363 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 76.44 169.82 0.25 Allowed 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 124.494 1.118 . . . . 0.0 113.004 -173.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.422 ' O ' ' HG3' ' A' ' 4' ' ' LYS . 3.4 mm? -74.02 1.3 11.25 Favored 'General case' 0 N--CA 1.506 2.372 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -158.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 175.83 54.58 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 125.376 1.47 . . . . 0.0 113.759 -157.564 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.762 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -93.56 -28.17 16.2 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 120.538 -1.351 . . . . 0.0 114.506 156.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -68.82 8.48 0.51 Allowed 'General case' 0 CA--C 1.581 2.16 0 O-C-N 120.534 -1.354 . . . . 0.0 112.991 155.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.877 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.2 mt-10 -143.11 12.14 1.79 Allowed 'General case' 0 N--CA 1.502 2.169 0 C-N-CA 126.225 1.81 . . . . 0.0 111.95 169.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.762 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.7 OUTLIER -72.75 -26.03 61.41 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 120.799 -1.188 . . . . 0.0 113.162 172.531 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.615 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -83.87 -24.29 49.67 Favored Glycine 1 CA--C 1.582 4.263 0 CA-C-O 122.795 1.22 . . . . 0.0 112.443 167.537 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.669 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -61.17 -28.47 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 120.651 -1.499 . . . . 0.0 111.395 156.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.877 HG23 ' O ' ' A' ' 7' ' ' GLU . 40.0 t -77.39 -63.08 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 C-N-CA 125.472 1.509 . . . . 0.0 111.456 -178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.495 ' N ' HD23 ' A' ' 12' ' ' LEU . 3.8 mt -61.91 -21.81 65.06 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 119.917 -1.739 . . . . 0.0 113.429 174.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.615 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 1.4 t -73.73 -29.91 62.52 Favored 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 161.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.823 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -63.18 -30.01 48.65 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.283 0 CA-C-O 119.043 -0.503 . . . . 0.0 109.777 162.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.889 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 53.5 m-20 -70.6 -36.3 73.46 Favored 'General case' 0 CA--C 1.581 2.136 0 C-N-CA 124.95 1.3 . . . . 0.0 111.5 173.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.816 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.48 -29.16 23.42 Favored 'General case' 0 CA--C 1.584 2.251 0 C-N-CA 124.893 1.277 . . . . 0.0 113.592 155.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.051 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 47.6 mt -90.0 -2.08 58.08 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 164.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.889 ' HD3' ' HA ' ' A' ' 15' ' ' ASP . 0.0 OUTLIER -75.97 -20.61 57.77 Favored 'General case' 0 CA--C 1.589 2.466 0 CA-C-O 124.881 2.277 . . . . 0.0 111.22 153.034 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.816 HD12 ' HA ' ' A' ' 16' ' ' ALA . 34.3 mt -74.63 -37.43 62.81 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 129.347 3.059 . . . . 0.0 113.166 155.12 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.051 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.8 t -37.11 -40.06 0.29 Allowed 'General case' 0 CA--C 1.587 2.399 0 CA-C-O 124.672 2.177 . . . . 0.0 109.97 160.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.821 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 4.3 mmm-85 -92.43 -54.89 3.61 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 126.939 2.096 . . . . 0.0 112.701 -164.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -37.81 -86.6 0.0 OUTLIER 'General case' 0 CA--C 1.583 2.22 0 CA-C-O 122.125 0.964 . . . . 0.0 111.904 168.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 56.14 161.64 0.07 OUTLIER Pre-proline 0 CA--C 1.585 2.316 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 176.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -8.02 74.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.569 2.234 1 C-N-CA 127.491 5.461 . . . . 0.0 117.021 173.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.738 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -24.59 148.64 0.0 OUTLIER 'General case' 0 CA--C 1.577 1.999 0 C-N-CA 124.442 1.097 . . . . 0.0 113.615 164.234 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.48 -77.77 0.57 Allowed Glycine 0 CA--C 1.574 3.763 0 O-C-N 121.081 -1.012 . . . . 0.0 114.414 -177.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.56 0 O-C-N 120.829 -1.395 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.576 1.978 0 CA-C-O 120.865 0.364 . . . . 0.0 111.282 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.586 ' O ' ' HG2' ' A' ' 2' ' ' GLU . 0.2 OUTLIER -116.58 77.74 1.14 Allowed 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.128 -0.983 . . . . 0.0 112.855 165.789 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 mp 41.77 36.75 0.65 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 120.639 -1.288 . . . . 0.0 112.969 -163.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 1.016 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 43.6 mtmt -20.66 87.63 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 126.392 1.877 . . . . 0.0 115.238 -158.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.504 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -90.91 -32.75 15.89 Favored 'General case' 0 N--CA 1.505 2.312 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 156.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.638 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 1.1 p -68.27 5.09 1.05 Allowed 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.334 -1.479 . . . . 0.0 113.102 155.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 1.016 ' HB2' ' HB3' ' A' ' 4' ' ' LYS . 3.8 mt-10 -145.22 25.23 1.4 Allowed 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 126.18 1.792 . . . . 0.0 111.544 169.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.504 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 19.1 t80 -67.68 -37.7 82.7 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.313 -0.867 . . . . 0.0 113.036 163.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -69.59 -29.49 71.39 Favored Glycine 1 CA--C 1.581 4.192 0 CA-C-O 123.101 1.389 . . . . 0.0 112.211 167.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.744 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.7 t -63.15 -25.72 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 O-C-N 120.752 -1.44 . . . . 0.0 111.937 161.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.857 HG23 ' O ' ' A' ' 7' ' ' GLU . 16.4 t -76.8 -39.53 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 CA-C-O 123.275 1.512 . . . . 0.0 110.399 177.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.504 ' N ' HD23 ' A' ' 12' ' ' LEU . 3.7 mt -70.15 -26.45 63.94 Favored 'General case' 0 N--CA 1.502 2.13 0 CA-C-O 124.173 1.94 . . . . 0.0 112.733 176.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -73.01 -27.23 61.66 Favored 'General case' 0 CA--C 1.58 2.123 0 O-C-N 119.916 -1.74 . . . . 0.0 114.378 160.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.567 ' O ' ' HB2' ' A' ' 17' ' ' LEU . 2.2 t -64.94 -30.94 51.84 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.245 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.26 161.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.754 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.2 m-20 -68.67 -37.08 79.34 Favored 'General case' 0 CA--C 1.582 2.178 0 C-N-CA 124.522 1.129 . . . . 0.0 111.725 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.786 ' O ' ' HB2' ' A' ' 19' ' ' LEU . . . -52.5 -28.17 19.37 Favored 'General case' 0 CA--C 1.586 2.337 0 C-N-CA 124.696 1.198 . . . . 0.0 114.232 155.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.068 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 28.4 mt -87.16 -6.7 58.53 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 163.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 1.004 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -73.85 -16.96 61.12 Favored 'General case' 0 N--CA 1.507 2.417 0 CA-C-O 124.896 2.284 . . . . 0.0 111.365 154.502 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.786 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 45.8 mt -77.16 -40.47 45.38 Favored 'General case' 0 CA--C 1.575 1.913 0 C-N-CA 129.711 3.204 . . . . 0.0 112.842 153.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.068 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -39.15 -39.75 0.63 Allowed 'General case' 0 CA--C 1.589 2.472 0 CA-C-O 125.297 2.475 . . . . 0.0 109.508 158.685 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.627 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -91.32 -45.33 8.65 Favored 'General case' 0 CA--C 1.579 2.087 0 C-N-CA 127.767 2.427 . . . . 0.0 112.369 -160.622 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.689 ' NE2' HD23 ' A' ' 19' ' ' LEU . 17.8 mt-30 -37.03 -83.74 0.01 OUTLIER 'General case' 0 CA--C 1.58 2.133 0 C-N-CA 125.411 1.484 . . . . 0.0 112.413 161.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 0.96 88.41 0.03 OUTLIER Pre-proline 0 CA--C 1.582 2.179 0 C-N-CA 127.225 2.21 . . . . 0.0 115.326 -178.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -64.8 -144.11 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.615 0 C-N-CA 124.73 3.62 . . . . 0.0 115.286 -178.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.65 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -92.47 157.12 16.73 Favored 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 125.746 1.618 . . . . 0.0 113.934 -156.5 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 54.84 -105.18 0.33 Allowed Glycine 0 CA--C 1.575 3.822 0 O-C-N 120.599 -1.313 . . . . 0.0 113.994 -175.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.583 0 O-C-N 120.871 -1.37 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.8 mmt . . . . . 0 CA--C 1.577 2.011 0 CA-C-O 120.798 0.333 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 86.07 -63.23 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.168 0 C-N-CA 124.943 1.297 . . . . 0.0 112.719 173.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER 65.03 9.7 5.69 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.574 -1.329 . . . . 0.0 113.459 159.369 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.695 ' CG ' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 43.34 82.75 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.829 -1.17 . . . . 0.0 113.86 157.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.745 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -97.51 -40.9 8.44 Favored 'General case' 0 N--CA 1.507 2.421 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 157.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.68 3.0 1.56 Allowed 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.083 -1.635 . . . . 0.0 112.985 155.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.914 ' O ' HG23 ' A' ' 11' ' ' VAL . 8.8 mt-10 -137.31 14.75 3.01 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 126.82 2.048 . . . . 0.0 111.789 170.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.745 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 3.6 t80 -69.49 -32.01 70.63 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.861 -1.149 . . . . 0.0 113.078 171.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -72.63 -35.23 59.27 Favored Glycine 1 CA--C 1.587 4.539 0 CA-C-O 122.878 1.265 . . . . 0.0 111.736 168.232 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.67 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.2 t -55.55 -28.43 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.252 0 C-N-CA 125.175 1.39 . . . . 0.0 111.76 160.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 7' ' ' GLU . 33.0 t -77.03 -53.14 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 C-N-CA 125.11 1.364 . . . . 0.0 110.954 -177.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.419 ' O ' ' HB2' ' A' ' 15' ' ' ASP . 5.4 mt -70.97 -33.85 70.84 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -174.412 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 7.9 t -75.18 -20.52 59.28 Favored 'General case' 0 CA--C 1.578 2.023 0 O-C-N 120.373 -1.455 . . . . 0.0 114.42 160.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.537 ' O ' ' CD ' ' A' ' 18' ' ' LYS . 2.2 t -66.29 -29.11 45.61 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.251 0 O-C-N 121.631 -0.668 . . . . 0.0 110.186 157.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.819 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.1 m-20 -73.85 -34.94 64.72 Favored 'General case' 0 CA--C 1.583 2.231 0 CA-C-O 122.462 1.125 . . . . 0.0 110.806 175.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.82 -28.83 24.5 Favored 'General case' 0 CA--C 1.584 2.272 0 C-N-CA 125.135 1.374 . . . . 0.0 113.59 154.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.036 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 27.0 mt -89.34 -4.04 58.24 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 163.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.941 ' HA ' ' HG3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -75.49 -18.17 59.91 Favored 'General case' 0 CA--C 1.588 2.435 0 CA-C-O 123.938 1.828 . . . . 0.0 111.286 153.328 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.826 HD12 ' HA ' ' A' ' 16' ' ' ALA . 34.2 mt -76.62 -37.79 55.8 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 129.269 3.028 . . . . 0.0 113.112 154.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.036 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -37.26 -40.31 0.33 Allowed 'General case' 0 CA--C 1.587 2.397 0 CA-C-O 124.527 2.108 . . . . 0.0 109.768 160.009 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.941 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 2.4 mmt180 -88.84 -53.54 4.56 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 127.122 2.169 . . . . 0.0 112.733 -169.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.591 ' HG3' ' HA ' ' A' ' 19' ' ' LEU . 1.1 mt-30 -39.75 -44.35 1.56 Allowed 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 123.628 0.771 . . . . 0.0 112.259 -177.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.7 t 49.24 103.42 0.03 OUTLIER Pre-proline 0 CA--C 1.582 2.209 0 C-N-CA 124.663 1.185 . . . . 0.0 113.935 177.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -5.04 69.99 0.0 OUTLIER 'Trans proline' 0 CA--C 1.571 2.326 1 C-N-CA 127.073 5.182 . . . . 0.0 117.007 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.466 ' N ' HD12 ' A' ' 25' ' ' LEU . 2.6 mp 54.98 -176.92 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.262 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 157.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 44.48 38.5 5.31 Favored Glycine 0 CA--C 1.575 3.825 0 O-C-N 120.634 -1.291 . . . . 0.0 114.179 176.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.584 0 O-C-N 120.908 -1.348 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.478 ' CB ' ' HE2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.019 0 CA-C-O 120.295 0.093 . . . . 0.0 111.075 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -76.64 -104.79 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.583 -1.323 . . . . 0.0 112.603 -168.64 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.0 mp -45.65 -56.96 4.6 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 120.785 -1.197 . . . . 0.0 113.229 -165.667 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.541 ' HB2' ' HE3' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -19.04 85.66 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 126.259 1.824 . . . . 0.0 114.39 173.859 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.798 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -119.14 -27.3 5.72 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.687 -1.258 . . . . 0.0 114.33 159.671 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.6 p -68.45 10.85 0.21 Allowed 'General case' 0 CA--C 1.583 2.221 0 O-C-N 120.82 -1.175 . . . . 0.0 112.706 154.427 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.92 ' O ' HG23 ' A' ' 11' ' ' VAL . 14.9 mt-10 -143.0 1.67 1.28 Allowed 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 126.007 1.723 . . . . 0.0 112.536 166.554 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.798 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.2 OUTLIER -73.19 -24.49 60.54 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.971 -1.08 . . . . 0.0 113.425 171.998 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.531 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -77.61 -35.41 36.5 Favored Glycine 1 CA--C 1.582 4.27 0 O-C-N 121.187 -0.946 . . . . 0.0 112.762 165.092 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.599 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -53.34 -31.97 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.277 0 O-C-N 120.977 -1.308 . . . . 0.0 111.582 159.47 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 7' ' ' GLU . 40.9 t -76.91 -63.94 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 125.056 1.343 . . . . 0.0 111.025 -175.77 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.0 mt -70.74 -27.25 63.81 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.727 -1.233 . . . . 0.0 114.03 -177.528 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.531 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 29.4 t -74.4 -25.54 59.54 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.513 -1.367 . . . . 0.0 114.614 162.223 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.607 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -63.54 -33.53 62.07 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.287 0 O-C-N 122.002 -0.436 . . . . 0.0 109.944 159.618 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.828 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 14.8 m-20 -69.44 -33.99 73.76 Favored 'General case' 0 CA--C 1.583 2.216 0 C-N-CA 124.826 1.25 . . . . 0.0 111.377 174.093 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.775 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.45 -28.17 52.69 Favored 'General case' 0 CA--C 1.582 2.201 0 C-N-CA 124.236 1.014 . . . . 0.0 113.702 157.508 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.021 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 44.4 mt -89.79 -2.59 58.27 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 116.295 1.961 . . . . 0.0 116.295 163.597 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.932 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -76.3 -18.67 58.85 Favored 'General case' 0 CA--C 1.587 2.395 0 CA-C-O 124.638 2.161 . . . . 0.0 111.463 153.072 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.775 HD12 ' HA ' ' A' ' 16' ' ' ALA . 33.4 mt -76.61 -36.87 57.21 Favored 'General case' 0 CA--C 1.575 1.907 0 C-N-CA 129.222 3.009 . . . . 0.0 112.996 155.097 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.021 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.3 t -37.43 -38.83 0.26 Allowed 'General case' 0 CA--C 1.587 2.378 0 CA-C-O 124.351 2.024 . . . . 0.0 109.897 160.069 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.769 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -96.11 -57.36 2.36 Favored 'General case' 0 N--CA 1.503 2.211 0 C-N-CA 126.599 1.96 . . . . 0.0 112.803 -165.081 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 11.4 mt-30 -36.24 -89.65 0.0 OUTLIER 'General case' 0 CA--C 1.582 2.19 0 CA-C-O 123.093 1.425 . . . . 0.0 112.315 179.603 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 49.75 164.39 0.04 OUTLIER Pre-proline 0 CA--C 1.583 2.234 0 C-N-CA 124.92 1.288 . . . . 0.0 114.37 -170.926 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.443 ' C ' HD13 ' A' ' 25' ' ' LEU . 76.6 Cg_exo -65.27 -141.06 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.6 0 C-N-CA 124.085 3.19 . . . . 0.0 114.797 177.824 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.721 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.05 127.31 37.47 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 125.645 1.578 . . . . 0.0 114.126 -166.923 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -107.24 105.17 2.25 Favored Glycine 0 CA--C 1.574 3.74 0 O-C-N 120.813 -1.179 . . . . 0.0 114.111 -174.246 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.588 0 O-C-N 120.795 -1.415 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mtm . . . . . 0 N--CA 1.499 2.018 0 CA-C-O 120.794 0.33 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.598 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 10.0 mt-10 49.38 40.96 19.82 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.992 -1.068 . . . . 0.0 112.834 162.619 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -40.17 -48.68 2.58 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 124.627 1.171 . . . . 0.0 113.876 -161.364 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.598 ' HB2' ' O ' ' A' ' 2' ' ' GLU . 0.0 OUTLIER 28.79 65.36 0.11 Allowed 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 125.638 1.575 . . . . 0.0 114.641 158.093 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.745 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -92.89 -28.53 16.43 Favored 'General case' 0 N--CA 1.507 2.409 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 163.226 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.517 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 1.2 t -67.69 6.37 0.67 Allowed 'General case' 0 N--CA 1.504 2.256 0 O-C-N 120.515 -1.366 . . . . 0.0 113.061 155.756 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.89 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.3 mt-10 -145.04 9.8 1.29 Allowed 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 126.424 1.89 . . . . 0.0 111.902 169.844 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.745 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 9.0 t80 -72.92 -28.38 62.42 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 120.729 -1.232 . . . . 0.0 113.263 167.831 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.15 -35.19 57.48 Favored Glycine 1 CA--C 1.584 4.398 0 CA-C-O 122.697 1.165 . . . . 0.0 112.042 167.816 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.688 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.4 t -53.79 -33.83 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 C-N-CA 125.288 1.435 . . . . 0.0 111.753 160.978 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.89 HG23 ' O ' ' A' ' 7' ' ' GLU . 33.3 t -76.56 -59.11 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 C-N-CA 125.129 1.372 . . . . 0.0 111.258 -173.316 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.459 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.3 mt -67.59 -25.95 66.03 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 120.32 -1.488 . . . . 0.0 113.587 -177.337 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m -72.89 -26.46 61.44 Favored 'General case' 0 CA--C 1.581 2.161 0 O-C-N 120.233 -1.542 . . . . 0.0 114.626 162.269 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.842 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.1 t -66.13 -30.06 48.72 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.242 0 O-C-N 121.841 -0.537 . . . . 0.0 110.188 161.381 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.87 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 1.7 m-20 -70.23 -37.26 74.96 Favored 'General case' 0 CA--C 1.581 2.144 0 C-N-CA 124.616 1.166 . . . . 0.0 111.859 176.119 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.824 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -51.17 -27.17 8.09 Favored 'General case' 0 CA--C 1.587 2.387 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 156.266 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.048 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 25.5 mt -89.38 -10.62 45.92 Favored 'General case' 0 N--CA 1.505 2.276 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 164.199 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.894 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.59 -20.2 64.5 Favored 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 124.772 2.225 . . . . 0.0 111.218 155.119 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 16' ' ' ALA . 34.2 mt -76.17 -42.71 45.62 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 129.123 2.969 . . . . 0.0 113.307 155.237 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.048 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -37.34 -40.85 0.38 Allowed 'General case' 0 N--CA 1.512 2.626 0 CA-C-O 125.225 2.44 . . . . 0.0 108.802 158.183 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.54 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -77.8 -39.24 44.47 Favored 'General case' 0 CA--C 1.579 2.089 0 C-N-CA 128.032 2.533 . . . . 0.0 112.128 -176.527 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 4.1 mt-30 -94.51 -105.43 0.14 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 126.012 1.725 . . . . 0.0 112.888 172.962 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 34.3 t -56.08 93.42 0.04 OUTLIER Pre-proline 0 N--CA 1.504 2.23 0 C-N-CA 125.432 1.493 . . . . 0.0 114.409 -158.3 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.455 ' HD3' ' O ' ' A' ' 22' ' ' GLN . 70.9 Cg_exo -63.82 -142.12 0.01 OUTLIER 'Trans proline' 0 CA--C 1.576 2.597 0 C-N-CA 123.979 3.119 . . . . 0.0 114.803 177.577 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.689 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -84.32 168.36 15.7 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 125.243 1.417 . . . . 0.0 113.983 -161.018 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.96 160.84 3.79 Favored Glycine 0 CA--C 1.575 3.835 0 O-C-N 120.547 -1.346 . . . . 0.0 113.873 -162.847 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.538 0 O-C-N 120.893 -1.357 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.998 0 CA-C-O 120.596 0.236 . . . . 0.0 111.017 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -53.21 -101.32 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 124.318 1.047 . . . . 0.0 113.585 -156.896 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.83 ' O ' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -58.0 -23.45 54.14 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 120.577 -1.327 . . . . 0.0 113.494 -165.785 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 1.134 ' HE2' ' HG3' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 85.76 107.42 0.05 OUTLIER 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 125.895 1.678 . . . . 0.0 112.52 -171.049 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.85 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -92.13 -32.59 15.08 Favored 'General case' 0 N--CA 1.508 2.467 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 166.217 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.93 7.98 0.46 Allowed 'General case' 0 CA--C 1.584 2.26 0 O-C-N 120.136 -1.602 . . . . 0.0 112.755 153.498 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 1.134 ' HG3' ' HE2' ' A' ' 4' ' ' LYS . 6.4 mt-10 -141.59 4.33 1.74 Allowed 'General case' 0 N--CA 1.503 2.214 0 C-N-CA 127.764 2.426 . . . . 0.0 112.08 173.047 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.85 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 0.9 OUTLIER -73.82 -27.72 61.26 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.585 -1.322 . . . . 0.0 113.217 169.497 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.67 -34.69 38.49 Favored Glycine 1 CA--C 1.583 4.29 0 CA-C-O 122.51 1.061 . . . . 0.0 112.2 171.13 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.623 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.5 t -47.07 -35.69 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.152 0 O-C-N 120.823 -1.398 . . . . 0.0 110.959 156.665 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 7' ' ' GLU . 23.5 t -76.86 -55.65 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 C-N-CA 125.329 1.451 . . . . 0.0 111.004 -173.013 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.427 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.3 mt -70.19 -28.37 65.26 Favored 'General case' 0 N--CA 1.502 2.17 0 CA-C-O 123.473 1.606 . . . . 0.0 113.321 -177.031 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.413 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.8 m -72.46 -25.58 61.5 Favored 'General case' 0 CA--C 1.582 2.184 0 O-C-N 120.076 -1.64 . . . . 0.0 114.516 163.259 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.653 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -66.34 -32.33 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.255 0 C-N-CA 123.091 0.556 . . . . 0.0 110.25 160.515 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.796 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 2.0 m-20 -69.07 -32.52 72.02 Favored 'General case' 0 CA--C 1.583 2.24 0 C-N-CA 124.526 1.13 . . . . 0.0 111.436 176.136 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.788 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -55.41 -28.4 53.93 Favored 'General case' 0 CA--C 1.584 2.265 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 158.068 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.023 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 25.6 mt -88.63 -4.72 58.5 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 116.317 1.969 . . . . 0.0 116.317 163.156 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.939 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -75.25 -18.43 60.1 Favored 'General case' 0 CA--C 1.586 2.356 0 O-C-N 119.913 -1.742 . . . . 0.0 111.283 153.681 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.788 HD12 ' HA ' ' A' ' 16' ' ' ALA . 35.3 mt -77.0 -37.27 55.45 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 129.014 2.926 . . . . 0.0 113.123 154.946 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.023 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 1.5 t -36.97 -40.81 0.31 Allowed 'General case' 0 CA--C 1.588 2.426 0 CA-C-O 124.927 2.298 . . . . 0.0 109.786 160.608 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.791 ' HG3' ' HA ' ' A' ' 18' ' ' LYS . 6.4 mmm180 -88.15 -56.22 3.42 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 127.743 2.417 . . . . 0.0 112.689 -170.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.73 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 2.9 mt-30 -47.26 -27.54 1.58 Allowed 'General case' 0 N--CA 1.507 2.382 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.711 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.0 t -28.38 90.23 0.04 OUTLIER Pre-proline 0 CA--C 1.582 2.176 0 C-N-CA 125.524 1.529 . . . . 0.0 114.272 -172.022 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -7.45 69.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.57 2.318 1 C-N-CA 127.382 5.388 . . . . 0.0 117.017 178.298 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.725 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -14.96 121.59 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 126.849 2.06 . . . . 0.0 114.506 175.463 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -54.63 148.17 22.62 Favored Glycine 0 CA--C 1.576 3.882 0 O-C-N 120.831 -1.168 . . . . 0.0 113.706 -179.41 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.562 0 O-C-N 121.396 -1.061 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.419 ' HB3' ' H ' ' A' ' 2' ' ' GLU . 4.9 mtp . . . . . 0 N--CA 1.499 2.024 0 CA-C-O 120.777 0.323 . . . . 0.0 111.281 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.419 ' H ' ' HB3' ' A' ' 1' ' ' MET . 21.9 mt-10 56.97 -88.09 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.952 -1.092 . . . . 0.0 112.687 -157.626 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.459 ' O ' ' CG ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER 51.92 27.36 4.28 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.961 -1.087 . . . . 0.0 113.595 157.135 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.729 ' HB3' ' HB2' ' A' ' 7' ' ' GLU . 0.7 OUTLIER 147.07 75.04 0.0 OUTLIER 'General case' 0 CA--C 1.58 2.132 0 C-N-CA 127.578 2.351 . . . . 0.0 112.174 -159.704 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.757 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -87.0 -30.14 21.46 Favored 'General case' 0 N--CA 1.504 2.275 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 156.909 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.429 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 1.5 m -68.68 6.63 0.8 Allowed 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.388 -1.445 . . . . 0.0 113.162 155.913 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.906 ' O ' HG23 ' A' ' 11' ' ' VAL . 8.1 mt-10 -146.27 15.48 1.31 Allowed 'General case' 0 N--CA 1.501 2.098 0 C-N-CA 125.785 1.634 . . . . 0.0 112.13 171.511 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.757 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 1.8 t80 -73.44 -27.61 61.52 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.136 -0.977 . . . . 0.0 113.418 177.833 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.674 ' O ' ' HB3' ' A' ' 13' ' ' SER . . . -79.0 -31.97 41.44 Favored Glycine 1 CA--C 1.584 4.382 0 CA-C-O 122.872 1.262 . . . . 0.0 111.998 165.628 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.581 HG23 ' HA ' ' A' ' 7' ' ' GLU . 1.9 t -58.27 -27.7 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 C-N-CA 124.999 1.319 . . . . 0.0 111.779 159.187 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 7' ' ' GLU . 47.3 t -76.2 -65.13 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 C-N-CA 125.268 1.427 . . . . 0.0 110.74 -179.632 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.451 ' HA ' ' HB2' ' A' ' 15' ' ' ASP . 5.0 mt -68.43 -26.16 65.39 Favored 'General case' 0 N--CA 1.503 2.192 0 CA-C-O 123.283 1.516 . . . . 0.0 113.236 -175.757 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.674 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -71.7 -39.56 70.12 Favored 'General case' 0 CA--C 1.583 2.228 0 O-C-N 120.516 -1.365 . . . . 0.0 114.227 162.0 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.679 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -56.47 -29.09 28.06 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.326 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.917 164.359 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.757 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 15.6 m-20 -74.05 -34.76 64.17 Favored 'General case' 0 N--CA 1.502 2.172 0 C-N-CA 124.896 1.278 . . . . 0.0 111.241 176.403 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.807 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -51.87 -27.42 12.65 Favored 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 124.596 1.158 . . . . 0.0 114.099 156.454 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.075 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 24.0 mt -90.34 -11.79 39.61 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 163.307 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.919 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.48 -16.42 63.88 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-O 124.503 2.096 . . . . 0.0 111.215 155.068 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.807 HD12 ' HA ' ' A' ' 16' ' ' ALA . 41.9 mt -78.89 -43.46 24.88 Favored 'General case' 0 CA--C 1.575 1.941 0 C-N-CA 129.502 3.121 . . . . 0.0 113.154 155.555 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.075 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -35.39 -39.48 0.13 Allowed 'General case' 0 N--CA 1.509 2.482 0 CA-C-O 125.321 2.486 . . . . 0.0 109.506 158.331 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.562 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 1.2 tpp180 -99.89 -37.44 9.04 Favored 'General case' 0 CA--C 1.58 2.103 0 C-N-CA 128.34 2.656 . . . . 0.0 112.262 -157.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.621 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 5.1 mt-30 -65.96 -91.94 0.01 OUTLIER 'General case' 0 CA--C 1.579 2.093 0 C-N-CA 126.061 1.744 . . . . 0.0 112.514 176.166 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.1 t 179.74 139.79 0.3 Allowed Pre-proline 0 CA--C 1.584 2.281 0 C-N-CA 126.009 1.724 . . . . 0.0 114.894 -160.429 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -62.18 -143.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.577 2.626 0 C-N-CA 124.519 3.479 . . . . 0.0 115.117 -178.331 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.683 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -80.74 158.72 25.42 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 125.505 1.522 . . . . 0.0 114.374 -156.434 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.29 -10.36 0.94 Allowed Glycine 0 CA--C 1.576 3.866 0 O-C-N 120.815 -1.178 . . . . 0.0 113.921 177.032 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.564 0 O-C-N 120.979 -1.306 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 2.019 0 CA-C-O 120.948 0.404 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -133.77 18.59 3.86 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.021 -1.05 . . . . 0.0 112.564 162.326 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.761 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 1.4 mp -61.42 -2.93 0.81 Allowed 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -171.813 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 1.082 ' CB ' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 83.9 111.42 0.06 Allowed 'General case' 0 N--CA 1.507 2.4 0 CA-C-N 120.929 1.695 . . . . 0.0 112.504 -157.123 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.764 ' HA ' ' HB2' ' A' ' 8' ' ' PHE . . . -95.05 -37.64 11.01 Favored 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 163.425 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' A' ' 7' ' ' GLU . 4.8 t -68.79 5.36 1.12 Allowed 'General case' 0 N--CA 1.503 2.199 0 O-C-N 119.919 -1.738 . . . . 0.0 112.976 154.908 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 1.082 ' HB2' ' CB ' ' A' ' 4' ' ' LYS . 6.9 mt-10 -146.43 19.78 1.35 Allowed 'General case' 0 N--CA 1.502 2.144 0 C-N-CA 126.915 2.086 . . . . 0.0 111.453 173.906 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.764 ' HB2' ' HA ' ' A' ' 5' ' ' ALA . 1.6 t80 -73.47 -26.36 60.88 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.113 -0.992 . . . . 0.0 113.186 173.95 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.16 -33.52 32.32 Favored Glycine 1 CA--C 1.583 4.295 0 CA-C-O 122.701 1.167 . . . . 0.0 112.203 166.157 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.661 HG23 ' HA ' ' A' ' 7' ' ' GLU . 2.1 t -53.38 -28.41 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.248 0 O-C-N 120.788 -1.419 . . . . 0.0 111.675 157.493 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 7' ' ' GLU . 41.7 t -77.18 -62.94 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 C-N-CA 125.225 1.41 . . . . 0.0 110.956 -179.812 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.435 ' N ' HD23 ' A' ' 12' ' ' LEU . 4.6 mt -70.05 -29.26 66.23 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-O 123.074 1.416 . . . . 0.0 113.377 -173.83 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.1 m -72.94 -25.91 61.2 Favored 'General case' 0 CA--C 1.581 2.164 0 O-C-N 120.302 -1.499 . . . . 0.0 114.672 162.618 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.498 HG12 ' HE3' ' A' ' 18' ' ' LYS . 2.2 t -65.74 -30.48 50.21 Favored 'Isoleucine or valine' 0 CA--C 1.584 2.263 0 O-C-N 121.764 -0.585 . . . . 0.0 110.173 160.466 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.732 ' HA ' ' HD3' ' A' ' 18' ' ' LYS . 2.5 m-20 -71.95 -34.35 68.95 Favored 'General case' 0 CA--C 1.582 2.197 0 C-N-CA 124.559 1.144 . . . . 0.0 111.399 177.884 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.783 ' HA ' HD12 ' A' ' 19' ' ' LEU . . . -52.39 -27.53 16.11 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 157.113 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.067 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 30.6 mt -88.22 -13.77 40.2 Favored 'General case' 0 N--CA 1.505 2.284 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 163.255 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.968 ' HD2' ' N ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -68.0 -14.55 63.05 Favored 'General case' 0 N--CA 1.512 2.646 0 CA-C-O 124.447 2.07 . . . . 0.0 111.382 155.049 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 1.113 HD22 HD11 ' A' ' 25' ' ' LEU . 48.0 mt -81.83 -43.13 18.69 Favored 'General case' 0 CA--C 1.575 1.905 0 C-N-CA 129.238 3.015 . . . . 0.0 113.086 155.6 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 1.067 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -35.37 -38.62 0.1 Allowed 'General case' 0 N--CA 1.511 2.617 0 CA-C-O 125.497 2.57 . . . . 0.0 109.225 158.015 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.567 ' HB3' ' HA ' ' A' ' 18' ' ' LYS . 0.1 OUTLIER -98.53 -32.13 11.61 Favored 'General case' 0 CA--C 1.58 2.115 0 C-N-CA 129.52 3.128 . . . . 0.0 111.756 -162.591 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.723 ' HG3' ' O ' ' A' ' 18' ' ' LYS . 5.4 mt-30 -80.01 -96.72 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.011 0 C-N-CA 126.913 2.085 . . . . 0.0 113.316 161.882 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 t -158.45 165.46 18.51 Favored Pre-proline 0 CA--C 1.587 2.388 0 C-N-CA 126.989 2.116 . . . . 0.0 114.82 -178.949 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.797 ' C ' HD22 ' A' ' 25' ' ' LEU . 50.9 Cg_exo -71.55 29.45 0.24 Allowed 'Trans proline' 0 CA--C 1.575 2.538 1 C-N-CA 125.591 4.194 . . . . 0.0 119.508 -176.705 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 1.113 HD11 HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 24.62 -157.94 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 126.037 1.735 . . . . 0.0 115.349 -169.934 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.48 9.3 64.52 Favored Glycine 0 CA--C 1.575 3.834 0 O-C-N 120.327 -1.483 . . . . 0.0 114.171 163.965 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.555 0 O-C-N 121.009 -1.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_