data_6a5j_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6a5j _Structure_validation_residue.Date_analyzed 2019-07-19 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.588 ' HB2' ' HZ2' ' A' ' 2' ' ' LYS . 9.7 mtmp? . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.862 0.363 . . . . 1.71 110.956 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -99.56 -69.96 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.432 -0.951 . . . . 2.53 108.432 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.3 mm -91.04 -32.74 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 N-CA-C 108.999 -0.741 . . . . 1.2 108.999 177.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.429 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.3 mp -67.77 -10.51 53.34 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.159 -0.928 . . . . 2.1 110.136 178.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.505 ' HA ' ' HZ1' ' A' ' 2' ' ' LYS . 41.2 t -76.9 -64.18 1.19 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.814 -0.63 . . . . 0.91 109.886 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -57.34 -25.14 58.94 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.526 -0.916 . . . . 2.64 108.526 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.471 HG21 ' HG ' ' A' ' 12' ' ' LEU . 14.3 mm -80.98 -35.83 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 114.624 -1.171 . . . . 1.05 110.91 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.645 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 26.5 tttt -48.38 -32.22 7.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.144 -0.48 . . . . 2.25 111.135 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -90.85 -23.82 20.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.046 -0.525 . . . . 2.6 111.394 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.423 HD13 HD13 ' A' ' 8' ' ' ILE . 95.8 mt -84.43 -68.2 0.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.356 -0.384 . . . . 1.08 111.563 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.532 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.49 -68.25 0.66 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 111.847 0.314 . . . . 1.11 111.847 -179.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.645 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.9 tppp? . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.192 -0.908 . . . . 1.8 110.877 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.509 ' HB3' ' N ' ' A' ' 6' ' ' SER . 35.8 mtmm . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.853 0.359 . . . . 1.71 111.334 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -101.2 -70.4 0.74 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.218 -1.03 . . . . 2.53 108.218 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.5 mm -91.1 -32.78 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 108.72 -0.844 . . . . 1.2 108.72 177.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.48 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.7 mp -67.51 -10.52 52.43 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.185 -0.916 . . . . 2.1 110.136 178.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.509 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.3 t -74.34 -65.88 0.8 Allowed 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.882 -0.599 . . . . 0.91 110.288 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -59.98 -23.36 63.56 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.7 -0.852 . . . . 2.64 108.7 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.5 HD11 HD11 ' A' ' 11' ' ' LEU . 10.7 mm -80.2 -34.08 14.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.919 -1.037 . . . . 1.05 110.311 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.665 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 14.5 tttm -47.37 -34.53 7.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.798 -0.637 . . . . 2.25 110.919 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -90.92 -25.06 19.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.964 -0.562 . . . . 2.6 111.212 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.5 HD11 HD11 ' A' ' 8' ' ' ILE . 98.5 mt -78.84 -66.93 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.308 -0.406 . . . . 1.08 111.338 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.531 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -135.43 -64.57 0.63 Allowed 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 111.791 0.293 . . . . 1.11 111.791 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.665 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.355 -0.831 . . . . 1.8 110.825 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.491 ' HB3' ' N ' ' A' ' 6' ' ' SER . 31.8 mtmm . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.911 0.386 . . . . 1.71 111.197 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -103.1 -71.37 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.319 -0.993 . . . . 2.53 108.319 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 43.0 mm -91.04 -31.14 4.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 108.667 -0.864 . . . . 1.2 108.667 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.562 ' HB3' ' HZ1' ' A' ' 13' ' ' LYS . 3.4 mm? -68.63 -10.51 56.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.179 -0.919 . . . . 2.1 109.812 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.491 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 47.0 t -76.68 -63.72 1.28 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.758 -0.655 . . . . 0.91 109.72 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.639 ' HB3' ' HZ3' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -57.88 -24.85 59.51 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.523 -0.917 . . . . 2.64 108.523 178.176 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.461 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.1 mm -80.26 -36.08 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 CA-C-N 114.78 -1.1 . . . . 1.05 110.522 179.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.467 ' HD2' ' HE3' ' A' ' 2' ' ' LYS . 8.2 tttp -49.94 -31.81 13.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.014 -0.539 . . . . 2.25 111.118 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -90.28 -23.69 21.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.898 -0.592 . . . . 2.6 111.036 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.43 ' HB3' HD23 ' A' ' 12' ' ' LEU . 96.3 mt -84.92 -67.78 0.77 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 1.08 111.452 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.531 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -134.62 -69.94 0.51 Allowed 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.169 0.433 . . . . 1.11 112.169 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.562 ' HZ1' ' HB3' ' A' ' 5' ' ' LEU . 12.3 ttmm . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.161 -0.923 . . . . 1.8 110.836 -178.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.512 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 34.2 mtmm . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.872 0.368 . . . . 1.71 111.169 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -104.32 -68.61 0.84 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.613 -0.884 . . . . 2.53 108.613 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.447 HG21 ' HE2' ' A' ' 7' ' ' LYS . 43.7 mm -90.95 -34.18 6.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 108.977 -0.749 . . . . 1.2 108.977 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.445 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.1 mp -68.26 -10.69 56.44 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.333 -0.848 . . . . 2.1 110.022 178.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.478 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.5 t -76.18 -64.96 0.98 Allowed 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 115.814 -0.63 . . . . 0.91 109.957 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.447 ' HE2' HG21 ' A' ' 4' ' ' ILE . 65.0 pttt -56.6 -24.85 50.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.496 -0.928 . . . . 2.64 108.496 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.449 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.5 mm -80.56 -35.74 15.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 114.564 -1.198 . . . . 1.05 110.769 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.64 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 20.8 tttt -49.39 -31.97 10.62 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.039 -0.528 . . . . 2.25 111.153 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -90.62 -23.33 20.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.043 -0.526 . . . . 2.6 111.164 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.476 ' HB3' HD22 ' A' ' 12' ' ' LEU . 97.5 mt -85.11 -68.7 0.71 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 1.08 111.591 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.53 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.21 -69.44 0.63 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.559 -0.292 . . . . 1.11 111.78 -179.622 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.64 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.286 -0.864 . . . . 1.8 110.881 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.551 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 35.6 mtmm . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.941 0.4 . . . . 1.71 111.218 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -100.91 -70.4 0.74 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.216 -1.031 . . . . 2.53 108.216 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 41.9 mm -91.03 -30.8 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 108.825 -0.806 . . . . 1.2 108.825 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.444 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mt -68.85 -11.09 60.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.091 -0.958 . . . . 2.1 109.985 178.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.506 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.8 t -76.51 -63.67 1.29 Allowed 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.571 -0.741 . . . . 0.91 109.804 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.573 ' HZ2' ' HB3' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -57.67 -25.42 60.22 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.435 -0.95 . . . . 2.64 108.435 178.127 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.444 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.7 mm -78.97 -36.33 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 114.792 -1.094 . . . . 1.05 110.387 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.648 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 21.3 tttt -49.42 -31.69 10.21 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.009 -0.541 . . . . 2.25 111.007 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -90.81 -26.18 19.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.005 -0.543 . . . . 2.6 111.128 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.475 ' HB3' HD23 ' A' ' 12' ' ' LEU . 98.0 mt -80.78 -69.05 0.63 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.439 . . . . 1.08 111.443 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.525 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.89 -68.45 0.64 Allowed 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.857 0.317 . . . . 1.11 111.857 -179.619 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.648 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.4 tppp? . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.141 -0.933 . . . . 1.8 110.835 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.476 ' HB3' ' N ' ' A' ' 6' ' ' SER . 32.7 mtmm . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.934 0.397 . . . . 1.71 111.346 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -105.86 -71.59 0.74 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.659 -0.867 . . . . 2.53 108.659 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.4 mm -90.95 -32.35 5.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.857 -0.794 . . . . 1.2 108.857 177.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.573 ' HB3' ' HZ1' ' A' ' 13' ' ' LYS . 3.6 mm? -69.1 -10.38 57.31 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.015 -0.993 . . . . 2.1 109.453 178.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.476 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 32.5 t -74.15 -63.66 1.18 Allowed 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.322 -0.854 . . . . 0.91 109.879 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -57.7 -26.82 62.27 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.429 -0.952 . . . . 2.64 108.429 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.529 HG21 ' HG ' ' A' ' 12' ' ' LEU . 13.6 mm -75.93 -36.93 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.811 -1.086 . . . . 1.05 110.522 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.406 ' HA ' ' HD2' ' A' ' 13' ' ' LYS . 8.3 tmtm? -52.57 -36.16 55.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.867 -0.606 . . . . 2.25 111.275 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -91.02 -18.91 23.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 2.6 111.151 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.535 ' HB3' HD21 ' A' ' 12' ' ' LEU . 58.3 mt -87.16 -67.98 0.78 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.32 -0.4 . . . . 1.08 111.208 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.535 HD21 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -126.67 -84.31 0.62 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.522 -0.308 . . . . 1.11 111.786 -179.797 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.573 ' HZ1' ' HB3' ' A' ' 5' ' ' LEU . 20.1 ttmm . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.447 -0.787 . . . . 1.8 111.141 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.561 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 35.1 mtmm . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.806 0.336 . . . . 1.71 111.204 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -98.92 -72.29 0.66 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.99 -1.115 . . . . 2.53 107.99 178.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.431 HD13 ' HZ3' ' A' ' 7' ' ' LYS . 47.9 mm -91.42 -29.52 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 115.498 -0.774 . . . . 1.2 108.964 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.411 ' O ' ' HD2' ' A' ' 2' ' ' LYS . 4.3 mt -67.83 -11.65 59.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.274 -0.875 . . . . 2.1 110.177 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.461 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.9 t -77.22 -64.45 1.14 Allowed 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.831 -0.622 . . . . 0.91 110.101 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.431 ' HZ3' HD13 ' A' ' 4' ' ' ILE . 8.7 ptpp? -56.49 -25.0 49.85 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.548 -0.908 . . . . 2.64 108.548 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.497 HG21 ' HG ' ' A' ' 12' ' ' LEU . 13.9 mm -79.63 -36.95 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 114.746 -1.115 . . . . 1.05 110.698 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.658 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 7.5 tttp -50.54 -31.16 14.82 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.075 -0.511 . . . . 2.25 111.216 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -90.69 -23.72 20.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.122 -0.49 . . . . 2.6 111.2 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.416 ' HB3' HD22 ' A' ' 12' ' ' LEU . 97.1 mt -86.45 -68.59 0.73 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 1.08 111.556 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.517 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -129.23 -71.23 0.63 Allowed 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.963 0.357 . . . . 1.11 111.963 -179.628 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.658 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.8 tppp? . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.238 -0.887 . . . . 1.8 110.913 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.486 ' HB3' ' N ' ' A' ' 6' ' ' SER . 35.9 mtmm . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.845 0.355 . . . . 1.71 111.33 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -102.79 -71.49 0.72 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.294 -1.002 . . . . 2.53 108.294 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.528 ' HA ' ' HZ1' ' A' ' 7' ' ' LYS . 3.4 mp -90.18 -32.68 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 108.988 -0.745 . . . . 1.2 108.988 177.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 9' ' ' LYS . 3.1 mm? -68.07 -10.68 55.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.27 -0.877 . . . . 2.1 110.114 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.486 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.7 t -74.96 -67.8 0.61 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.019 -0.537 . . . . 0.91 110.269 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.528 ' HZ1' ' HA ' ' A' ' 4' ' ' ILE . 25.1 pttm -57.67 -23.55 52.02 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.849 -0.797 . . . . 2.64 108.849 178.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.431 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.9 mm -79.86 -35.55 16.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.001 -1.0 . . . . 1.05 110.377 178.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.513 ' HA ' ' HB3' ' A' ' 13' ' ' LYS . 4.7 tttp -50.29 -30.02 10.97 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.994 -0.548 . . . . 2.25 111.077 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -90.68 -23.94 20.6 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.008 -0.542 . . . . 2.6 111.065 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.0 mt -87.45 -69.24 0.7 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 1.08 111.749 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.13 -74.61 0.65 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.478 -0.328 . . . . 1.11 111.735 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.513 ' HB3' ' HA ' ' A' ' 9' ' ' LYS . 23.5 ttpp . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.252 -0.88 . . . . 1.8 111.839 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.497 ' HB3' ' N ' ' A' ' 6' ' ' SER . 56.8 mttm . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.913 0.387 . . . . 1.71 111.22 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -104.56 -72.67 0.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.41 -0.959 . . . . 2.53 108.41 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.546 HG23 ' HE2' ' A' ' 7' ' ' LYS . 39.4 mm -90.72 -29.23 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 108.35 -0.981 . . . . 1.2 108.35 177.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.639 ' HB3' ' HZ2' ' A' ' 13' ' ' LYS . 3.9 mm? -71.14 -9.8 58.68 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.838 -1.073 . . . . 2.1 109.636 178.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.497 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 45.7 t -76.63 -65.52 0.93 Allowed 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.483 -0.78 . . . . 0.91 110.045 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.546 ' HE2' HG23 ' A' ' 4' ' ' ILE . 62.7 pttt -56.49 -24.58 47.13 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.431 -0.951 . . . . 2.64 108.431 178.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.421 HD13 HD12 ' A' ' 11' ' ' LEU . 10.8 mm -81.7 -36.35 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 114.76 -1.109 . . . . 1.05 110.744 178.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.488 ' HG3' ' HE3' ' A' ' 2' ' ' LYS . 27.7 tttm -48.26 -35.07 11.37 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.284 -0.416 . . . . 2.25 110.882 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -90.42 -25.77 20.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.889 -0.596 . . . . 2.6 111.279 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.503 ' HB3' HD23 ' A' ' 12' ' ' LEU . 79.3 mt -77.54 -67.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 1.08 111.149 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.544 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -139.09 -65.14 0.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.044 0.387 . . . . 1.11 112.044 -179.744 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.639 ' HZ2' ' HB3' ' A' ' 5' ' ' LEU . 12.4 ttmm . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.155 -0.926 . . . . 1.8 110.797 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.5 ' HB3' ' N ' ' A' ' 6' ' ' SER . 34.8 mtmm . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.799 0.333 . . . . 1.71 111.24 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -102.15 -69.95 0.77 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.474 -0.936 . . . . 2.53 108.474 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -90.75 -33.19 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 108.732 -0.84 . . . . 1.2 108.732 177.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.489 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.1 mp -68.02 -10.5 54.2 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.069 -0.969 . . . . 2.1 109.951 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.5 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 44.2 t -74.73 -64.84 0.95 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.854 -0.612 . . . . 0.91 110.094 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -59.56 -23.86 63.25 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.638 -0.875 . . . . 2.64 108.638 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.498 HD13 HD13 ' A' ' 11' ' ' LEU . 12.6 mm -80.7 -34.25 14.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 114.816 -1.084 . . . . 1.05 110.549 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.662 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.0 ttpp -47.26 -33.87 5.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.771 -0.649 . . . . 2.25 111.139 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -90.6 -25.68 20.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.047 -0.524 . . . . 2.6 111.389 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.498 HD13 HD13 ' A' ' 8' ' ' ILE . 93.7 mt -80.41 -67.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.488 -0.324 . . . . 1.08 111.483 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.495 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -133.07 -66.29 0.67 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.888 0.329 . . . . 1.11 111.888 -179.604 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.662 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 3.3 tppp? . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.177 -0.916 . . . . 1.8 110.821 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.517 ' HZ1' ' HB2' ' A' ' 2' ' ' LYS . 9.0 mtmp? . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.941 0.4 . . . . 1.71 111.43 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -108.14 -71.95 0.74 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.662 -0.866 . . . . 2.53 108.662 178.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.1 mm -90.79 -31.8 5.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.634 -0.876 . . . . 1.2 108.634 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.621 ' HB3' ' HZ1' ' A' ' 13' ' ' LYS . 3.7 mm? -70.27 -10.3 58.52 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.134 -0.939 . . . . 2.1 109.257 178.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.467 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 36.8 t -72.39 -65.67 0.75 Allowed 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.369 -0.832 . . . . 0.91 109.959 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -58.83 -24.98 62.76 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.628 -0.879 . . . . 2.64 108.628 178.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.515 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.5 mm -76.62 -36.51 27.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.062 -0.972 . . . . 1.05 110.35 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.411 ' HA ' ' HD2' ' A' ' 13' ' ' LYS . 8.9 tttm -52.46 -33.24 43.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.734 -0.666 . . . . 2.25 110.944 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -91.32 -23.77 20.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.995 -0.548 . . . . 2.6 110.939 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.544 ' HB3' HD23 ' A' ' 12' ' ' LEU . 68.9 mt -81.31 -69.35 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.073 -0.512 . . . . 1.08 111.369 -179.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.544 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -129.69 -78.35 0.55 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.529 -0.305 . . . . 1.11 111.719 -179.659 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.621 ' HZ1' ' HB3' ' A' ' 5' ' ' LEU . 17.1 ttmm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.414 -0.803 . . . . 1.8 111.115 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.513 ' HB3' ' N ' ' A' ' 6' ' ' SER . 31.1 mtmm . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.86 0.362 . . . . 1.71 111.261 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -103.12 -70.02 0.77 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.621 -0.881 . . . . 2.53 108.621 178.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.474 HG22 ' NZ ' ' A' ' 7' ' ' LYS . 46.7 mm -90.95 -33.06 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 108.772 -0.825 . . . . 1.2 108.772 177.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.508 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 3.7 mm? -68.79 -10.37 56.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.281 -0.872 . . . . 2.1 109.932 178.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.513 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.8 t -73.65 -68.05 0.54 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.926 -0.579 . . . . 0.91 110.351 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.474 ' NZ ' HG22 ' A' ' 4' ' ' ILE . 23.9 pttm -57.91 -24.74 59.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.721 -0.844 . . . . 2.64 108.721 178.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.519 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.4 mm -78.76 -35.15 17.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 114.882 -1.054 . . . . 1.05 110.44 178.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.638 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 28.4 tttt -47.4 -33.72 6.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.827 -0.624 . . . . 2.25 111.137 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -90.66 -27.42 19.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 2.6 111.445 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.3 mt -79.67 -67.99 0.71 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.279 -0.419 . . . . 1.08 111.584 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.523 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -130.72 -69.54 0.64 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.797 0.295 . . . . 1.11 111.797 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.638 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.0 tppp? . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.176 -0.916 . . . . 1.8 110.807 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.529 ' HB3' ' N ' ' A' ' 6' ' ' SER . 34.3 mtmm . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.904 0.383 . . . . 1.71 111.368 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -101.19 -70.71 0.73 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.215 -1.031 . . . . 2.53 108.215 178.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 40.1 mm -91.42 -32.92 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 108.558 -0.904 . . . . 1.2 108.558 177.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.688 ' HB3' ' HZ2' ' A' ' 13' ' ' LYS . 4.9 mt -66.59 -10.99 51.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.276 -0.874 . . . . 2.1 109.825 178.62 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.529 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.4 t -74.48 -62.91 1.36 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.554 -0.748 . . . . 0.91 109.735 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -60.04 -24.73 64.77 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.536 -0.912 . . . . 2.64 108.536 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.519 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 15.1 mm -77.37 -37.21 24.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.914 -1.039 . . . . 1.05 110.462 178.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.45 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 13.0 tttt -52.08 -32.76 36.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.682 -0.69 . . . . 2.25 111.167 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -91.18 -24.55 19.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.055 -0.52 . . . . 2.6 111.119 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.473 ' HB3' HD23 ' A' ' 12' ' ' LEU . 88.3 mt -83.73 -69.9 0.6 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.132 -0.486 . . . . 1.08 111.392 -179.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.499 ' HG ' HG21 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -126.46 -77.74 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.004 0.372 . . . . 1.11 112.004 -179.432 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.688 ' HZ2' ' HB3' ' A' ' 5' ' ' LEU . 13.6 ttmm . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.104 -0.951 . . . . 1.8 110.956 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.494 ' HB3' ' N ' ' A' ' 6' ' ' SER . 31.8 mtmm . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.909 0.385 . . . . 1.71 111.379 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -102.63 -69.47 0.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.472 -0.936 . . . . 2.53 108.472 178.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.5 mm -91.2 -33.56 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 115.476 -0.784 . . . . 1.2 108.98 177.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.457 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.0 mp -68.14 -10.57 55.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.358 -0.837 . . . . 2.1 110.134 178.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.494 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.5 t -75.58 -65.34 0.91 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.827 -0.624 . . . . 0.91 110.032 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -56.89 -25.72 57.57 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 108.551 -0.907 . . . . 2.64 108.551 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.487 HG23 ' HG ' ' A' ' 12' ' ' LEU . 14.8 mm -79.59 -35.75 16.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.7 -1.136 . . . . 1.05 110.74 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.633 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.7 ttpp -48.41 -32.31 7.47 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.037 -0.529 . . . . 2.25 111.109 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -90.62 -25.16 20.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.007 -0.542 . . . . 2.6 111.263 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.406 ' HB3' HD23 ' A' ' 12' ' ' LEU . 96.0 mt -83.64 -68.32 0.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.324 -0.398 . . . . 1.08 111.61 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.547 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.26 -67.82 0.69 Allowed 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 112.009 0.374 . . . . 1.11 112.009 -179.636 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.633 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.4 tppp? . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.113 -0.946 . . . . 1.8 110.766 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.515 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.6 mtmm . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.891 0.377 . . . . 1.71 111.293 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -102.75 -70.59 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.486 -0.931 . . . . 2.53 108.486 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 42.8 mm -90.84 -32.55 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 108.834 -0.802 . . . . 1.2 108.834 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.485 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.2 mp -68.05 -10.41 53.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.245 -0.889 . . . . 2.1 109.931 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.488 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.3 t -74.89 -64.91 0.94 Allowed 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.845 -0.616 . . . . 0.91 110.026 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -59.13 -24.68 63.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.537 -0.912 . . . . 2.64 108.537 178.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.485 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.5 mm -80.03 -34.27 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 114.74 -1.118 . . . . 1.05 110.332 178.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.633 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.1 tttt -46.37 -36.14 6.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.856 -0.611 . . . . 2.25 110.945 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -90.9 -25.17 19.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.847 -0.615 . . . . 2.6 111.266 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.456 HD13 HD11 ' A' ' 8' ' ' ILE . 82.5 mt -77.47 -66.82 0.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 1.08 111.281 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.549 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -136.36 -64.58 0.6 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.486 -0.325 . . . . 1.11 111.76 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.633 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.1 tppp? . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.377 -0.821 . . . . 1.8 110.861 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.547 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 31.9 mtmm . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.722 0.296 . . . . 1.71 110.976 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -98.52 -68.88 0.78 Allowed 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.222 -1.029 . . . . 2.53 108.222 178.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -91.36 -32.92 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 115.385 -0.825 . . . . 1.2 108.919 177.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.428 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.6 mt -67.08 -10.9 54.88 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.146 -0.934 . . . . 2.1 110.466 179.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.515 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.5 t -75.65 -66.77 0.74 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.962 -0.563 . . . . 0.91 110.054 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -57.67 -23.98 54.29 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.717 -0.846 . . . . 2.64 108.717 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.506 HG22 ' HG ' ' A' ' 12' ' ' LEU . 13.5 mm -81.25 -35.01 13.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 114.826 -1.079 . . . . 1.05 110.577 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.657 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 18.9 tttm -46.6 -32.3 3.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.975 -0.557 . . . . 2.25 111.067 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -90.85 -26.77 19.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 2.6 111.372 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.49 HD12 HD12 ' A' ' 8' ' ' ILE . 99.6 mt -80.22 -68.2 0.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 1.08 111.695 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.506 ' HG ' HG22 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -131.87 -67.61 0.67 Allowed 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.801 0.297 . . . . 1.11 111.801 -179.528 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.657 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.344 -0.836 . . . . 1.8 110.767 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.554 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 33.4 mtmm . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.927 0.394 . . . . 1.71 111.255 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -105.26 -70.21 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.535 -0.913 . . . . 2.53 108.535 178.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.0 mm -90.95 -32.69 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 108.844 -0.798 . . . . 1.2 108.844 177.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.488 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mm? -69.48 -10.49 58.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.209 -0.905 . . . . 2.1 109.782 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.477 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.2 t -74.46 -65.77 0.82 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.746 -0.661 . . . . 0.91 109.916 179.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -58.3 -23.99 58.19 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.695 -0.854 . . . . 2.64 108.695 178.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.536 HG21 ' HG ' ' A' ' 12' ' ' LEU . 11.6 mm -80.55 -34.88 14.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 114.9 -1.045 . . . . 1.05 110.458 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.647 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 16.0 tttm -47.11 -34.42 6.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.731 -0.668 . . . . 2.25 111.159 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -90.63 -25.58 20.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.942 -0.572 . . . . 2.6 111.304 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.406 HD11 HD12 ' A' ' 8' ' ' ILE . 96.2 mt -79.87 -68.02 0.71 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.278 -0.419 . . . . 1.08 111.433 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.536 ' HG ' HG21 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -130.63 -70.33 0.62 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.77 0.285 . . . . 1.11 111.77 -179.627 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.647 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.9 tppp? . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.285 -0.865 . . . . 1.8 110.788 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.538 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.7 mtmm . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.85 0.357 . . . . 1.71 111.206 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -101.81 -69.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.349 -0.982 . . . . 2.53 108.349 178.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -91.1 -34.38 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 108.783 -0.821 . . . . 1.2 108.783 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.513 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.7 mp -66.92 -10.55 50.09 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.247 -0.888 . . . . 2.1 110.144 178.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.501 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 44.2 t -75.13 -64.21 1.1 Allowed 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.986 -0.552 . . . . 0.91 109.863 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -59.08 -25.23 63.6 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.482 -0.933 . . . . 2.64 108.482 178.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.513 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.7 mm -79.01 -35.21 17.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 114.851 -1.068 . . . . 1.05 110.468 178.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.626 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.5 ttpp -47.24 -34.17 6.22 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.854 -0.612 . . . . 2.25 110.843 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -90.95 -25.67 19.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.886 -0.597 . . . . 2.6 111.175 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.481 ' HB3' HD23 ' A' ' 12' ' ' LEU . 87.2 mt -79.09 -67.63 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 1.08 111.534 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.533 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -133.99 -67.3 0.59 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.508 -0.315 . . . . 1.11 111.765 -179.689 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.626 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.3 tppp? . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.316 -0.85 . . . . 1.8 110.804 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.535 ' HE2' ' HG3' ' A' ' 9' ' ' LYS . 61.0 mttp . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.848 0.356 . . . . 1.71 111.16 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -104.51 -70.44 0.77 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.549 -0.908 . . . . 2.53 108.549 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.1 mm -90.99 -29.42 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 108.841 -0.8 . . . . 1.2 108.841 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.573 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 2.6 mm? -72.75 -10.16 59.47 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.139 -0.937 . . . . 2.1 109.591 178.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.491 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 40.8 t -76.22 -66.17 0.83 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.607 -0.724 . . . . 0.91 109.855 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -54.12 -28.18 38.08 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.513 -0.921 . . . . 2.64 108.513 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.552 HG23 ' HD3' ' A' ' 13' ' ' LYS . 15.9 mm -77.43 -37.39 24.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.768 -1.105 . . . . 1.05 110.758 178.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.542 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.5 tttm -50.38 -37.06 35.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.017 -0.538 . . . . 2.25 111.251 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -91.23 -29.44 17.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 2.6 111.994 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.521 ' HB3' HD23 ' A' ' 12' ' ' LEU . 69.0 mt -75.87 -67.36 0.68 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.688 -0.233 . . . . 1.08 111.533 -179.161 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.531 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -129.12 -68.33 0.74 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.516 -0.311 . . . . 1.11 111.449 -179.794 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.573 ' HE2' ' HB3' ' A' ' 5' ' ' LEU . 13.5 tptp . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.345 -0.836 . . . . 1.8 111.161 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.618 ' HB2' ' HZ2' ' A' ' 2' ' ' LYS . 9.9 mtmp? . . . . . 0 CA--C 1.527 0.087 0 CA-C-O 120.987 0.422 . . . . 1.71 111.231 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -104.22 -68.81 0.83 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.561 -0.903 . . . . 2.53 108.561 178.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.7 mm -90.88 -33.33 5.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 108.768 -0.827 . . . . 1.2 108.768 177.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.577 ' HB3' ' HZ2' ' A' ' 13' ' ' LYS . 4.0 mm? -69.38 -10.45 58.01 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.182 -0.917 . . . . 2.1 109.832 178.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.519 ' HA ' ' HZ1' ' A' ' 2' ' ' LYS . 48.4 t -74.85 -65.88 0.82 Allowed 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.728 -0.669 . . . . 0.91 109.809 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -57.34 -25.28 59.16 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.598 -0.89 . . . . 2.64 108.598 178.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.485 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.7 mm -78.38 -36.39 20.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 114.926 -1.033 . . . . 1.05 110.474 178.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 5' ' ' LEU . 14.8 tttt -51.04 -31.32 18.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.002 -0.544 . . . . 2.25 111.044 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -90.23 -24.51 20.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 2.6 110.894 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.471 ' HB3' HD22 ' A' ' 12' ' ' LEU . 97.0 mt -84.0 -68.56 0.71 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 1.08 111.422 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.515 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -133.04 -73.63 0.5 Allowed 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.098 0.407 . . . . 1.11 112.098 -179.859 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.577 ' HZ2' ' HB3' ' A' ' 5' ' ' LEU . 9.7 ttmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.174 -0.917 . . . . 1.8 110.799 -178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 78.8 mt . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.821 0.343 . . . . 3.03 111.143 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.588 ' HB2' ' HZ2' ' A' ' 2' ' ' LYS . 9.7 mtmp? -72.06 133.0 45.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 1.71 110.956 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -99.56 -69.96 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.432 -0.951 . . . . 2.53 108.432 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.3 mm -91.04 -32.74 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 N-CA-C 108.999 -0.741 . . . . 1.2 108.999 177.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.429 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.3 mp -67.77 -10.51 53.34 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.159 -0.928 . . . . 2.1 110.136 178.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.505 ' HA ' ' HZ1' ' A' ' 2' ' ' LYS . 41.2 t -76.9 -64.18 1.19 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.814 -0.63 . . . . 0.91 109.886 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -57.34 -25.14 58.94 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.526 -0.916 . . . . 2.64 108.526 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.471 HG21 ' HG ' ' A' ' 12' ' ' LEU . 14.3 mm -80.98 -35.83 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 114.624 -1.171 . . . . 1.05 110.91 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.645 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 26.5 tttt -48.38 -32.22 7.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.144 -0.48 . . . . 2.25 111.135 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -90.85 -23.82 20.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.046 -0.525 . . . . 2.6 111.394 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.423 HD13 HD13 ' A' ' 8' ' ' ILE . 95.8 mt -84.43 -68.2 0.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.356 -0.384 . . . . 1.08 111.563 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.532 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.49 -68.25 0.66 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 111.847 0.314 . . . . 1.11 111.847 -179.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.645 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.9 tppp? . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.192 -0.908 . . . . 1.8 110.877 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 81.9 mt . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.734 0.302 . . . . 3.03 111.087 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.509 ' HB3' ' N ' ' A' ' 6' ' ' SER . 35.8 mtmm -98.25 133.91 42.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.289 -0.414 . . . . 1.71 111.334 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -101.2 -70.4 0.74 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.218 -1.03 . . . . 2.53 108.218 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.5 mm -91.1 -32.78 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 108.72 -0.844 . . . . 1.2 108.72 177.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.48 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.7 mp -67.51 -10.52 52.43 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.185 -0.916 . . . . 2.1 110.136 178.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.509 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.3 t -74.34 -65.88 0.8 Allowed 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.882 -0.599 . . . . 0.91 110.288 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -59.98 -23.36 63.56 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.7 -0.852 . . . . 2.64 108.7 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.5 HD11 HD11 ' A' ' 11' ' ' LEU . 10.7 mm -80.2 -34.08 14.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.919 -1.037 . . . . 1.05 110.311 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.665 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 14.5 tttm -47.37 -34.53 7.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.798 -0.637 . . . . 2.25 110.919 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -90.92 -25.06 19.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.964 -0.562 . . . . 2.6 111.212 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.5 HD11 HD11 ' A' ' 8' ' ' ILE . 98.5 mt -78.84 -66.93 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.308 -0.406 . . . . 1.08 111.338 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.531 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -135.43 -64.57 0.63 Allowed 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 111.791 0.293 . . . . 1.11 111.791 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.665 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.355 -0.831 . . . . 1.8 110.825 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 41.7 mm . . . . . 0 N--CA 1.484 1.263 0 CA-C-O 120.809 0.338 . . . . 3.03 110.975 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.491 ' HB3' ' N ' ' A' ' 6' ' ' SER . 31.8 mtmm -94.75 137.67 33.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.095 -0.502 . . . . 1.71 111.197 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -103.1 -71.37 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.319 -0.993 . . . . 2.53 108.319 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 43.0 mm -91.04 -31.14 4.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 108.667 -0.864 . . . . 1.2 108.667 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.562 ' HB3' ' HZ1' ' A' ' 13' ' ' LYS . 3.4 mm? -68.63 -10.51 56.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.179 -0.919 . . . . 2.1 109.812 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.491 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 47.0 t -76.68 -63.72 1.28 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.758 -0.655 . . . . 0.91 109.72 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.639 ' HB3' ' HZ3' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -57.88 -24.85 59.51 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.523 -0.917 . . . . 2.64 108.523 178.176 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.461 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.1 mm -80.26 -36.08 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 CA-C-N 114.78 -1.1 . . . . 1.05 110.522 179.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.467 ' HD2' ' HE3' ' A' ' 2' ' ' LYS . 8.2 tttp -49.94 -31.81 13.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.014 -0.539 . . . . 2.25 111.118 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -90.28 -23.69 21.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.898 -0.592 . . . . 2.6 111.036 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.43 ' HB3' HD23 ' A' ' 12' ' ' LEU . 96.3 mt -84.92 -67.78 0.77 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 1.08 111.452 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.531 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -134.62 -69.94 0.51 Allowed 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.169 0.433 . . . . 1.11 112.169 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.562 ' HZ1' ' HB3' ' A' ' 5' ' ' LEU . 12.3 ttmm . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.161 -0.923 . . . . 1.8 110.836 -178.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.564 HD12 ' H3 ' ' A' ' 1' ' ' ILE . 4.6 mp . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.929 0.395 . . . . 3.03 110.841 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.512 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 34.2 mtmm -95.05 137.95 33.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.173 -0.467 . . . . 1.71 111.169 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -104.32 -68.61 0.84 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.613 -0.884 . . . . 2.53 108.613 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.447 HG21 ' HE2' ' A' ' 7' ' ' LYS . 43.7 mm -90.95 -34.18 6.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 108.977 -0.749 . . . . 1.2 108.977 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.445 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.1 mp -68.26 -10.69 56.44 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.333 -0.848 . . . . 2.1 110.022 178.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.478 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.5 t -76.18 -64.96 0.98 Allowed 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 115.814 -0.63 . . . . 0.91 109.957 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.447 ' HE2' HG21 ' A' ' 4' ' ' ILE . 65.0 pttt -56.6 -24.85 50.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.496 -0.928 . . . . 2.64 108.496 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.449 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.5 mm -80.56 -35.74 15.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 114.564 -1.198 . . . . 1.05 110.769 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.64 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 20.8 tttt -49.39 -31.97 10.62 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.039 -0.528 . . . . 2.25 111.153 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -90.62 -23.33 20.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.043 -0.526 . . . . 2.6 111.164 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.476 ' HB3' HD22 ' A' ' 12' ' ' LEU . 97.5 mt -85.11 -68.7 0.71 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 1.08 111.591 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.53 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.21 -69.44 0.63 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.559 -0.292 . . . . 1.11 111.78 -179.622 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.64 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.286 -0.864 . . . . 1.8 110.881 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 45.4 mm . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 120.769 0.318 . . . . 3.03 110.957 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.551 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 35.6 mtmm -82.47 132.68 35.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.152 -0.476 . . . . 1.71 111.218 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -100.91 -70.4 0.74 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.216 -1.031 . . . . 2.53 108.216 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 41.9 mm -91.03 -30.8 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 108.825 -0.806 . . . . 1.2 108.825 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.444 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mt -68.85 -11.09 60.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.091 -0.958 . . . . 2.1 109.985 178.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.506 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.8 t -76.51 -63.67 1.29 Allowed 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.571 -0.741 . . . . 0.91 109.804 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.573 ' HZ2' ' HB3' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -57.67 -25.42 60.22 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.435 -0.95 . . . . 2.64 108.435 178.127 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.444 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.7 mm -78.97 -36.33 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 114.792 -1.094 . . . . 1.05 110.387 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.648 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 21.3 tttt -49.42 -31.69 10.21 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.009 -0.541 . . . . 2.25 111.007 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -90.81 -26.18 19.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.005 -0.543 . . . . 2.6 111.128 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.475 ' HB3' HD23 ' A' ' 12' ' ' LEU . 98.0 mt -80.78 -69.05 0.63 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.439 . . . . 1.08 111.443 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.525 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.89 -68.45 0.64 Allowed 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.857 0.317 . . . . 1.11 111.857 -179.619 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.648 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.4 tppp? . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.141 -0.933 . . . . 1.8 110.835 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 54.0 mt . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.918 0.389 . . . . 3.03 110.941 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.476 ' HB3' ' N ' ' A' ' 6' ' ' SER . 32.7 mtmm -86.03 139.39 31.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 1.71 111.346 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -105.86 -71.59 0.74 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.659 -0.867 . . . . 2.53 108.659 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.4 mm -90.95 -32.35 5.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.857 -0.794 . . . . 1.2 108.857 177.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.573 ' HB3' ' HZ1' ' A' ' 13' ' ' LYS . 3.6 mm? -69.1 -10.38 57.31 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.015 -0.993 . . . . 2.1 109.453 178.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.476 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 32.5 t -74.15 -63.66 1.18 Allowed 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.322 -0.854 . . . . 0.91 109.879 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -57.7 -26.82 62.27 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.429 -0.952 . . . . 2.64 108.429 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.529 HG21 ' HG ' ' A' ' 12' ' ' LEU . 13.6 mm -75.93 -36.93 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.811 -1.086 . . . . 1.05 110.522 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.406 ' HA ' ' HD2' ' A' ' 13' ' ' LYS . 8.3 tmtm? -52.57 -36.16 55.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.867 -0.606 . . . . 2.25 111.275 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -91.02 -18.91 23.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 2.6 111.151 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.535 ' HB3' HD21 ' A' ' 12' ' ' LEU . 58.3 mt -87.16 -67.98 0.78 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.32 -0.4 . . . . 1.08 111.208 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.535 HD21 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -126.67 -84.31 0.62 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.522 -0.308 . . . . 1.11 111.786 -179.797 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.573 ' HZ1' ' HB3' ' A' ' 5' ' ' LEU . 20.1 ttmm . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.447 -0.787 . . . . 1.8 111.141 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.538 ' H1 ' HD13 ' A' ' 1' ' ' ILE . 4.8 mp . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.766 0.317 . . . . 3.03 110.949 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.561 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 35.1 mtmm -64.02 136.09 57.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 1.71 111.204 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -98.92 -72.29 0.66 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.99 -1.115 . . . . 2.53 107.99 178.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.431 HD13 ' HZ3' ' A' ' 7' ' ' LYS . 47.9 mm -91.42 -29.52 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 115.498 -0.774 . . . . 1.2 108.964 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.411 ' O ' ' HD2' ' A' ' 2' ' ' LYS . 4.3 mt -67.83 -11.65 59.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.274 -0.875 . . . . 2.1 110.177 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.461 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.9 t -77.22 -64.45 1.14 Allowed 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.831 -0.622 . . . . 0.91 110.101 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.431 ' HZ3' HD13 ' A' ' 4' ' ' ILE . 8.7 ptpp? -56.49 -25.0 49.85 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.548 -0.908 . . . . 2.64 108.548 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.497 HG21 ' HG ' ' A' ' 12' ' ' LEU . 13.9 mm -79.63 -36.95 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 114.746 -1.115 . . . . 1.05 110.698 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.658 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 7.5 tttp -50.54 -31.16 14.82 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.075 -0.511 . . . . 2.25 111.216 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -90.69 -23.72 20.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.122 -0.49 . . . . 2.6 111.2 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.416 ' HB3' HD22 ' A' ' 12' ' ' LEU . 97.1 mt -86.45 -68.59 0.73 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 1.08 111.556 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.517 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -129.23 -71.23 0.63 Allowed 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.963 0.357 . . . . 1.11 111.963 -179.628 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.658 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.8 tppp? . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.238 -0.887 . . . . 1.8 110.913 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 79.5 mt . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.815 0.34 . . . . 3.03 110.983 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.486 ' HB3' ' N ' ' A' ' 6' ' ' SER . 35.9 mtmm -81.32 136.27 35.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.159 -0.473 . . . . 1.71 111.33 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -102.79 -71.49 0.72 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.294 -1.002 . . . . 2.53 108.294 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.528 ' HA ' ' HZ1' ' A' ' 7' ' ' LYS . 3.4 mp -90.18 -32.68 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 108.988 -0.745 . . . . 1.2 108.988 177.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 9' ' ' LYS . 3.1 mm? -68.07 -10.68 55.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.27 -0.877 . . . . 2.1 110.114 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.486 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.7 t -74.96 -67.8 0.61 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.019 -0.537 . . . . 0.91 110.269 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.528 ' HZ1' ' HA ' ' A' ' 4' ' ' ILE . 25.1 pttm -57.67 -23.55 52.02 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.849 -0.797 . . . . 2.64 108.849 178.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.431 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.9 mm -79.86 -35.55 16.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.001 -1.0 . . . . 1.05 110.377 178.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.513 ' HA ' ' HB3' ' A' ' 13' ' ' LYS . 4.7 tttp -50.29 -30.02 10.97 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.994 -0.548 . . . . 2.25 111.077 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -90.68 -23.94 20.6 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.008 -0.542 . . . . 2.6 111.065 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.0 mt -87.45 -69.24 0.7 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 1.08 111.749 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.13 -74.61 0.65 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.478 -0.328 . . . . 1.11 111.735 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.513 ' HB3' ' HA ' ' A' ' 9' ' ' LYS . 23.5 ttpp . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.252 -0.88 . . . . 1.8 111.839 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 59.2 mt . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 120.82 0.343 . . . . 3.03 110.964 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.497 ' HB3' ' N ' ' A' ' 6' ' ' SER . 56.8 mttm -118.01 134.09 55.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 1.71 111.22 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -104.56 -72.67 0.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.41 -0.959 . . . . 2.53 108.41 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.546 HG23 ' HE2' ' A' ' 7' ' ' LYS . 39.4 mm -90.72 -29.23 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 108.35 -0.981 . . . . 1.2 108.35 177.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.639 ' HB3' ' HZ2' ' A' ' 13' ' ' LYS . 3.9 mm? -71.14 -9.8 58.68 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.838 -1.073 . . . . 2.1 109.636 178.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.497 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 45.7 t -76.63 -65.52 0.93 Allowed 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.483 -0.78 . . . . 0.91 110.045 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.546 ' HE2' HG23 ' A' ' 4' ' ' ILE . 62.7 pttt -56.49 -24.58 47.13 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.431 -0.951 . . . . 2.64 108.431 178.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.421 HD13 HD12 ' A' ' 11' ' ' LEU . 10.8 mm -81.7 -36.35 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 114.76 -1.109 . . . . 1.05 110.744 178.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.488 ' HG3' ' HE3' ' A' ' 2' ' ' LYS . 27.7 tttm -48.26 -35.07 11.37 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.284 -0.416 . . . . 2.25 110.882 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -90.42 -25.77 20.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.889 -0.596 . . . . 2.6 111.279 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.503 ' HB3' HD23 ' A' ' 12' ' ' LEU . 79.3 mt -77.54 -67.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 1.08 111.149 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.544 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -139.09 -65.14 0.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.044 0.387 . . . . 1.11 112.044 -179.744 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.639 ' HZ2' ' HB3' ' A' ' 5' ' ' LEU . 12.4 ttmm . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.155 -0.926 . . . . 1.8 110.797 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 7.3 tp . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.785 0.326 . . . . 3.03 111.045 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.5 ' HB3' ' N ' ' A' ' 6' ' ' SER . 34.8 mtmm -92.44 134.21 35.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 1.71 111.24 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -102.15 -69.95 0.77 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.474 -0.936 . . . . 2.53 108.474 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -90.75 -33.19 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 108.732 -0.84 . . . . 1.2 108.732 177.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.489 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.1 mp -68.02 -10.5 54.2 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.069 -0.969 . . . . 2.1 109.951 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.5 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 44.2 t -74.73 -64.84 0.95 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.854 -0.612 . . . . 0.91 110.094 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -59.56 -23.86 63.25 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.638 -0.875 . . . . 2.64 108.638 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.498 HD13 HD13 ' A' ' 11' ' ' LEU . 12.6 mm -80.7 -34.25 14.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 114.816 -1.084 . . . . 1.05 110.549 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.662 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.0 ttpp -47.26 -33.87 5.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.771 -0.649 . . . . 2.25 111.139 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -90.6 -25.68 20.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.047 -0.524 . . . . 2.6 111.389 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.498 HD13 HD13 ' A' ' 8' ' ' ILE . 93.7 mt -80.41 -67.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.488 -0.324 . . . . 1.08 111.483 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.495 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -133.07 -66.29 0.67 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.888 0.329 . . . . 1.11 111.888 -179.604 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.662 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 3.3 tppp? . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.177 -0.916 . . . . 1.8 110.821 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 38.4 mm . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 120.923 0.392 . . . . 3.03 110.747 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.517 ' HZ1' ' HB2' ' A' ' 2' ' ' LYS . 9.0 mtmp? -64.98 138.67 58.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.896 -0.593 . . . . 1.71 111.43 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -108.14 -71.95 0.74 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.662 -0.866 . . . . 2.53 108.662 178.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.1 mm -90.79 -31.8 5.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.634 -0.876 . . . . 1.2 108.634 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.621 ' HB3' ' HZ1' ' A' ' 13' ' ' LYS . 3.7 mm? -70.27 -10.3 58.52 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.134 -0.939 . . . . 2.1 109.257 178.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.467 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 36.8 t -72.39 -65.67 0.75 Allowed 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.369 -0.832 . . . . 0.91 109.959 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -58.83 -24.98 62.76 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.628 -0.879 . . . . 2.64 108.628 178.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.515 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.5 mm -76.62 -36.51 27.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.062 -0.972 . . . . 1.05 110.35 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.411 ' HA ' ' HD2' ' A' ' 13' ' ' LYS . 8.9 tttm -52.46 -33.24 43.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.734 -0.666 . . . . 2.25 110.944 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -91.32 -23.77 20.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.995 -0.548 . . . . 2.6 110.939 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.544 ' HB3' HD23 ' A' ' 12' ' ' LEU . 68.9 mt -81.31 -69.35 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.073 -0.512 . . . . 1.08 111.369 -179.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.544 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -129.69 -78.35 0.55 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.529 -0.305 . . . . 1.11 111.719 -179.659 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.621 ' HZ1' ' HB3' ' A' ' 5' ' ' LEU . 17.1 ttmm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.414 -0.803 . . . . 1.8 111.115 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 71.8 mt . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.807 0.337 . . . . 3.03 111.103 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.513 ' HB3' ' N ' ' A' ' 6' ' ' SER . 31.1 mtmm -89.18 137.8 31.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 1.71 111.261 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -103.12 -70.02 0.77 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.621 -0.881 . . . . 2.53 108.621 178.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.474 HG22 ' NZ ' ' A' ' 7' ' ' LYS . 46.7 mm -90.95 -33.06 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 108.772 -0.825 . . . . 1.2 108.772 177.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.508 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 3.7 mm? -68.79 -10.37 56.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.281 -0.872 . . . . 2.1 109.932 178.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.513 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.8 t -73.65 -68.05 0.54 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.926 -0.579 . . . . 0.91 110.351 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.474 ' NZ ' HG22 ' A' ' 4' ' ' ILE . 23.9 pttm -57.91 -24.74 59.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.721 -0.844 . . . . 2.64 108.721 178.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.519 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.4 mm -78.76 -35.15 17.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 114.882 -1.054 . . . . 1.05 110.44 178.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.638 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 28.4 tttt -47.4 -33.72 6.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.827 -0.624 . . . . 2.25 111.137 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -90.66 -27.42 19.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 2.6 111.445 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.3 mt -79.67 -67.99 0.71 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.279 -0.419 . . . . 1.08 111.584 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.523 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -130.72 -69.54 0.64 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.797 0.295 . . . . 1.11 111.797 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.638 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.0 tppp? . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.176 -0.916 . . . . 1.8 110.807 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 46.8 mt . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 120.809 0.338 . . . . 3.03 110.81 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.529 ' HB3' ' N ' ' A' ' 6' ' ' SER . 34.3 mtmm -64.87 130.84 44.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 1.71 111.368 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -101.19 -70.71 0.73 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.215 -1.031 . . . . 2.53 108.215 178.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 40.1 mm -91.42 -32.92 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 108.558 -0.904 . . . . 1.2 108.558 177.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.688 ' HB3' ' HZ2' ' A' ' 13' ' ' LYS . 4.9 mt -66.59 -10.99 51.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.276 -0.874 . . . . 2.1 109.825 178.62 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.529 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.4 t -74.48 -62.91 1.36 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.554 -0.748 . . . . 0.91 109.735 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -60.04 -24.73 64.77 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.536 -0.912 . . . . 2.64 108.536 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.519 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 15.1 mm -77.37 -37.21 24.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.914 -1.039 . . . . 1.05 110.462 178.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.45 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 13.0 tttt -52.08 -32.76 36.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.682 -0.69 . . . . 2.25 111.167 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -91.18 -24.55 19.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.055 -0.52 . . . . 2.6 111.119 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.473 ' HB3' HD23 ' A' ' 12' ' ' LEU . 88.3 mt -83.73 -69.9 0.6 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.132 -0.486 . . . . 1.08 111.392 -179.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.499 ' HG ' HG21 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -126.46 -77.74 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.004 0.372 . . . . 1.11 112.004 -179.432 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.688 ' HZ2' ' HB3' ' A' ' 5' ' ' LEU . 13.6 ttmm . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.104 -0.951 . . . . 1.8 110.956 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 60.3 mt . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 120.829 0.347 . . . . 3.03 111.082 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.494 ' HB3' ' N ' ' A' ' 6' ' ' SER . 31.8 mtmm -83.81 137.8 33.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 1.71 111.379 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -102.63 -69.47 0.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.472 -0.936 . . . . 2.53 108.472 178.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.5 mm -91.2 -33.56 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 115.476 -0.784 . . . . 1.2 108.98 177.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.457 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.0 mp -68.14 -10.57 55.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.358 -0.837 . . . . 2.1 110.134 178.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.494 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.5 t -75.58 -65.34 0.91 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.827 -0.624 . . . . 0.91 110.032 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -56.89 -25.72 57.57 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 108.551 -0.907 . . . . 2.64 108.551 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.487 HG23 ' HG ' ' A' ' 12' ' ' LEU . 14.8 mm -79.59 -35.75 16.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.7 -1.136 . . . . 1.05 110.74 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.633 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.7 ttpp -48.41 -32.31 7.47 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.037 -0.529 . . . . 2.25 111.109 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -90.62 -25.16 20.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.007 -0.542 . . . . 2.6 111.263 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.406 ' HB3' HD23 ' A' ' 12' ' ' LEU . 96.0 mt -83.64 -68.32 0.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.324 -0.398 . . . . 1.08 111.61 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.547 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.26 -67.82 0.69 Allowed 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 112.009 0.374 . . . . 1.11 112.009 -179.636 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.633 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.4 tppp? . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.113 -0.946 . . . . 1.8 110.766 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 45.2 mm . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.833 0.349 . . . . 3.03 110.963 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.515 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.6 mtmm -98.9 135.8 39.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.164 -0.471 . . . . 1.71 111.293 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -102.75 -70.59 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.486 -0.931 . . . . 2.53 108.486 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 42.8 mm -90.84 -32.55 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 108.834 -0.802 . . . . 1.2 108.834 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.485 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.2 mp -68.05 -10.41 53.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.245 -0.889 . . . . 2.1 109.931 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.488 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.3 t -74.89 -64.91 0.94 Allowed 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.845 -0.616 . . . . 0.91 110.026 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -59.13 -24.68 63.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.537 -0.912 . . . . 2.64 108.537 178.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.485 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.5 mm -80.03 -34.27 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 114.74 -1.118 . . . . 1.05 110.332 178.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.633 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.1 tttt -46.37 -36.14 6.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.856 -0.611 . . . . 2.25 110.945 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -90.9 -25.17 19.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.847 -0.615 . . . . 2.6 111.266 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.456 HD13 HD11 ' A' ' 8' ' ' ILE . 82.5 mt -77.47 -66.82 0.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 1.08 111.281 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.549 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -136.36 -64.58 0.6 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.486 -0.325 . . . . 1.11 111.76 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.633 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.1 tppp? . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.377 -0.821 . . . . 1.8 110.861 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 83.9 mt . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 120.738 0.304 . . . . 3.03 111.208 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.547 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 31.9 mtmm -92.75 131.78 37.52 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.224 -0.444 . . . . 1.71 110.976 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -98.52 -68.88 0.78 Allowed 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.222 -1.029 . . . . 2.53 108.222 178.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -91.36 -32.92 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 115.385 -0.825 . . . . 1.2 108.919 177.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.428 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.6 mt -67.08 -10.9 54.88 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.146 -0.934 . . . . 2.1 110.466 179.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.515 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.5 t -75.65 -66.77 0.74 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.962 -0.563 . . . . 0.91 110.054 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -57.67 -23.98 54.29 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.717 -0.846 . . . . 2.64 108.717 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.506 HG22 ' HG ' ' A' ' 12' ' ' LEU . 13.5 mm -81.25 -35.01 13.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 114.826 -1.079 . . . . 1.05 110.577 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.657 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 18.9 tttm -46.6 -32.3 3.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.975 -0.557 . . . . 2.25 111.067 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -90.85 -26.77 19.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 2.6 111.372 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.49 HD12 HD12 ' A' ' 8' ' ' ILE . 99.6 mt -80.22 -68.2 0.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 1.08 111.695 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.506 ' HG ' HG22 ' A' ' 8' ' ' ILE . 0.1 OUTLIER -131.87 -67.61 0.67 Allowed 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.801 0.297 . . . . 1.11 111.801 -179.528 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.657 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.344 -0.836 . . . . 1.8 110.767 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 24.3 mt . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.969 0.414 . . . . 3.03 111.039 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.554 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 33.4 mtmm -82.5 140.03 33.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.495 . . . . 1.71 111.255 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -105.26 -70.21 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.535 -0.913 . . . . 2.53 108.535 178.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.0 mm -90.95 -32.69 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 108.844 -0.798 . . . . 1.2 108.844 177.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.488 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mm? -69.48 -10.49 58.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.209 -0.905 . . . . 2.1 109.782 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.477 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.2 t -74.46 -65.77 0.82 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.746 -0.661 . . . . 0.91 109.916 179.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -58.3 -23.99 58.19 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.695 -0.854 . . . . 2.64 108.695 178.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.536 HG21 ' HG ' ' A' ' 12' ' ' LEU . 11.6 mm -80.55 -34.88 14.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 114.9 -1.045 . . . . 1.05 110.458 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.647 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 16.0 tttm -47.11 -34.42 6.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.731 -0.668 . . . . 2.25 111.159 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -90.63 -25.58 20.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.942 -0.572 . . . . 2.6 111.304 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.406 HD11 HD12 ' A' ' 8' ' ' ILE . 96.2 mt -79.87 -68.02 0.71 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.278 -0.419 . . . . 1.08 111.433 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.536 ' HG ' HG21 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -130.63 -70.33 0.62 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.77 0.285 . . . . 1.11 111.77 -179.627 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.647 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.9 tppp? . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.285 -0.865 . . . . 1.8 110.788 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 44.7 mm . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.795 0.331 . . . . 3.03 110.939 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.538 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.7 mtmm -82.06 133.61 35.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.285 -0.416 . . . . 1.71 111.206 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -101.81 -69.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.349 -0.982 . . . . 2.53 108.349 178.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -91.1 -34.38 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 108.783 -0.821 . . . . 1.2 108.783 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.513 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.7 mp -66.92 -10.55 50.09 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.247 -0.888 . . . . 2.1 110.144 178.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.501 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 44.2 t -75.13 -64.21 1.1 Allowed 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.986 -0.552 . . . . 0.91 109.863 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -59.08 -25.23 63.6 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.482 -0.933 . . . . 2.64 108.482 178.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.513 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.7 mm -79.01 -35.21 17.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 114.851 -1.068 . . . . 1.05 110.468 178.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.626 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.5 ttpp -47.24 -34.17 6.22 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.854 -0.612 . . . . 2.25 110.843 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -90.95 -25.67 19.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.886 -0.597 . . . . 2.6 111.175 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.481 ' HB3' HD23 ' A' ' 12' ' ' LEU . 87.2 mt -79.09 -67.63 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 1.08 111.534 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.533 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -133.99 -67.3 0.59 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.508 -0.315 . . . . 1.11 111.765 -179.689 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.626 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.3 tppp? . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.316 -0.85 . . . . 1.8 110.804 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 79.2 mt . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.667 0.27 . . . . 3.03 111.082 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.535 ' HE2' ' HG3' ' A' ' 9' ' ' LYS . 61.0 mttp -82.3 132.08 35.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.368 -0.378 . . . . 1.71 111.16 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -104.51 -70.44 0.77 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.549 -0.908 . . . . 2.53 108.549 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.1 mm -90.99 -29.42 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 108.841 -0.8 . . . . 1.2 108.841 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.573 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 2.6 mm? -72.75 -10.16 59.47 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.139 -0.937 . . . . 2.1 109.591 178.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.491 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 40.8 t -76.22 -66.17 0.83 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.607 -0.724 . . . . 0.91 109.855 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -54.12 -28.18 38.08 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.513 -0.921 . . . . 2.64 108.513 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.552 HG23 ' HD3' ' A' ' 13' ' ' LYS . 15.9 mm -77.43 -37.39 24.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.768 -1.105 . . . . 1.05 110.758 178.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.542 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.5 tttm -50.38 -37.06 35.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.017 -0.538 . . . . 2.25 111.251 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -91.23 -29.44 17.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 2.6 111.994 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.521 ' HB3' HD23 ' A' ' 12' ' ' LEU . 69.0 mt -75.87 -67.36 0.68 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.688 -0.233 . . . . 1.08 111.533 -179.161 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.531 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -129.12 -68.33 0.74 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.516 -0.311 . . . . 1.11 111.449 -179.794 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.573 ' HE2' ' HB3' ' A' ' 5' ' ' LEU . 13.5 tptp . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.345 -0.836 . . . . 1.8 111.161 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 60.8 mt . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 120.862 0.363 . . . . 3.03 111.049 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.618 ' HB2' ' HZ2' ' A' ' 2' ' ' LYS . 9.9 mtmp? -95.22 134.02 38.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.078 -0.51 . . . . 1.71 111.231 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -104.22 -68.81 0.83 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.561 -0.903 . . . . 2.53 108.561 178.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.7 mm -90.88 -33.33 5.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 108.768 -0.827 . . . . 1.2 108.768 177.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.577 ' HB3' ' HZ2' ' A' ' 13' ' ' LYS . 4.0 mm? -69.38 -10.45 58.01 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.182 -0.917 . . . . 2.1 109.832 178.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.519 ' HA ' ' HZ1' ' A' ' 2' ' ' LYS . 48.4 t -74.85 -65.88 0.82 Allowed 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.728 -0.669 . . . . 0.91 109.809 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -57.34 -25.28 59.16 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.598 -0.89 . . . . 2.64 108.598 178.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.485 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.7 mm -78.38 -36.39 20.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 114.926 -1.033 . . . . 1.05 110.474 178.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 5' ' ' LEU . 14.8 tttt -51.04 -31.32 18.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.002 -0.544 . . . . 2.25 111.044 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -90.23 -24.51 20.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 2.6 110.894 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.471 ' HB3' HD22 ' A' ' 12' ' ' LEU . 97.0 mt -84.0 -68.56 0.71 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 1.08 111.422 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.515 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -133.04 -73.63 0.5 Allowed 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.098 0.407 . . . . 1.11 112.098 -179.859 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.577 ' HZ2' ' HB3' ' A' ' 5' ' ' LEU . 9.7 ttmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.174 -0.917 . . . . 1.8 110.799 -178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.543 ' HZ3' ' HA ' ' A' ' 6' ' ' SER . 9.7 mtmp? . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.862 0.363 . . . . 1.15 110.956 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -99.56 -69.96 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.432 -0.951 . . . . 2.0 108.432 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.3 mm -91.04 -32.74 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 N-CA-C 108.999 -0.741 . . . . 0.56 108.999 177.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.467 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.3 mp -67.77 -10.51 53.34 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.159 -0.928 . . . . 1.43 110.136 178.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.543 ' HA ' ' HZ3' ' A' ' 2' ' ' LYS . 41.2 t -76.9 -64.18 1.19 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.814 -0.63 . . . . 0.1 109.886 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -57.34 -25.14 58.94 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.526 -0.916 . . . . 2.09 108.526 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.513 HG23 ' HG ' ' A' ' 12' ' ' LEU . 14.3 mm -80.98 -35.83 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 114.624 -1.171 . . . . 0.16 110.91 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.674 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 26.5 tttt -48.38 -32.22 7.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.144 -0.48 . . . . 1.63 111.135 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -90.85 -23.82 20.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.046 -0.525 . . . . 2.02 111.394 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.441 ' HB3' HD23 ' A' ' 12' ' ' LEU . 95.8 mt -84.43 -68.2 0.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.356 -0.384 . . . . 0.18 111.563 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.531 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.49 -68.25 0.66 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 111.847 0.314 . . . . 0.3 111.847 -179.67 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.674 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.9 tppp? . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.192 -0.908 . . . . 1.46 110.877 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.528 ' HB3' ' N ' ' A' ' 6' ' ' SER . 35.8 mtmm . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.853 0.359 . . . . 1.15 111.334 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -101.2 -70.4 0.74 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.218 -1.03 . . . . 2.0 108.218 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.5 mm -91.1 -32.78 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 108.72 -0.844 . . . . 0.56 108.72 177.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.489 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.7 mp -67.51 -10.52 52.43 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.185 -0.916 . . . . 1.43 110.136 178.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.528 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.3 t -74.34 -65.88 0.8 Allowed 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.882 -0.599 . . . . 0.1 110.288 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -59.98 -23.36 63.56 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.7 -0.852 . . . . 2.09 108.7 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.519 HD13 HD12 ' A' ' 11' ' ' LEU . 10.7 mm -80.2 -34.08 14.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.919 -1.037 . . . . 0.16 110.311 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.69 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 14.5 tttm -47.37 -34.53 7.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.798 -0.637 . . . . 1.63 110.919 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -90.92 -25.06 19.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.964 -0.562 . . . . 2.02 111.212 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.541 ' HB3' HD23 ' A' ' 12' ' ' LEU . 98.5 mt -78.84 -66.93 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.308 -0.406 . . . . 0.18 111.338 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.541 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -135.43 -64.57 0.63 Allowed 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 111.791 0.293 . . . . 0.3 111.791 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.69 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.355 -0.831 . . . . 1.46 110.825 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.509 ' HB3' ' N ' ' A' ' 6' ' ' SER . 31.8 mtmm . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.911 0.386 . . . . 1.15 111.197 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -103.1 -71.37 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.319 -0.993 . . . . 2.0 108.319 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 43.0 mm -91.04 -31.14 4.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 108.667 -0.864 . . . . 0.56 108.667 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.466 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.4 mm? -68.63 -10.51 56.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.179 -0.919 . . . . 1.43 109.812 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.509 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 47.0 t -76.68 -63.72 1.28 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.758 -0.655 . . . . 0.1 109.72 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.88 -24.85 59.51 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.523 -0.917 . . . . 2.09 108.523 178.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.466 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.1 mm -80.26 -36.08 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 CA-C-N 114.78 -1.1 . . . . 0.16 110.522 179.031 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.483 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 8.2 tttp -49.94 -31.81 13.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.014 -0.539 . . . . 1.63 111.118 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -90.28 -23.69 21.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.898 -0.592 . . . . 2.02 111.036 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.509 ' HB3' HD23 ' A' ' 12' ' ' LEU . 96.3 mt -84.92 -67.78 0.77 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.18 111.452 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.533 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -134.62 -69.94 0.51 Allowed 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.169 0.433 . . . . 0.3 112.169 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.533 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 12.3 ttmm . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.161 -0.923 . . . . 1.46 110.836 -178.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.2 mtmm . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.872 0.368 . . . . 1.15 111.169 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -104.32 -68.61 0.84 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.613 -0.884 . . . . 2.0 108.613 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.478 HG23 ' HE2' ' A' ' 7' ' ' LYS . 43.7 mm -90.95 -34.18 6.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 108.977 -0.749 . . . . 0.56 108.977 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.48 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.1 mp -68.26 -10.69 56.44 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.333 -0.848 . . . . 1.43 110.022 178.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.496 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.5 t -76.18 -64.96 0.98 Allowed 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 115.814 -0.63 . . . . 0.1 109.957 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.478 ' HE2' HG23 ' A' ' 4' ' ' ILE . 65.0 pttt -56.6 -24.85 50.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.496 -0.928 . . . . 2.09 108.496 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.492 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.5 mm -80.56 -35.74 15.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 114.564 -1.198 . . . . 0.16 110.769 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.667 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 20.8 tttt -49.39 -31.97 10.62 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.039 -0.528 . . . . 1.63 111.153 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -90.62 -23.33 20.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.043 -0.526 . . . . 2.02 111.164 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.538 ' HB3' HD23 ' A' ' 12' ' ' LEU . 97.5 mt -85.11 -68.7 0.71 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.18 111.591 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.538 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -131.21 -69.44 0.63 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.559 -0.292 . . . . 0.3 111.78 -179.622 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.667 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.286 -0.864 . . . . 1.46 110.881 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.552 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 35.6 mtmm . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.941 0.4 . . . . 1.15 111.218 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -100.91 -70.4 0.74 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.216 -1.031 . . . . 2.0 108.216 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 41.9 mm -91.03 -30.8 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 108.825 -0.806 . . . . 0.56 108.825 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.458 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mt -68.85 -11.09 60.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.091 -0.958 . . . . 1.43 109.985 178.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.524 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.8 t -76.51 -63.67 1.29 Allowed 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.571 -0.741 . . . . 0.1 109.804 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.438 ' NZ ' ' HB3' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -57.67 -25.42 60.22 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.435 -0.95 . . . . 2.09 108.435 178.127 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.458 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.7 mm -78.97 -36.33 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 114.792 -1.094 . . . . 0.16 110.387 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.669 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 21.3 tttt -49.42 -31.69 10.21 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.009 -0.541 . . . . 1.63 111.007 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -90.81 -26.18 19.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.005 -0.543 . . . . 2.02 111.128 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.533 ' HB3' HD23 ' A' ' 12' ' ' LEU . 98.0 mt -80.78 -69.05 0.63 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.439 . . . . 0.18 111.443 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.533 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -131.89 -68.45 0.64 Allowed 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.857 0.317 . . . . 0.3 111.857 -179.619 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.669 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.4 tppp? . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.141 -0.933 . . . . 1.46 110.835 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.492 ' HB3' ' N ' ' A' ' 6' ' ' SER . 32.7 mtmm . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.934 0.397 . . . . 1.15 111.346 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -105.86 -71.59 0.74 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.659 -0.867 . . . . 2.0 108.659 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.4 mm -90.95 -32.35 5.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.857 -0.794 . . . . 0.56 108.857 177.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.499 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.6 mm? -69.1 -10.38 57.31 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.015 -0.993 . . . . 1.43 109.453 178.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.492 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 32.5 t -74.15 -63.66 1.18 Allowed 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.322 -0.854 . . . . 0.1 109.879 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -57.7 -26.82 62.27 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.429 -0.952 . . . . 2.09 108.429 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.543 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.6 mm -75.93 -36.93 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.811 -1.086 . . . . 0.16 110.522 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -52.57 -36.16 55.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.867 -0.606 . . . . 1.63 111.275 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -91.02 -18.91 23.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 2.02 111.151 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.574 ' HB3' HD23 ' A' ' 12' ' ' LEU . 58.3 mt -87.16 -67.98 0.78 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.32 -0.4 . . . . 0.18 111.208 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.574 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -126.67 -84.31 0.62 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.522 -0.308 . . . . 0.3 111.786 -179.797 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.446 ' HB2' HG22 ' A' ' 8' ' ' ILE . 20.1 ttmm . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.447 -0.787 . . . . 1.46 111.141 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.57 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 35.1 mtmm . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.806 0.336 . . . . 1.15 111.204 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -98.92 -72.29 0.66 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.99 -1.115 . . . . 2.0 107.99 178.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.9 mm -91.42 -29.52 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 115.498 -0.774 . . . . 0.56 108.964 177.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.434 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 4.3 mt -67.83 -11.65 59.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.274 -0.875 . . . . 1.43 110.177 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.482 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.9 t -77.22 -64.45 1.14 Allowed 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.831 -0.622 . . . . 0.1 110.101 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -56.49 -25.0 49.85 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.548 -0.908 . . . . 2.09 108.548 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.523 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.9 mm -79.63 -36.95 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 114.746 -1.115 . . . . 0.16 110.698 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.686 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 7.5 tttp -50.54 -31.16 14.82 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.075 -0.511 . . . . 1.63 111.216 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -90.69 -23.72 20.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.122 -0.49 . . . . 2.02 111.2 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.453 ' HB3' HD23 ' A' ' 12' ' ' LEU . 97.1 mt -86.45 -68.59 0.73 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.18 111.556 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.525 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -129.23 -71.23 0.63 Allowed 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.963 0.357 . . . . 0.3 111.963 -179.628 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.686 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.8 tppp? . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.238 -0.887 . . . . 1.46 110.913 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.503 ' HB3' ' N ' ' A' ' 6' ' ' SER . 35.9 mtmm . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.845 0.355 . . . . 1.15 111.33 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -102.79 -71.49 0.72 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.294 -1.002 . . . . 2.0 108.294 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.561 ' N ' HD12 ' A' ' 4' ' ' ILE . 3.4 mp -90.18 -32.68 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 108.988 -0.745 . . . . 0.56 108.988 177.228 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.473 HD22 ' N ' ' A' ' 5' ' ' LEU . 3.1 mm? -68.07 -10.68 55.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.27 -0.877 . . . . 1.43 110.114 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.503 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.7 t -74.96 -67.8 0.61 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.019 -0.537 . . . . 0.1 110.269 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.476 ' HZ3' ' HA ' ' A' ' 4' ' ' ILE . 25.1 pttm -57.67 -23.55 52.02 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.849 -0.797 . . . . 2.09 108.849 178.464 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.438 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.9 mm -79.86 -35.55 16.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.001 -1.0 . . . . 0.16 110.377 178.751 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.526 ' HA ' ' HB3' ' A' ' 13' ' ' LYS . 4.7 tttp -50.29 -30.02 10.97 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.994 -0.548 . . . . 1.63 111.077 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -90.68 -23.94 20.6 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.008 -0.542 . . . . 2.02 111.065 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.0 mt -87.45 -69.24 0.7 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.18 111.749 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.13 -74.61 0.65 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.478 -0.328 . . . . 0.3 111.735 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.526 ' HB3' ' HA ' ' A' ' 9' ' ' LYS . 23.5 ttpp . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.252 -0.88 . . . . 1.46 111.839 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.513 ' HB3' ' N ' ' A' ' 6' ' ' SER . 56.8 mttm . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.913 0.387 . . . . 1.15 111.22 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -104.56 -72.67 0.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.41 -0.959 . . . . 2.0 108.41 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.577 HG23 ' HE2' ' A' ' 7' ' ' LYS . 39.4 mm -90.72 -29.23 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 108.35 -0.981 . . . . 0.56 108.35 177.112 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 9' ' ' LYS . 3.9 mm? -71.14 -9.8 58.68 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.838 -1.073 . . . . 1.43 109.636 178.367 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.513 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 45.7 t -76.63 -65.52 0.93 Allowed 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.483 -0.78 . . . . 0.1 110.045 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.577 ' HE2' HG23 ' A' ' 4' ' ' ILE . 62.7 pttt -56.49 -24.58 47.13 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.431 -0.951 . . . . 2.09 108.431 178.299 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.425 HD13 ' HA ' ' A' ' 8' ' ' ILE . 10.8 mm -81.7 -36.35 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 114.76 -1.109 . . . . 0.16 110.744 178.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.499 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.7 tttm -48.26 -35.07 11.37 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.284 -0.416 . . . . 1.63 110.882 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -90.42 -25.77 20.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.889 -0.596 . . . . 2.02 111.279 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.541 ' HB3' HD23 ' A' ' 12' ' ' LEU . 79.3 mt -77.54 -67.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.18 111.149 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.541 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -139.09 -65.14 0.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.044 0.387 . . . . 0.3 112.044 -179.744 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.54 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 12.4 ttmm . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.155 -0.926 . . . . 1.46 110.797 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.564 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.8 mtmm . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.799 0.333 . . . . 1.15 111.24 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -102.15 -69.95 0.77 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.474 -0.936 . . . . 2.0 108.474 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -90.75 -33.19 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 108.732 -0.84 . . . . 0.56 108.732 177.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.5 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.1 mp -68.02 -10.5 54.2 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.069 -0.969 . . . . 1.43 109.951 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.517 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 44.2 t -74.73 -64.84 0.95 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.854 -0.612 . . . . 0.1 110.094 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -59.56 -23.86 63.25 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.638 -0.875 . . . . 2.09 108.638 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.513 HG23 ' HG ' ' A' ' 12' ' ' LEU . 12.6 mm -80.7 -34.25 14.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 114.816 -1.084 . . . . 0.16 110.549 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.693 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.0 ttpp -47.26 -33.87 5.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.771 -0.649 . . . . 1.63 111.139 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -90.6 -25.68 20.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.047 -0.524 . . . . 2.02 111.389 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.51 HD12 HD13 ' A' ' 8' ' ' ILE . 93.7 mt -80.41 -67.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.488 -0.324 . . . . 0.18 111.483 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.513 ' HG ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -133.07 -66.29 0.67 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.888 0.329 . . . . 0.3 111.888 -179.604 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.693 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 3.3 tppp? . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.177 -0.916 . . . . 1.46 110.821 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.481 ' HB3' ' N ' ' A' ' 6' ' ' SER . 9.0 mtmp? . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.941 0.4 . . . . 1.15 111.43 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -108.14 -71.95 0.74 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.662 -0.866 . . . . 2.0 108.662 178.4 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.1 mm -90.79 -31.8 5.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.634 -0.876 . . . . 0.56 108.634 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.519 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mm? -70.27 -10.3 58.52 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.134 -0.939 . . . . 1.43 109.257 178.395 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.481 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 36.8 t -72.39 -65.67 0.75 Allowed 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.369 -0.832 . . . . 0.1 109.959 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -58.83 -24.98 62.76 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.628 -0.879 . . . . 2.09 108.628 178.411 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.519 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.5 mm -76.62 -36.51 27.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.062 -0.972 . . . . 0.16 110.35 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -52.46 -33.24 43.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.734 -0.666 . . . . 1.63 110.944 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -91.32 -23.77 20.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.995 -0.548 . . . . 2.02 110.939 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.633 ' HB3' HD23 ' A' ' 12' ' ' LEU . 68.9 mt -81.31 -69.35 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.073 -0.512 . . . . 0.18 111.369 -179.476 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.633 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -129.69 -78.35 0.55 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.529 -0.305 . . . . 0.3 111.719 -179.659 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.496 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 17.1 ttmm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.414 -0.803 . . . . 1.46 111.115 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.543 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 31.1 mtmm . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.86 0.362 . . . . 1.15 111.261 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -103.12 -70.02 0.77 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.621 -0.881 . . . . 2.0 108.621 178.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.478 HG23 ' NZ ' ' A' ' 7' ' ' LYS . 46.7 mm -90.95 -33.06 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 108.772 -0.825 . . . . 0.56 108.772 177.55 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.543 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 3.7 mm? -68.79 -10.37 56.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.281 -0.872 . . . . 1.43 109.932 178.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.53 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.8 t -73.65 -68.05 0.54 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.926 -0.579 . . . . 0.1 110.351 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.478 ' NZ ' HG23 ' A' ' 4' ' ' ILE . 23.9 pttm -57.91 -24.74 59.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.721 -0.844 . . . . 2.09 108.721 178.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.55 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.4 mm -78.76 -35.15 17.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 114.882 -1.054 . . . . 0.16 110.44 178.781 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.663 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 28.4 tttt -47.4 -33.72 6.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.827 -0.624 . . . . 1.63 111.137 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -90.66 -27.42 19.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 2.02 111.445 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.448 ' HB3' HD23 ' A' ' 12' ' ' LEU . 95.3 mt -79.67 -67.99 0.71 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.279 -0.419 . . . . 0.18 111.584 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.55 ' HG ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -130.72 -69.54 0.64 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.797 0.295 . . . . 0.3 111.797 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.663 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.0 tppp? . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.176 -0.916 . . . . 1.46 110.807 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.545 ' HB3' ' N ' ' A' ' 6' ' ' SER . 34.3 mtmm . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.904 0.383 . . . . 1.15 111.368 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -101.19 -70.71 0.73 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.215 -1.031 . . . . 2.0 108.215 178.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 40.1 mm -91.42 -32.92 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 108.558 -0.904 . . . . 0.56 108.558 177.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.532 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.9 mt -66.59 -10.99 51.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.276 -0.874 . . . . 1.43 109.825 178.62 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.545 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.4 t -74.48 -62.91 1.36 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.554 -0.748 . . . . 0.1 109.735 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -60.04 -24.73 64.77 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.536 -0.912 . . . . 2.09 108.536 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.532 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 15.1 mm -77.37 -37.21 24.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.914 -1.039 . . . . 0.16 110.462 178.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.472 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 13.0 tttt -52.08 -32.76 36.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.682 -0.69 . . . . 1.63 111.167 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -91.18 -24.55 19.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.055 -0.52 . . . . 2.02 111.119 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.543 ' HB3' HD23 ' A' ' 12' ' ' LEU . 88.3 mt -83.73 -69.9 0.6 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.132 -0.486 . . . . 0.18 111.392 -179.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.543 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -126.46 -77.74 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.004 0.372 . . . . 0.3 112.004 -179.432 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.485 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 13.6 ttmm . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.104 -0.951 . . . . 1.46 110.956 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.533 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 31.8 mtmm . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.909 0.385 . . . . 1.15 111.379 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -102.63 -69.47 0.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.472 -0.936 . . . . 2.0 108.472 178.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.5 mm -91.2 -33.56 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 115.476 -0.784 . . . . 0.56 108.98 177.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.493 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.0 mp -68.14 -10.57 55.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.358 -0.837 . . . . 1.43 110.134 178.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.512 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.5 t -75.58 -65.34 0.91 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.827 -0.624 . . . . 0.1 110.032 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -56.89 -25.72 57.57 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 108.551 -0.907 . . . . 2.09 108.551 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.515 HG23 ' HG ' ' A' ' 12' ' ' LEU . 14.8 mm -79.59 -35.75 16.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.7 -1.136 . . . . 0.16 110.74 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.662 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.7 ttpp -48.41 -32.31 7.47 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.037 -0.529 . . . . 1.63 111.109 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -90.62 -25.16 20.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.007 -0.542 . . . . 2.02 111.263 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.446 ' HB3' HD23 ' A' ' 12' ' ' LEU . 96.0 mt -83.64 -68.32 0.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.324 -0.398 . . . . 0.18 111.61 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.549 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.26 -67.82 0.69 Allowed 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 112.009 0.374 . . . . 0.3 112.009 -179.636 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.662 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.4 tppp? . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.113 -0.946 . . . . 1.46 110.766 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.56 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.6 mtmm . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.891 0.377 . . . . 1.15 111.293 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -102.75 -70.59 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.486 -0.931 . . . . 2.0 108.486 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 42.8 mm -90.84 -32.55 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 108.834 -0.802 . . . . 0.56 108.834 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.507 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.2 mp -68.05 -10.41 53.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.245 -0.889 . . . . 1.43 109.931 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.505 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.3 t -74.89 -64.91 0.94 Allowed 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.845 -0.616 . . . . 0.1 110.026 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -59.13 -24.68 63.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.537 -0.912 . . . . 2.09 108.537 178.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.505 HG23 ' HG ' ' A' ' 12' ' ' LEU . 11.5 mm -80.03 -34.27 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 114.74 -1.118 . . . . 0.16 110.332 178.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.656 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.1 tttt -46.37 -36.14 6.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.856 -0.611 . . . . 1.63 110.945 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -90.9 -25.17 19.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.847 -0.615 . . . . 2.02 111.266 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.484 HD12 HD13 ' A' ' 8' ' ' ILE . 82.5 mt -77.47 -66.82 0.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.18 111.281 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.544 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -136.36 -64.58 0.6 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.486 -0.325 . . . . 0.3 111.76 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.656 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.1 tppp? . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.377 -0.821 . . . . 1.46 110.861 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.556 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 31.9 mtmm . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.722 0.296 . . . . 1.15 110.976 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -98.52 -68.88 0.78 Allowed 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.222 -1.029 . . . . 2.0 108.222 178.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -91.36 -32.92 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 115.385 -0.825 . . . . 0.56 108.919 177.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.446 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.6 mt -67.08 -10.9 54.88 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.146 -0.934 . . . . 1.43 110.466 179.185 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.535 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.5 t -75.65 -66.77 0.74 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.962 -0.563 . . . . 0.1 110.054 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -57.67 -23.98 54.29 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.717 -0.846 . . . . 2.09 108.717 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.537 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.5 mm -81.25 -35.01 13.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 114.826 -1.079 . . . . 0.16 110.577 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.685 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 18.9 tttm -46.6 -32.3 3.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.975 -0.557 . . . . 1.63 111.067 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -90.85 -26.77 19.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 2.02 111.372 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.576 ' HB3' HD23 ' A' ' 12' ' ' LEU . 99.6 mt -80.22 -68.2 0.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.18 111.695 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.576 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -131.87 -67.61 0.67 Allowed 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.801 0.297 . . . . 0.3 111.801 -179.528 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.685 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.344 -0.836 . . . . 1.46 110.767 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.561 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 33.4 mtmm . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.927 0.394 . . . . 1.15 111.255 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -105.26 -70.21 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.535 -0.913 . . . . 2.0 108.535 178.296 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.0 mm -90.95 -32.69 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 108.844 -0.798 . . . . 0.56 108.844 177.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.494 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mm? -69.48 -10.49 58.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.209 -0.905 . . . . 1.43 109.782 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.493 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.2 t -74.46 -65.77 0.82 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.746 -0.661 . . . . 0.1 109.916 179.515 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -58.3 -23.99 58.19 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.695 -0.854 . . . . 2.09 108.695 178.267 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.568 HG23 ' HG ' ' A' ' 12' ' ' LEU . 11.6 mm -80.55 -34.88 14.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 114.9 -1.045 . . . . 0.16 110.458 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.674 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 16.0 tttm -47.11 -34.42 6.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.731 -0.668 . . . . 1.63 111.159 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -90.63 -25.58 20.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.942 -0.572 . . . . 2.02 111.304 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.437 HD12 HD13 ' A' ' 8' ' ' ILE . 96.2 mt -79.87 -68.02 0.71 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.278 -0.419 . . . . 0.18 111.433 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.568 ' HG ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -130.63 -70.33 0.62 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.77 0.285 . . . . 0.3 111.77 -179.627 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.674 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.9 tppp? . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.285 -0.865 . . . . 1.46 110.788 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.553 ' HE3' ' HD3' ' A' ' 9' ' ' LYS . 34.7 mtmm . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.85 0.357 . . . . 1.15 111.206 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -101.81 -69.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.349 -0.982 . . . . 2.0 108.349 178.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -91.1 -34.38 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 108.783 -0.821 . . . . 0.56 108.783 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.53 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.7 mp -66.92 -10.55 50.09 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.247 -0.888 . . . . 1.43 110.144 178.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.52 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 44.2 t -75.13 -64.21 1.1 Allowed 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.986 -0.552 . . . . 0.1 109.863 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -59.08 -25.23 63.6 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.482 -0.933 . . . . 2.09 108.482 178.159 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.7 mm -79.01 -35.21 17.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 114.851 -1.068 . . . . 0.16 110.468 178.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.65 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.5 ttpp -47.24 -34.17 6.22 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.854 -0.612 . . . . 1.63 110.843 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -90.95 -25.67 19.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.886 -0.597 . . . . 2.02 111.175 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.554 ' HB3' HD23 ' A' ' 12' ' ' LEU . 87.2 mt -79.09 -67.63 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.18 111.534 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.554 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -133.99 -67.3 0.59 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.508 -0.315 . . . . 0.3 111.765 -179.689 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.65 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.3 tppp? . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.316 -0.85 . . . . 1.46 110.804 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.536 ' HE2' ' HG3' ' A' ' 9' ' ' LYS . 61.0 mttp . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.848 0.356 . . . . 1.15 111.16 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -104.51 -70.44 0.77 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.549 -0.908 . . . . 2.0 108.549 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.1 mm -90.99 -29.42 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 108.841 -0.8 . . . . 0.56 108.841 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.603 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 2.6 mm? -72.75 -10.16 59.47 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.139 -0.937 . . . . 1.43 109.591 178.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.507 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 40.8 t -76.22 -66.17 0.83 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.607 -0.724 . . . . 0.1 109.855 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -54.12 -28.18 38.08 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.513 -0.921 . . . . 2.09 108.513 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.513 HG22 ' HD3' ' A' ' 13' ' ' LYS . 15.9 mm -77.43 -37.39 24.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.768 -1.105 . . . . 0.16 110.758 178.743 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.561 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.5 tttm -50.38 -37.06 35.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.017 -0.538 . . . . 1.63 111.251 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -91.23 -29.44 17.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 2.02 111.994 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.581 ' HB3' HD23 ' A' ' 12' ' ' LEU . 69.0 mt -75.87 -67.36 0.68 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.688 -0.233 . . . . 0.18 111.533 -179.161 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.581 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -129.12 -68.33 0.74 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.516 -0.311 . . . . 0.3 111.449 -179.794 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.603 ' HE2' ' HB3' ' A' ' 5' ' ' LEU . 13.5 tptp . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.345 -0.836 . . . . 1.46 111.161 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.576 ' HD3' ' HE3' ' A' ' 13' ' ' LYS . 9.9 mtmp? . . . . . 0 CA--C 1.527 0.087 0 CA-C-O 120.987 0.422 . . . . 1.15 111.231 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -104.22 -68.81 0.83 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.561 -0.903 . . . . 2.0 108.561 178.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.7 mm -90.88 -33.33 5.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 108.768 -0.827 . . . . 0.56 108.768 177.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.49 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.0 mm? -69.38 -10.45 58.01 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.182 -0.917 . . . . 1.43 109.832 178.797 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.535 ' HA ' ' HZ2' ' A' ' 2' ' ' LYS . 48.4 t -74.85 -65.88 0.82 Allowed 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.728 -0.669 . . . . 0.1 109.809 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -57.34 -25.28 59.16 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.598 -0.89 . . . . 2.09 108.598 178.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.49 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.7 mm -78.38 -36.39 20.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 114.926 -1.033 . . . . 0.16 110.474 178.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 5' ' ' LEU . 14.8 tttt -51.04 -31.32 18.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.002 -0.544 . . . . 1.63 111.044 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -90.23 -24.51 20.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 2.02 110.894 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.526 ' HB3' HD23 ' A' ' 12' ' ' LEU . 97.0 mt -84.0 -68.56 0.71 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.18 111.422 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.526 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -133.04 -73.63 0.5 Allowed 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.098 0.407 . . . . 0.3 112.098 -179.859 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.576 ' HE3' ' HD3' ' A' ' 2' ' ' LYS . 9.7 ttmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.174 -0.917 . . . . 1.46 110.799 -178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 78.8 mt . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.821 0.343 . . . . 2.53 111.143 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.543 ' HZ3' ' HA ' ' A' ' 6' ' ' SER . 9.7 mtmp? -72.06 133.0 45.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 1.15 110.956 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -99.56 -69.96 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.432 -0.951 . . . . 2.0 108.432 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.3 mm -91.04 -32.74 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 N-CA-C 108.999 -0.741 . . . . 0.56 108.999 177.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.467 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.3 mp -67.77 -10.51 53.34 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.159 -0.928 . . . . 1.43 110.136 178.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.543 ' HA ' ' HZ3' ' A' ' 2' ' ' LYS . 41.2 t -76.9 -64.18 1.19 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.814 -0.63 . . . . 0.1 109.886 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -57.34 -25.14 58.94 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.526 -0.916 . . . . 2.09 108.526 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.513 HG23 ' HG ' ' A' ' 12' ' ' LEU . 14.3 mm -80.98 -35.83 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 114.624 -1.171 . . . . 0.16 110.91 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.674 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 26.5 tttt -48.38 -32.22 7.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.144 -0.48 . . . . 1.63 111.135 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -90.85 -23.82 20.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.046 -0.525 . . . . 2.02 111.394 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.441 ' HB3' HD23 ' A' ' 12' ' ' LEU . 95.8 mt -84.43 -68.2 0.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.356 -0.384 . . . . 0.18 111.563 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.531 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.49 -68.25 0.66 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 111.847 0.314 . . . . 0.3 111.847 -179.67 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.674 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.9 tppp? . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.192 -0.908 . . . . 1.46 110.877 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 81.9 mt . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.734 0.302 . . . . 2.53 111.087 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.528 ' HB3' ' N ' ' A' ' 6' ' ' SER . 35.8 mtmm -98.25 133.91 42.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.289 -0.414 . . . . 1.15 111.334 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -101.2 -70.4 0.74 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.218 -1.03 . . . . 2.0 108.218 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.5 mm -91.1 -32.78 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 108.72 -0.844 . . . . 0.56 108.72 177.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.489 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.7 mp -67.51 -10.52 52.43 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.185 -0.916 . . . . 1.43 110.136 178.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.528 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.3 t -74.34 -65.88 0.8 Allowed 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.882 -0.599 . . . . 0.1 110.288 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -59.98 -23.36 63.56 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.7 -0.852 . . . . 2.09 108.7 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.519 HD13 HD12 ' A' ' 11' ' ' LEU . 10.7 mm -80.2 -34.08 14.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.919 -1.037 . . . . 0.16 110.311 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.69 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 14.5 tttm -47.37 -34.53 7.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.798 -0.637 . . . . 1.63 110.919 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -90.92 -25.06 19.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.964 -0.562 . . . . 2.02 111.212 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.541 ' HB3' HD23 ' A' ' 12' ' ' LEU . 98.5 mt -78.84 -66.93 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.308 -0.406 . . . . 0.18 111.338 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.541 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -135.43 -64.57 0.63 Allowed 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 111.791 0.293 . . . . 0.3 111.791 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.69 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.355 -0.831 . . . . 1.46 110.825 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 41.7 mm . . . . . 0 N--CA 1.484 1.263 0 CA-C-O 120.809 0.338 . . . . 2.53 110.975 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.509 ' HB3' ' N ' ' A' ' 6' ' ' SER . 31.8 mtmm -94.75 137.67 33.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.095 -0.502 . . . . 1.15 111.197 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -103.1 -71.37 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.319 -0.993 . . . . 2.0 108.319 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 43.0 mm -91.04 -31.14 4.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 108.667 -0.864 . . . . 0.56 108.667 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.466 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.4 mm? -68.63 -10.51 56.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.179 -0.919 . . . . 1.43 109.812 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.509 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 47.0 t -76.68 -63.72 1.28 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.758 -0.655 . . . . 0.1 109.72 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.88 -24.85 59.51 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.523 -0.917 . . . . 2.09 108.523 178.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.466 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.1 mm -80.26 -36.08 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 CA-C-N 114.78 -1.1 . . . . 0.16 110.522 179.031 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.483 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 8.2 tttp -49.94 -31.81 13.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.014 -0.539 . . . . 1.63 111.118 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -90.28 -23.69 21.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.898 -0.592 . . . . 2.02 111.036 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.509 ' HB3' HD23 ' A' ' 12' ' ' LEU . 96.3 mt -84.92 -67.78 0.77 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.18 111.452 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.533 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -134.62 -69.94 0.51 Allowed 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.169 0.433 . . . . 0.3 112.169 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.533 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 12.3 ttmm . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.161 -0.923 . . . . 1.46 110.836 -178.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.466 ' N ' HD12 ' A' ' 1' ' ' ILE . 4.6 mp . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.929 0.395 . . . . 2.53 110.841 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.2 mtmm -95.05 137.95 33.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.173 -0.467 . . . . 1.15 111.169 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -104.32 -68.61 0.84 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.613 -0.884 . . . . 2.0 108.613 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.478 HG23 ' HE2' ' A' ' 7' ' ' LYS . 43.7 mm -90.95 -34.18 6.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 108.977 -0.749 . . . . 0.56 108.977 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.48 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.1 mp -68.26 -10.69 56.44 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.333 -0.848 . . . . 1.43 110.022 178.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.496 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.5 t -76.18 -64.96 0.98 Allowed 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 115.814 -0.63 . . . . 0.1 109.957 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.478 ' HE2' HG23 ' A' ' 4' ' ' ILE . 65.0 pttt -56.6 -24.85 50.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.496 -0.928 . . . . 2.09 108.496 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.492 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.5 mm -80.56 -35.74 15.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 114.564 -1.198 . . . . 0.16 110.769 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.667 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 20.8 tttt -49.39 -31.97 10.62 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.039 -0.528 . . . . 1.63 111.153 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -90.62 -23.33 20.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.043 -0.526 . . . . 2.02 111.164 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.538 ' HB3' HD23 ' A' ' 12' ' ' LEU . 97.5 mt -85.11 -68.7 0.71 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.18 111.591 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.538 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -131.21 -69.44 0.63 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.559 -0.292 . . . . 0.3 111.78 -179.622 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.667 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.286 -0.864 . . . . 1.46 110.881 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 45.4 mm . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 120.769 0.318 . . . . 2.53 110.957 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.552 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 35.6 mtmm -82.47 132.68 35.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.152 -0.476 . . . . 1.15 111.218 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -100.91 -70.4 0.74 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.216 -1.031 . . . . 2.0 108.216 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 41.9 mm -91.03 -30.8 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 108.825 -0.806 . . . . 0.56 108.825 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.458 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mt -68.85 -11.09 60.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.091 -0.958 . . . . 1.43 109.985 178.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.524 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.8 t -76.51 -63.67 1.29 Allowed 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.571 -0.741 . . . . 0.1 109.804 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.438 ' NZ ' ' HB3' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -57.67 -25.42 60.22 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.435 -0.95 . . . . 2.09 108.435 178.127 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.458 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.7 mm -78.97 -36.33 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 114.792 -1.094 . . . . 0.16 110.387 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.669 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 21.3 tttt -49.42 -31.69 10.21 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.009 -0.541 . . . . 1.63 111.007 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -90.81 -26.18 19.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.005 -0.543 . . . . 2.02 111.128 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.533 ' HB3' HD23 ' A' ' 12' ' ' LEU . 98.0 mt -80.78 -69.05 0.63 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.439 . . . . 0.18 111.443 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.533 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -131.89 -68.45 0.64 Allowed 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.857 0.317 . . . . 0.3 111.857 -179.619 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.669 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.4 tppp? . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.141 -0.933 . . . . 1.46 110.835 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 54.0 mt . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.918 0.389 . . . . 2.53 110.941 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.492 ' HB3' ' N ' ' A' ' 6' ' ' SER . 32.7 mtmm -86.03 139.39 31.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 1.15 111.346 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -105.86 -71.59 0.74 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.659 -0.867 . . . . 2.0 108.659 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.4 mm -90.95 -32.35 5.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.857 -0.794 . . . . 0.56 108.857 177.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.499 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.6 mm? -69.1 -10.38 57.31 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.015 -0.993 . . . . 1.43 109.453 178.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.492 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 32.5 t -74.15 -63.66 1.18 Allowed 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.322 -0.854 . . . . 0.1 109.879 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -57.7 -26.82 62.27 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.429 -0.952 . . . . 2.09 108.429 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.543 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.6 mm -75.93 -36.93 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.811 -1.086 . . . . 0.16 110.522 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -52.57 -36.16 55.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.867 -0.606 . . . . 1.63 111.275 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -91.02 -18.91 23.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 2.02 111.151 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.574 ' HB3' HD23 ' A' ' 12' ' ' LEU . 58.3 mt -87.16 -67.98 0.78 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.32 -0.4 . . . . 0.18 111.208 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.574 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -126.67 -84.31 0.62 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.522 -0.308 . . . . 0.3 111.786 -179.797 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.446 ' HB2' HG22 ' A' ' 8' ' ' ILE . 20.1 ttmm . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.447 -0.787 . . . . 1.46 111.141 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.452 ' N ' HD12 ' A' ' 1' ' ' ILE . 4.8 mp . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.766 0.317 . . . . 2.53 110.949 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.57 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 35.1 mtmm -64.02 136.09 57.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 1.15 111.204 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -98.92 -72.29 0.66 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.99 -1.115 . . . . 2.0 107.99 178.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.9 mm -91.42 -29.52 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 115.498 -0.774 . . . . 0.56 108.964 177.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.434 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 4.3 mt -67.83 -11.65 59.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.274 -0.875 . . . . 1.43 110.177 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.482 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.9 t -77.22 -64.45 1.14 Allowed 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.831 -0.622 . . . . 0.1 110.101 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -56.49 -25.0 49.85 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.548 -0.908 . . . . 2.09 108.548 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.523 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.9 mm -79.63 -36.95 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 114.746 -1.115 . . . . 0.16 110.698 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.686 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 7.5 tttp -50.54 -31.16 14.82 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.075 -0.511 . . . . 1.63 111.216 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -90.69 -23.72 20.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.122 -0.49 . . . . 2.02 111.2 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.453 ' HB3' HD23 ' A' ' 12' ' ' LEU . 97.1 mt -86.45 -68.59 0.73 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.18 111.556 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.525 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -129.23 -71.23 0.63 Allowed 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.963 0.357 . . . . 0.3 111.963 -179.628 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.686 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.8 tppp? . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.238 -0.887 . . . . 1.46 110.913 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 79.5 mt . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.815 0.34 . . . . 2.53 110.983 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.503 ' HB3' ' N ' ' A' ' 6' ' ' SER . 35.9 mtmm -81.32 136.27 35.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.159 -0.473 . . . . 1.15 111.33 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -102.79 -71.49 0.72 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.294 -1.002 . . . . 2.0 108.294 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.561 ' N ' HD12 ' A' ' 4' ' ' ILE . 3.4 mp -90.18 -32.68 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 108.988 -0.745 . . . . 0.56 108.988 177.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.473 HD22 ' N ' ' A' ' 5' ' ' LEU . 3.1 mm? -68.07 -10.68 55.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.27 -0.877 . . . . 1.43 110.114 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.503 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.7 t -74.96 -67.8 0.61 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.019 -0.537 . . . . 0.1 110.269 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.476 ' HZ3' ' HA ' ' A' ' 4' ' ' ILE . 25.1 pttm -57.67 -23.55 52.02 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.849 -0.797 . . . . 2.09 108.849 178.464 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.438 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.9 mm -79.86 -35.55 16.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.001 -1.0 . . . . 0.16 110.377 178.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.526 ' HA ' ' HB3' ' A' ' 13' ' ' LYS . 4.7 tttp -50.29 -30.02 10.97 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.994 -0.548 . . . . 1.63 111.077 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -90.68 -23.94 20.6 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.008 -0.542 . . . . 2.02 111.065 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.0 mt -87.45 -69.24 0.7 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.18 111.749 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.13 -74.61 0.65 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.478 -0.328 . . . . 0.3 111.735 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.526 ' HB3' ' HA ' ' A' ' 9' ' ' LYS . 23.5 ttpp . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.252 -0.88 . . . . 1.46 111.839 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 59.2 mt . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 120.82 0.343 . . . . 2.53 110.964 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.513 ' HB3' ' N ' ' A' ' 6' ' ' SER . 56.8 mttm -118.01 134.09 55.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 1.15 111.22 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -104.56 -72.67 0.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.41 -0.959 . . . . 2.0 108.41 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.577 HG23 ' HE2' ' A' ' 7' ' ' LYS . 39.4 mm -90.72 -29.23 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 108.35 -0.981 . . . . 0.56 108.35 177.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 9' ' ' LYS . 3.9 mm? -71.14 -9.8 58.68 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.838 -1.073 . . . . 1.43 109.636 178.367 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.513 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 45.7 t -76.63 -65.52 0.93 Allowed 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.483 -0.78 . . . . 0.1 110.045 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.577 ' HE2' HG23 ' A' ' 4' ' ' ILE . 62.7 pttt -56.49 -24.58 47.13 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.431 -0.951 . . . . 2.09 108.431 178.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.425 HD13 ' HA ' ' A' ' 8' ' ' ILE . 10.8 mm -81.7 -36.35 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 114.76 -1.109 . . . . 0.16 110.744 178.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.499 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.7 tttm -48.26 -35.07 11.37 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.284 -0.416 . . . . 1.63 110.882 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -90.42 -25.77 20.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.889 -0.596 . . . . 2.02 111.279 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.541 ' HB3' HD23 ' A' ' 12' ' ' LEU . 79.3 mt -77.54 -67.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.18 111.149 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.541 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -139.09 -65.14 0.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.044 0.387 . . . . 0.3 112.044 -179.744 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.54 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 12.4 ttmm . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.155 -0.926 . . . . 1.46 110.797 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 7.3 tp . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.785 0.326 . . . . 2.53 111.045 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.564 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.8 mtmm -92.44 134.21 35.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 1.15 111.24 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -102.15 -69.95 0.77 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.474 -0.936 . . . . 2.0 108.474 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -90.75 -33.19 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 108.732 -0.84 . . . . 0.56 108.732 177.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.5 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.1 mp -68.02 -10.5 54.2 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.069 -0.969 . . . . 1.43 109.951 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.517 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 44.2 t -74.73 -64.84 0.95 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.854 -0.612 . . . . 0.1 110.094 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -59.56 -23.86 63.25 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.638 -0.875 . . . . 2.09 108.638 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.513 HG23 ' HG ' ' A' ' 12' ' ' LEU . 12.6 mm -80.7 -34.25 14.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 114.816 -1.084 . . . . 0.16 110.549 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.693 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.0 ttpp -47.26 -33.87 5.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.771 -0.649 . . . . 1.63 111.139 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -90.6 -25.68 20.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.047 -0.524 . . . . 2.02 111.389 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.51 HD12 HD13 ' A' ' 8' ' ' ILE . 93.7 mt -80.41 -67.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.488 -0.324 . . . . 0.18 111.483 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.513 ' HG ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -133.07 -66.29 0.67 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.888 0.329 . . . . 0.3 111.888 -179.604 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.693 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 3.3 tppp? . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.177 -0.916 . . . . 1.46 110.821 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 38.4 mm . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 120.923 0.392 . . . . 2.53 110.747 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.481 ' HB3' ' N ' ' A' ' 6' ' ' SER . 9.0 mtmp? -64.98 138.67 58.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.896 -0.593 . . . . 1.15 111.43 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -108.14 -71.95 0.74 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.662 -0.866 . . . . 2.0 108.662 178.4 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.1 mm -90.79 -31.8 5.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.634 -0.876 . . . . 0.56 108.634 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.519 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mm? -70.27 -10.3 58.52 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.134 -0.939 . . . . 1.43 109.257 178.395 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.481 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 36.8 t -72.39 -65.67 0.75 Allowed 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.369 -0.832 . . . . 0.1 109.959 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -58.83 -24.98 62.76 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.628 -0.879 . . . . 2.09 108.628 178.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.519 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.5 mm -76.62 -36.51 27.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.062 -0.972 . . . . 0.16 110.35 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -52.46 -33.24 43.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.734 -0.666 . . . . 1.63 110.944 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -91.32 -23.77 20.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.995 -0.548 . . . . 2.02 110.939 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.633 ' HB3' HD23 ' A' ' 12' ' ' LEU . 68.9 mt -81.31 -69.35 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.073 -0.512 . . . . 0.18 111.369 -179.476 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.633 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -129.69 -78.35 0.55 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.529 -0.305 . . . . 0.3 111.719 -179.659 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.496 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 17.1 ttmm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.414 -0.803 . . . . 1.46 111.115 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 71.8 mt . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.807 0.337 . . . . 2.53 111.103 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.543 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 31.1 mtmm -89.18 137.8 31.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 1.15 111.261 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -103.12 -70.02 0.77 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.621 -0.881 . . . . 2.0 108.621 178.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.478 HG23 ' NZ ' ' A' ' 7' ' ' LYS . 46.7 mm -90.95 -33.06 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 108.772 -0.825 . . . . 0.56 108.772 177.55 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.543 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 3.7 mm? -68.79 -10.37 56.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.281 -0.872 . . . . 1.43 109.932 178.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.53 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.8 t -73.65 -68.05 0.54 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.926 -0.579 . . . . 0.1 110.351 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.478 ' NZ ' HG23 ' A' ' 4' ' ' ILE . 23.9 pttm -57.91 -24.74 59.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.721 -0.844 . . . . 2.09 108.721 178.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.55 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.4 mm -78.76 -35.15 17.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 114.882 -1.054 . . . . 0.16 110.44 178.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.663 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 28.4 tttt -47.4 -33.72 6.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.827 -0.624 . . . . 1.63 111.137 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -90.66 -27.42 19.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 2.02 111.445 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.448 ' HB3' HD23 ' A' ' 12' ' ' LEU . 95.3 mt -79.67 -67.99 0.71 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.279 -0.419 . . . . 0.18 111.584 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.55 ' HG ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -130.72 -69.54 0.64 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.797 0.295 . . . . 0.3 111.797 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.663 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.0 tppp? . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.176 -0.916 . . . . 1.46 110.807 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 46.8 mt . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 120.809 0.338 . . . . 2.53 110.81 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.545 ' HB3' ' N ' ' A' ' 6' ' ' SER . 34.3 mtmm -64.87 130.84 44.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 1.15 111.368 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -101.19 -70.71 0.73 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.215 -1.031 . . . . 2.0 108.215 178.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 40.1 mm -91.42 -32.92 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 108.558 -0.904 . . . . 0.56 108.558 177.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.532 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.9 mt -66.59 -10.99 51.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.276 -0.874 . . . . 1.43 109.825 178.62 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.545 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.4 t -74.48 -62.91 1.36 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.554 -0.748 . . . . 0.1 109.735 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -60.04 -24.73 64.77 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.536 -0.912 . . . . 2.09 108.536 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.532 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 15.1 mm -77.37 -37.21 24.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.914 -1.039 . . . . 0.16 110.462 178.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.472 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 13.0 tttt -52.08 -32.76 36.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.682 -0.69 . . . . 1.63 111.167 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -91.18 -24.55 19.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.055 -0.52 . . . . 2.02 111.119 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.543 ' HB3' HD23 ' A' ' 12' ' ' LEU . 88.3 mt -83.73 -69.9 0.6 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.132 -0.486 . . . . 0.18 111.392 -179.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.543 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -126.46 -77.74 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.004 0.372 . . . . 0.3 112.004 -179.432 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.485 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 13.6 ttmm . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.104 -0.951 . . . . 1.46 110.956 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 60.3 mt . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 120.829 0.347 . . . . 2.53 111.082 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.533 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 31.8 mtmm -83.81 137.8 33.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 1.15 111.379 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -102.63 -69.47 0.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.472 -0.936 . . . . 2.0 108.472 178.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.5 mm -91.2 -33.56 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 115.476 -0.784 . . . . 0.56 108.98 177.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.493 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.0 mp -68.14 -10.57 55.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.358 -0.837 . . . . 1.43 110.134 178.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.512 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.5 t -75.58 -65.34 0.91 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.827 -0.624 . . . . 0.1 110.032 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -56.89 -25.72 57.57 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 108.551 -0.907 . . . . 2.09 108.551 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.515 HG23 ' HG ' ' A' ' 12' ' ' LEU . 14.8 mm -79.59 -35.75 16.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.7 -1.136 . . . . 0.16 110.74 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.662 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.7 ttpp -48.41 -32.31 7.47 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.037 -0.529 . . . . 1.63 111.109 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -90.62 -25.16 20.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.007 -0.542 . . . . 2.02 111.263 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.446 ' HB3' HD23 ' A' ' 12' ' ' LEU . 96.0 mt -83.64 -68.32 0.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.324 -0.398 . . . . 0.18 111.61 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.549 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.26 -67.82 0.69 Allowed 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 112.009 0.374 . . . . 0.3 112.009 -179.636 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.662 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.4 tppp? . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.113 -0.946 . . . . 1.46 110.766 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 45.2 mm . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.833 0.349 . . . . 2.53 110.963 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.56 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.6 mtmm -98.9 135.8 39.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.164 -0.471 . . . . 1.15 111.293 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -102.75 -70.59 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.486 -0.931 . . . . 2.0 108.486 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 42.8 mm -90.84 -32.55 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 108.834 -0.802 . . . . 0.56 108.834 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.507 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.2 mp -68.05 -10.41 53.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.245 -0.889 . . . . 1.43 109.931 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.505 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.3 t -74.89 -64.91 0.94 Allowed 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.845 -0.616 . . . . 0.1 110.026 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -59.13 -24.68 63.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.537 -0.912 . . . . 2.09 108.537 178.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.505 HG23 ' HG ' ' A' ' 12' ' ' LEU . 11.5 mm -80.03 -34.27 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 114.74 -1.118 . . . . 0.16 110.332 178.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.656 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.1 tttt -46.37 -36.14 6.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.856 -0.611 . . . . 1.63 110.945 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -90.9 -25.17 19.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.847 -0.615 . . . . 2.02 111.266 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.484 HD12 HD13 ' A' ' 8' ' ' ILE . 82.5 mt -77.47 -66.82 0.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.18 111.281 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.544 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -136.36 -64.58 0.6 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.486 -0.325 . . . . 0.3 111.76 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.656 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.1 tppp? . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.377 -0.821 . . . . 1.46 110.861 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 83.9 mt . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 120.738 0.304 . . . . 2.53 111.208 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.556 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 31.9 mtmm -92.75 131.78 37.52 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.224 -0.444 . . . . 1.15 110.976 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -98.52 -68.88 0.78 Allowed 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.222 -1.029 . . . . 2.0 108.222 178.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -91.36 -32.92 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 115.385 -0.825 . . . . 0.56 108.919 177.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.446 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.6 mt -67.08 -10.9 54.88 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.146 -0.934 . . . . 1.43 110.466 179.185 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.535 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.5 t -75.65 -66.77 0.74 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.962 -0.563 . . . . 0.1 110.054 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -57.67 -23.98 54.29 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.717 -0.846 . . . . 2.09 108.717 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.537 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.5 mm -81.25 -35.01 13.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 114.826 -1.079 . . . . 0.16 110.577 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.685 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 18.9 tttm -46.6 -32.3 3.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.975 -0.557 . . . . 1.63 111.067 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -90.85 -26.77 19.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 2.02 111.372 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.576 ' HB3' HD23 ' A' ' 12' ' ' LEU . 99.6 mt -80.22 -68.2 0.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.18 111.695 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.576 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -131.87 -67.61 0.67 Allowed 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.801 0.297 . . . . 0.3 111.801 -179.528 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.685 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.344 -0.836 . . . . 1.46 110.767 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 24.3 mt . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.969 0.414 . . . . 2.53 111.039 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.561 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 33.4 mtmm -82.5 140.03 33.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.495 . . . . 1.15 111.255 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -105.26 -70.21 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.535 -0.913 . . . . 2.0 108.535 178.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.0 mm -90.95 -32.69 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 108.844 -0.798 . . . . 0.56 108.844 177.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.494 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mm? -69.48 -10.49 58.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.209 -0.905 . . . . 1.43 109.782 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.493 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.2 t -74.46 -65.77 0.82 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.746 -0.661 . . . . 0.1 109.916 179.515 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -58.3 -23.99 58.19 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.695 -0.854 . . . . 2.09 108.695 178.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.568 HG23 ' HG ' ' A' ' 12' ' ' LEU . 11.6 mm -80.55 -34.88 14.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 114.9 -1.045 . . . . 0.16 110.458 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.674 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 16.0 tttm -47.11 -34.42 6.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.731 -0.668 . . . . 1.63 111.159 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -90.63 -25.58 20.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.942 -0.572 . . . . 2.02 111.304 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.437 HD12 HD13 ' A' ' 8' ' ' ILE . 96.2 mt -79.87 -68.02 0.71 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.278 -0.419 . . . . 0.18 111.433 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.568 ' HG ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -130.63 -70.33 0.62 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.77 0.285 . . . . 0.3 111.77 -179.627 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.674 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.9 tppp? . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.285 -0.865 . . . . 1.46 110.788 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 44.7 mm . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.795 0.331 . . . . 2.53 110.939 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.553 ' HE3' ' HD3' ' A' ' 9' ' ' LYS . 34.7 mtmm -82.06 133.61 35.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.285 -0.416 . . . . 1.15 111.206 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -101.81 -69.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.349 -0.982 . . . . 2.0 108.349 178.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -91.1 -34.38 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 108.783 -0.821 . . . . 0.56 108.783 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.53 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.7 mp -66.92 -10.55 50.09 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.247 -0.888 . . . . 1.43 110.144 178.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.52 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 44.2 t -75.13 -64.21 1.1 Allowed 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.986 -0.552 . . . . 0.1 109.863 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -59.08 -25.23 63.6 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.482 -0.933 . . . . 2.09 108.482 178.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.7 mm -79.01 -35.21 17.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 114.851 -1.068 . . . . 0.16 110.468 178.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.65 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.5 ttpp -47.24 -34.17 6.22 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.854 -0.612 . . . . 1.63 110.843 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -90.95 -25.67 19.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.886 -0.597 . . . . 2.02 111.175 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.554 ' HB3' HD23 ' A' ' 12' ' ' LEU . 87.2 mt -79.09 -67.63 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.18 111.534 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.554 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -133.99 -67.3 0.59 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.508 -0.315 . . . . 0.3 111.765 -179.689 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.65 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.3 tppp? . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.316 -0.85 . . . . 1.46 110.804 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 79.2 mt . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.667 0.27 . . . . 2.53 111.082 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.536 ' HE2' ' HG3' ' A' ' 9' ' ' LYS . 61.0 mttp -82.3 132.08 35.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.368 -0.378 . . . . 1.15 111.16 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -104.51 -70.44 0.77 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.549 -0.908 . . . . 2.0 108.549 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.1 mm -90.99 -29.42 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 108.841 -0.8 . . . . 0.56 108.841 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.603 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 2.6 mm? -72.75 -10.16 59.47 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.139 -0.937 . . . . 1.43 109.591 178.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.507 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 40.8 t -76.22 -66.17 0.83 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.607 -0.724 . . . . 0.1 109.855 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -54.12 -28.18 38.08 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.513 -0.921 . . . . 2.09 108.513 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.513 HG22 ' HD3' ' A' ' 13' ' ' LYS . 15.9 mm -77.43 -37.39 24.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.768 -1.105 . . . . 0.16 110.758 178.743 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.561 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.5 tttm -50.38 -37.06 35.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.017 -0.538 . . . . 1.63 111.251 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -91.23 -29.44 17.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 2.02 111.994 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.581 ' HB3' HD23 ' A' ' 12' ' ' LEU . 69.0 mt -75.87 -67.36 0.68 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.688 -0.233 . . . . 0.18 111.533 -179.161 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.581 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -129.12 -68.33 0.74 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.516 -0.311 . . . . 0.3 111.449 -179.794 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.603 ' HE2' ' HB3' ' A' ' 5' ' ' LEU . 13.5 tptp . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.345 -0.836 . . . . 1.46 111.161 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 60.8 mt . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 120.862 0.363 . . . . 2.53 111.049 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.576 ' HD3' ' HE3' ' A' ' 13' ' ' LYS . 9.9 mtmp? -95.22 134.02 38.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.078 -0.51 . . . . 1.15 111.231 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -104.22 -68.81 0.83 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.561 -0.903 . . . . 2.0 108.561 178.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.7 mm -90.88 -33.33 5.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 108.768 -0.827 . . . . 0.56 108.768 177.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.49 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.0 mm? -69.38 -10.45 58.01 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.182 -0.917 . . . . 1.43 109.832 178.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.535 ' HA ' ' HZ2' ' A' ' 2' ' ' LYS . 48.4 t -74.85 -65.88 0.82 Allowed 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.728 -0.669 . . . . 0.1 109.809 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -57.34 -25.28 59.16 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.598 -0.89 . . . . 2.09 108.598 178.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.49 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.7 mm -78.38 -36.39 20.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 114.926 -1.033 . . . . 0.16 110.474 178.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 5' ' ' LEU . 14.8 tttt -51.04 -31.32 18.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.002 -0.544 . . . . 1.63 111.044 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -90.23 -24.51 20.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 2.02 110.894 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.526 ' HB3' HD23 ' A' ' 12' ' ' LEU . 97.0 mt -84.0 -68.56 0.71 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.18 111.422 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.526 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -133.04 -73.63 0.5 Allowed 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.098 0.407 . . . . 0.3 112.098 -179.859 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.576 ' HE3' ' HD3' ' A' ' 2' ' ' LYS . 9.7 ttmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.174 -0.917 . . . . 1.46 110.799 -178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.543 ' HZ3' ' HA ' ' A' ' 6' ' ' SER . 9.7 mtmp? . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.862 0.363 . . . . 1.15 110.956 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -99.56 -69.96 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.432 -0.951 . . . . 2.0 108.432 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.3 mm -91.04 -32.74 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 N-CA-C 108.999 -0.741 . . . . 0.56 108.999 177.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.467 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.3 mp -67.77 -10.51 53.34 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.159 -0.928 . . . . 1.43 110.136 178.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.543 ' HA ' ' HZ3' ' A' ' 2' ' ' LYS . 41.2 t -76.9 -64.18 1.19 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.814 -0.63 . . . . 0.1 109.886 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -57.34 -25.14 58.94 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.526 -0.916 . . . . 2.09 108.526 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.513 HG23 ' HG ' ' A' ' 12' ' ' LEU . 14.3 mm -80.98 -35.83 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 114.624 -1.171 . . . . 0.16 110.91 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.674 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 26.5 tttt -48.38 -32.22 7.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.144 -0.48 . . . . 1.63 111.135 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -90.85 -23.82 20.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.046 -0.525 . . . . 2.02 111.394 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.441 ' HB3' HD23 ' A' ' 12' ' ' LEU . 95.8 mt -84.43 -68.2 0.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.356 -0.384 . . . . 0.18 111.563 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.531 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.49 -68.25 0.66 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 111.847 0.314 . . . . 0.3 111.847 -179.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.674 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.9 tppp? . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.192 -0.908 . . . . 1.46 110.877 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.528 ' HB3' ' N ' ' A' ' 6' ' ' SER . 35.8 mtmm . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.853 0.359 . . . . 1.15 111.334 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -101.2 -70.4 0.74 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.218 -1.03 . . . . 2.0 108.218 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.5 mm -91.1 -32.78 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 108.72 -0.844 . . . . 0.56 108.72 177.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.489 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.7 mp -67.51 -10.52 52.43 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.185 -0.916 . . . . 1.43 110.136 178.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.528 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.3 t -74.34 -65.88 0.8 Allowed 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.882 -0.599 . . . . 0.1 110.288 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -59.98 -23.36 63.56 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.7 -0.852 . . . . 2.09 108.7 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.519 HD13 HD12 ' A' ' 11' ' ' LEU . 10.7 mm -80.2 -34.08 14.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.919 -1.037 . . . . 0.16 110.311 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.69 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 14.5 tttm -47.37 -34.53 7.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.798 -0.637 . . . . 1.63 110.919 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -90.92 -25.06 19.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.964 -0.562 . . . . 2.02 111.212 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.541 ' HB3' HD23 ' A' ' 12' ' ' LEU . 98.5 mt -78.84 -66.93 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.308 -0.406 . . . . 0.18 111.338 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.541 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -135.43 -64.57 0.63 Allowed 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 111.791 0.293 . . . . 0.3 111.791 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.69 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.355 -0.831 . . . . 1.46 110.825 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.509 ' HB3' ' N ' ' A' ' 6' ' ' SER . 31.8 mtmm . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.911 0.386 . . . . 1.15 111.197 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -103.1 -71.37 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.319 -0.993 . . . . 2.0 108.319 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 43.0 mm -91.04 -31.14 4.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 108.667 -0.864 . . . . 0.56 108.667 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.466 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.4 mm? -68.63 -10.51 56.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.179 -0.919 . . . . 1.43 109.812 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.509 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 47.0 t -76.68 -63.72 1.28 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.758 -0.655 . . . . 0.1 109.72 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.88 -24.85 59.51 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.523 -0.917 . . . . 2.09 108.523 178.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.466 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.1 mm -80.26 -36.08 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 CA-C-N 114.78 -1.1 . . . . 0.16 110.522 179.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.483 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 8.2 tttp -49.94 -31.81 13.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.014 -0.539 . . . . 1.63 111.118 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -90.28 -23.69 21.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.898 -0.592 . . . . 2.02 111.036 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.509 ' HB3' HD23 ' A' ' 12' ' ' LEU . 96.3 mt -84.92 -67.78 0.77 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.18 111.452 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.533 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -134.62 -69.94 0.51 Allowed 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.169 0.433 . . . . 0.3 112.169 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.533 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 12.3 ttmm . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.161 -0.923 . . . . 1.46 110.836 -178.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.2 mtmm . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.872 0.368 . . . . 1.15 111.169 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -104.32 -68.61 0.84 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.613 -0.884 . . . . 2.0 108.613 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.478 HG23 ' HE2' ' A' ' 7' ' ' LYS . 43.7 mm -90.95 -34.18 6.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 108.977 -0.749 . . . . 0.56 108.977 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.48 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.1 mp -68.26 -10.69 56.44 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.333 -0.848 . . . . 1.43 110.022 178.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.496 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.5 t -76.18 -64.96 0.98 Allowed 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 115.814 -0.63 . . . . 0.1 109.957 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.478 ' HE2' HG23 ' A' ' 4' ' ' ILE . 65.0 pttt -56.6 -24.85 50.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.496 -0.928 . . . . 2.09 108.496 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.492 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.5 mm -80.56 -35.74 15.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 114.564 -1.198 . . . . 0.16 110.769 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.667 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 20.8 tttt -49.39 -31.97 10.62 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.039 -0.528 . . . . 1.63 111.153 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -90.62 -23.33 20.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.043 -0.526 . . . . 2.02 111.164 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.538 ' HB3' HD23 ' A' ' 12' ' ' LEU . 97.5 mt -85.11 -68.7 0.71 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.18 111.591 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.538 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -131.21 -69.44 0.63 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.559 -0.292 . . . . 0.3 111.78 -179.622 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.667 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.286 -0.864 . . . . 1.46 110.881 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.552 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 35.6 mtmm . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.941 0.4 . . . . 1.15 111.218 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -100.91 -70.4 0.74 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.216 -1.031 . . . . 2.0 108.216 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 41.9 mm -91.03 -30.8 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 108.825 -0.806 . . . . 0.56 108.825 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.458 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mt -68.85 -11.09 60.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.091 -0.958 . . . . 1.43 109.985 178.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.524 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.8 t -76.51 -63.67 1.29 Allowed 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.571 -0.741 . . . . 0.1 109.804 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.438 ' NZ ' ' HB3' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -57.67 -25.42 60.22 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.435 -0.95 . . . . 2.09 108.435 178.127 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.458 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.7 mm -78.97 -36.33 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 114.792 -1.094 . . . . 0.16 110.387 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.669 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 21.3 tttt -49.42 -31.69 10.21 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.009 -0.541 . . . . 1.63 111.007 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -90.81 -26.18 19.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.005 -0.543 . . . . 2.02 111.128 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.533 ' HB3' HD23 ' A' ' 12' ' ' LEU . 98.0 mt -80.78 -69.05 0.63 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.439 . . . . 0.18 111.443 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.533 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -131.89 -68.45 0.64 Allowed 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.857 0.317 . . . . 0.3 111.857 -179.619 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.669 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.4 tppp? . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.141 -0.933 . . . . 1.46 110.835 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.492 ' HB3' ' N ' ' A' ' 6' ' ' SER . 32.7 mtmm . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.934 0.397 . . . . 1.15 111.346 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -105.86 -71.59 0.74 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.659 -0.867 . . . . 2.0 108.659 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.4 mm -90.95 -32.35 5.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.857 -0.794 . . . . 0.56 108.857 177.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.499 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.6 mm? -69.1 -10.38 57.31 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.015 -0.993 . . . . 1.43 109.453 178.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.492 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 32.5 t -74.15 -63.66 1.18 Allowed 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.322 -0.854 . . . . 0.1 109.879 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -57.7 -26.82 62.27 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.429 -0.952 . . . . 2.09 108.429 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.543 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.6 mm -75.93 -36.93 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.811 -1.086 . . . . 0.16 110.522 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -52.57 -36.16 55.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.867 -0.606 . . . . 1.63 111.275 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -91.02 -18.91 23.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 2.02 111.151 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.574 ' HB3' HD23 ' A' ' 12' ' ' LEU . 58.3 mt -87.16 -67.98 0.78 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.32 -0.4 . . . . 0.18 111.208 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.574 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -126.67 -84.31 0.62 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.522 -0.308 . . . . 0.3 111.786 -179.797 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.446 ' HB2' HG22 ' A' ' 8' ' ' ILE . 20.1 ttmm . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.447 -0.787 . . . . 1.46 111.141 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.57 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 35.1 mtmm . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.806 0.336 . . . . 1.15 111.204 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -98.92 -72.29 0.66 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.99 -1.115 . . . . 2.0 107.99 178.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.9 mm -91.42 -29.52 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 115.498 -0.774 . . . . 0.56 108.964 177.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.434 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 4.3 mt -67.83 -11.65 59.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.274 -0.875 . . . . 1.43 110.177 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.482 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.9 t -77.22 -64.45 1.14 Allowed 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.831 -0.622 . . . . 0.1 110.101 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -56.49 -25.0 49.85 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.548 -0.908 . . . . 2.09 108.548 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.523 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.9 mm -79.63 -36.95 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 114.746 -1.115 . . . . 0.16 110.698 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.686 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 7.5 tttp -50.54 -31.16 14.82 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.075 -0.511 . . . . 1.63 111.216 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -90.69 -23.72 20.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.122 -0.49 . . . . 2.02 111.2 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.453 ' HB3' HD23 ' A' ' 12' ' ' LEU . 97.1 mt -86.45 -68.59 0.73 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.18 111.556 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.525 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -129.23 -71.23 0.63 Allowed 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.963 0.357 . . . . 0.3 111.963 -179.628 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.686 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.8 tppp? . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.238 -0.887 . . . . 1.46 110.913 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.503 ' HB3' ' N ' ' A' ' 6' ' ' SER . 35.9 mtmm . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.845 0.355 . . . . 1.15 111.33 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -102.79 -71.49 0.72 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.294 -1.002 . . . . 2.0 108.294 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.561 ' N ' HD12 ' A' ' 4' ' ' ILE . 3.4 mp -90.18 -32.68 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 108.988 -0.745 . . . . 0.56 108.988 177.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.473 HD22 ' N ' ' A' ' 5' ' ' LEU . 3.1 mm? -68.07 -10.68 55.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.27 -0.877 . . . . 1.43 110.114 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.503 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.7 t -74.96 -67.8 0.61 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.019 -0.537 . . . . 0.1 110.269 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.476 ' HZ3' ' HA ' ' A' ' 4' ' ' ILE . 25.1 pttm -57.67 -23.55 52.02 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.849 -0.797 . . . . 2.09 108.849 178.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.438 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.9 mm -79.86 -35.55 16.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.001 -1.0 . . . . 0.16 110.377 178.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.526 ' HA ' ' HB3' ' A' ' 13' ' ' LYS . 4.7 tttp -50.29 -30.02 10.97 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.994 -0.548 . . . . 1.63 111.077 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -90.68 -23.94 20.6 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.008 -0.542 . . . . 2.02 111.065 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.0 mt -87.45 -69.24 0.7 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.18 111.749 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.13 -74.61 0.65 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.478 -0.328 . . . . 0.3 111.735 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.526 ' HB3' ' HA ' ' A' ' 9' ' ' LYS . 23.5 ttpp . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.252 -0.88 . . . . 1.46 111.839 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.513 ' HB3' ' N ' ' A' ' 6' ' ' SER . 56.8 mttm . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.913 0.387 . . . . 1.15 111.22 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -104.56 -72.67 0.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.41 -0.959 . . . . 2.0 108.41 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.577 HG23 ' HE2' ' A' ' 7' ' ' LYS . 39.4 mm -90.72 -29.23 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 108.35 -0.981 . . . . 0.56 108.35 177.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 9' ' ' LYS . 3.9 mm? -71.14 -9.8 58.68 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.838 -1.073 . . . . 1.43 109.636 178.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.513 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 45.7 t -76.63 -65.52 0.93 Allowed 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.483 -0.78 . . . . 0.1 110.045 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.577 ' HE2' HG23 ' A' ' 4' ' ' ILE . 62.7 pttt -56.49 -24.58 47.13 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.431 -0.951 . . . . 2.09 108.431 178.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.425 HD13 ' HA ' ' A' ' 8' ' ' ILE . 10.8 mm -81.7 -36.35 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 114.76 -1.109 . . . . 0.16 110.744 178.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.499 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.7 tttm -48.26 -35.07 11.37 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.284 -0.416 . . . . 1.63 110.882 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -90.42 -25.77 20.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.889 -0.596 . . . . 2.02 111.279 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.541 ' HB3' HD23 ' A' ' 12' ' ' LEU . 79.3 mt -77.54 -67.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.18 111.149 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.541 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -139.09 -65.14 0.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.044 0.387 . . . . 0.3 112.044 -179.744 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.54 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 12.4 ttmm . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.155 -0.926 . . . . 1.46 110.797 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.564 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.8 mtmm . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.799 0.333 . . . . 1.15 111.24 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -102.15 -69.95 0.77 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.474 -0.936 . . . . 2.0 108.474 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -90.75 -33.19 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 108.732 -0.84 . . . . 0.56 108.732 177.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.5 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.1 mp -68.02 -10.5 54.2 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.069 -0.969 . . . . 1.43 109.951 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.517 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 44.2 t -74.73 -64.84 0.95 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.854 -0.612 . . . . 0.1 110.094 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -59.56 -23.86 63.25 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.638 -0.875 . . . . 2.09 108.638 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.513 HG23 ' HG ' ' A' ' 12' ' ' LEU . 12.6 mm -80.7 -34.25 14.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 114.816 -1.084 . . . . 0.16 110.549 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.693 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.0 ttpp -47.26 -33.87 5.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.771 -0.649 . . . . 1.63 111.139 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -90.6 -25.68 20.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.047 -0.524 . . . . 2.02 111.389 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.51 HD12 HD13 ' A' ' 8' ' ' ILE . 93.7 mt -80.41 -67.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.488 -0.324 . . . . 0.18 111.483 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.513 ' HG ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -133.07 -66.29 0.67 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.888 0.329 . . . . 0.3 111.888 -179.604 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.693 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 3.3 tppp? . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.177 -0.916 . . . . 1.46 110.821 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.481 ' HB3' ' N ' ' A' ' 6' ' ' SER . 9.0 mtmp? . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.941 0.4 . . . . 1.15 111.43 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -108.14 -71.95 0.74 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.662 -0.866 . . . . 2.0 108.662 178.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.1 mm -90.79 -31.8 5.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.634 -0.876 . . . . 0.56 108.634 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.519 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mm? -70.27 -10.3 58.52 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.134 -0.939 . . . . 1.43 109.257 178.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.481 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 36.8 t -72.39 -65.67 0.75 Allowed 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.369 -0.832 . . . . 0.1 109.959 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -58.83 -24.98 62.76 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.628 -0.879 . . . . 2.09 108.628 178.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.519 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.5 mm -76.62 -36.51 27.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.062 -0.972 . . . . 0.16 110.35 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -52.46 -33.24 43.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.734 -0.666 . . . . 1.63 110.944 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -91.32 -23.77 20.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.995 -0.548 . . . . 2.02 110.939 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.633 ' HB3' HD23 ' A' ' 12' ' ' LEU . 68.9 mt -81.31 -69.35 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.073 -0.512 . . . . 0.18 111.369 -179.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.633 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -129.69 -78.35 0.55 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.529 -0.305 . . . . 0.3 111.719 -179.659 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.496 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 17.1 ttmm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.414 -0.803 . . . . 1.46 111.115 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.543 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 31.1 mtmm . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.86 0.362 . . . . 1.15 111.261 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -103.12 -70.02 0.77 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.621 -0.881 . . . . 2.0 108.621 178.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.478 HG23 ' NZ ' ' A' ' 7' ' ' LYS . 46.7 mm -90.95 -33.06 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 108.772 -0.825 . . . . 0.56 108.772 177.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.543 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 3.7 mm? -68.79 -10.37 56.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.281 -0.872 . . . . 1.43 109.932 178.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.53 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.8 t -73.65 -68.05 0.54 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.926 -0.579 . . . . 0.1 110.351 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.478 ' NZ ' HG23 ' A' ' 4' ' ' ILE . 23.9 pttm -57.91 -24.74 59.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.721 -0.844 . . . . 2.09 108.721 178.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.55 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.4 mm -78.76 -35.15 17.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 114.882 -1.054 . . . . 0.16 110.44 178.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.663 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 28.4 tttt -47.4 -33.72 6.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.827 -0.624 . . . . 1.63 111.137 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -90.66 -27.42 19.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 2.02 111.445 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.448 ' HB3' HD23 ' A' ' 12' ' ' LEU . 95.3 mt -79.67 -67.99 0.71 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.279 -0.419 . . . . 0.18 111.584 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.55 ' HG ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -130.72 -69.54 0.64 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.797 0.295 . . . . 0.3 111.797 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.663 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.0 tppp? . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.176 -0.916 . . . . 1.46 110.807 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.545 ' HB3' ' N ' ' A' ' 6' ' ' SER . 34.3 mtmm . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.904 0.383 . . . . 1.15 111.368 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -101.19 -70.71 0.73 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.215 -1.031 . . . . 2.0 108.215 178.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 40.1 mm -91.42 -32.92 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 108.558 -0.904 . . . . 0.56 108.558 177.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.532 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.9 mt -66.59 -10.99 51.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.276 -0.874 . . . . 1.43 109.825 178.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.545 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.4 t -74.48 -62.91 1.36 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.554 -0.748 . . . . 0.1 109.735 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -60.04 -24.73 64.77 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.536 -0.912 . . . . 2.09 108.536 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.532 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 15.1 mm -77.37 -37.21 24.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.914 -1.039 . . . . 0.16 110.462 178.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.472 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 13.0 tttt -52.08 -32.76 36.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.682 -0.69 . . . . 1.63 111.167 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -91.18 -24.55 19.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.055 -0.52 . . . . 2.02 111.119 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.543 ' HB3' HD23 ' A' ' 12' ' ' LEU . 88.3 mt -83.73 -69.9 0.6 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.132 -0.486 . . . . 0.18 111.392 -179.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.543 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -126.46 -77.74 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.004 0.372 . . . . 0.3 112.004 -179.432 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.485 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 13.6 ttmm . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.104 -0.951 . . . . 1.46 110.956 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.533 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 31.8 mtmm . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.909 0.385 . . . . 1.15 111.379 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -102.63 -69.47 0.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.472 -0.936 . . . . 2.0 108.472 178.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.5 mm -91.2 -33.56 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 115.476 -0.784 . . . . 0.56 108.98 177.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.493 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.0 mp -68.14 -10.57 55.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.358 -0.837 . . . . 1.43 110.134 178.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.512 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.5 t -75.58 -65.34 0.91 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.827 -0.624 . . . . 0.1 110.032 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -56.89 -25.72 57.57 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 108.551 -0.907 . . . . 2.09 108.551 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.515 HG23 ' HG ' ' A' ' 12' ' ' LEU . 14.8 mm -79.59 -35.75 16.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.7 -1.136 . . . . 0.16 110.74 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.662 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.7 ttpp -48.41 -32.31 7.47 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.037 -0.529 . . . . 1.63 111.109 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -90.62 -25.16 20.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.007 -0.542 . . . . 2.02 111.263 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.446 ' HB3' HD23 ' A' ' 12' ' ' LEU . 96.0 mt -83.64 -68.32 0.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.324 -0.398 . . . . 0.18 111.61 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.549 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.26 -67.82 0.69 Allowed 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 112.009 0.374 . . . . 0.3 112.009 -179.636 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.662 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.4 tppp? . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.113 -0.946 . . . . 1.46 110.766 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.56 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.6 mtmm . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.891 0.377 . . . . 1.15 111.293 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -102.75 -70.59 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.486 -0.931 . . . . 2.0 108.486 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 42.8 mm -90.84 -32.55 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 108.834 -0.802 . . . . 0.56 108.834 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.507 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.2 mp -68.05 -10.41 53.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.245 -0.889 . . . . 1.43 109.931 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.505 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.3 t -74.89 -64.91 0.94 Allowed 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.845 -0.616 . . . . 0.1 110.026 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -59.13 -24.68 63.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.537 -0.912 . . . . 2.09 108.537 178.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.505 HG23 ' HG ' ' A' ' 12' ' ' LEU . 11.5 mm -80.03 -34.27 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 114.74 -1.118 . . . . 0.16 110.332 178.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.656 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.1 tttt -46.37 -36.14 6.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.856 -0.611 . . . . 1.63 110.945 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -90.9 -25.17 19.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.847 -0.615 . . . . 2.02 111.266 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.484 HD12 HD13 ' A' ' 8' ' ' ILE . 82.5 mt -77.47 -66.82 0.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.18 111.281 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.544 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -136.36 -64.58 0.6 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.486 -0.325 . . . . 0.3 111.76 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.656 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.1 tppp? . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.377 -0.821 . . . . 1.46 110.861 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.556 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 31.9 mtmm . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.722 0.296 . . . . 1.15 110.976 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -98.52 -68.88 0.78 Allowed 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.222 -1.029 . . . . 2.0 108.222 178.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -91.36 -32.92 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 115.385 -0.825 . . . . 0.56 108.919 177.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.446 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.6 mt -67.08 -10.9 54.88 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.146 -0.934 . . . . 1.43 110.466 179.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.535 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.5 t -75.65 -66.77 0.74 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.962 -0.563 . . . . 0.1 110.054 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -57.67 -23.98 54.29 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.717 -0.846 . . . . 2.09 108.717 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.537 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.5 mm -81.25 -35.01 13.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 114.826 -1.079 . . . . 0.16 110.577 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.685 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 18.9 tttm -46.6 -32.3 3.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.975 -0.557 . . . . 1.63 111.067 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -90.85 -26.77 19.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 2.02 111.372 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.576 ' HB3' HD23 ' A' ' 12' ' ' LEU . 99.6 mt -80.22 -68.2 0.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.18 111.695 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.576 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -131.87 -67.61 0.67 Allowed 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.801 0.297 . . . . 0.3 111.801 -179.528 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.685 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.344 -0.836 . . . . 1.46 110.767 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.561 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 33.4 mtmm . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.927 0.394 . . . . 1.15 111.255 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -105.26 -70.21 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.535 -0.913 . . . . 2.0 108.535 178.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.0 mm -90.95 -32.69 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 108.844 -0.798 . . . . 0.56 108.844 177.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.494 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mm? -69.48 -10.49 58.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.209 -0.905 . . . . 1.43 109.782 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.493 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.2 t -74.46 -65.77 0.82 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.746 -0.661 . . . . 0.1 109.916 179.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -58.3 -23.99 58.19 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.695 -0.854 . . . . 2.09 108.695 178.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.568 HG23 ' HG ' ' A' ' 12' ' ' LEU . 11.6 mm -80.55 -34.88 14.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 114.9 -1.045 . . . . 0.16 110.458 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.674 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 16.0 tttm -47.11 -34.42 6.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.731 -0.668 . . . . 1.63 111.159 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -90.63 -25.58 20.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.942 -0.572 . . . . 2.02 111.304 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.437 HD12 HD13 ' A' ' 8' ' ' ILE . 96.2 mt -79.87 -68.02 0.71 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.278 -0.419 . . . . 0.18 111.433 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.568 ' HG ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -130.63 -70.33 0.62 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.77 0.285 . . . . 0.3 111.77 -179.627 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.674 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.9 tppp? . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.285 -0.865 . . . . 1.46 110.788 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.553 ' HE3' ' HD3' ' A' ' 9' ' ' LYS . 34.7 mtmm . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.85 0.357 . . . . 1.15 111.206 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -101.81 -69.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.349 -0.982 . . . . 2.0 108.349 178.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -91.1 -34.38 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 108.783 -0.821 . . . . 0.56 108.783 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.53 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.7 mp -66.92 -10.55 50.09 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.247 -0.888 . . . . 1.43 110.144 178.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.52 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 44.2 t -75.13 -64.21 1.1 Allowed 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.986 -0.552 . . . . 0.1 109.863 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -59.08 -25.23 63.6 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.482 -0.933 . . . . 2.09 108.482 178.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.7 mm -79.01 -35.21 17.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 114.851 -1.068 . . . . 0.16 110.468 178.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.65 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.5 ttpp -47.24 -34.17 6.22 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.854 -0.612 . . . . 1.63 110.843 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -90.95 -25.67 19.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.886 -0.597 . . . . 2.02 111.175 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.554 ' HB3' HD23 ' A' ' 12' ' ' LEU . 87.2 mt -79.09 -67.63 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.18 111.534 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.554 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -133.99 -67.3 0.59 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.508 -0.315 . . . . 0.3 111.765 -179.689 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.65 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.3 tppp? . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.316 -0.85 . . . . 1.46 110.804 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.536 ' HE2' ' HG3' ' A' ' 9' ' ' LYS . 61.0 mttp . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.848 0.356 . . . . 1.15 111.16 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -104.51 -70.44 0.77 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.549 -0.908 . . . . 2.0 108.549 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.1 mm -90.99 -29.42 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 108.841 -0.8 . . . . 0.56 108.841 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.603 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 2.6 mm? -72.75 -10.16 59.47 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.139 -0.937 . . . . 1.43 109.591 178.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.507 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 40.8 t -76.22 -66.17 0.83 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.607 -0.724 . . . . 0.1 109.855 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -54.12 -28.18 38.08 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.513 -0.921 . . . . 2.09 108.513 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.513 HG22 ' HD3' ' A' ' 13' ' ' LYS . 15.9 mm -77.43 -37.39 24.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.768 -1.105 . . . . 0.16 110.758 178.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.561 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.5 tttm -50.38 -37.06 35.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.017 -0.538 . . . . 1.63 111.251 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -91.23 -29.44 17.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 2.02 111.994 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.581 ' HB3' HD23 ' A' ' 12' ' ' LEU . 69.0 mt -75.87 -67.36 0.68 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.688 -0.233 . . . . 0.18 111.533 -179.161 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.581 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -129.12 -68.33 0.74 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.516 -0.311 . . . . 0.3 111.449 -179.794 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.603 ' HE2' ' HB3' ' A' ' 5' ' ' LEU . 13.5 tptp . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.345 -0.836 . . . . 1.46 111.161 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.576 ' HD3' ' HE3' ' A' ' 13' ' ' LYS . 9.9 mtmp? . . . . . 0 CA--C 1.527 0.087 0 CA-C-O 120.987 0.422 . . . . 1.15 111.231 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -104.22 -68.81 0.83 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.561 -0.903 . . . . 2.0 108.561 178.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.7 mm -90.88 -33.33 5.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 108.768 -0.827 . . . . 0.56 108.768 177.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.49 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.0 mm? -69.38 -10.45 58.01 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.182 -0.917 . . . . 1.43 109.832 178.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.535 ' HA ' ' HZ2' ' A' ' 2' ' ' LYS . 48.4 t -74.85 -65.88 0.82 Allowed 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.728 -0.669 . . . . 0.1 109.809 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -57.34 -25.28 59.16 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.598 -0.89 . . . . 2.09 108.598 178.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.49 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.7 mm -78.38 -36.39 20.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 114.926 -1.033 . . . . 0.16 110.474 178.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 5' ' ' LEU . 14.8 tttt -51.04 -31.32 18.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.002 -0.544 . . . . 1.63 111.044 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -90.23 -24.51 20.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 2.02 110.894 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.526 ' HB3' HD23 ' A' ' 12' ' ' LEU . 97.0 mt -84.0 -68.56 0.71 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.18 111.422 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.526 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -133.04 -73.63 0.5 Allowed 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.098 0.407 . . . . 0.3 112.098 -179.859 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.576 ' HE3' ' HD3' ' A' ' 2' ' ' LYS . 9.7 ttmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.174 -0.917 . . . . 1.46 110.799 -178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 78.8 mt . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.821 0.343 . . . . 2.53 111.143 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.543 ' HZ3' ' HA ' ' A' ' 6' ' ' SER . 9.7 mtmp? -72.06 133.0 45.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 1.15 110.956 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -99.56 -69.96 0.75 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.432 -0.951 . . . . 2.0 108.432 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.3 mm -91.04 -32.74 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 N-CA-C 108.999 -0.741 . . . . 0.56 108.999 177.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.467 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.3 mp -67.77 -10.51 53.34 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.159 -0.928 . . . . 1.43 110.136 178.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.543 ' HA ' ' HZ3' ' A' ' 2' ' ' LYS . 41.2 t -76.9 -64.18 1.19 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.814 -0.63 . . . . 0.1 109.886 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -57.34 -25.14 58.94 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.526 -0.916 . . . . 2.09 108.526 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.513 HG23 ' HG ' ' A' ' 12' ' ' LEU . 14.3 mm -80.98 -35.83 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 114.624 -1.171 . . . . 0.16 110.91 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.674 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 26.5 tttt -48.38 -32.22 7.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.144 -0.48 . . . . 1.63 111.135 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -90.85 -23.82 20.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.046 -0.525 . . . . 2.02 111.394 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.441 ' HB3' HD23 ' A' ' 12' ' ' LEU . 95.8 mt -84.43 -68.2 0.74 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.356 -0.384 . . . . 0.18 111.563 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.531 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.49 -68.25 0.66 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 111.847 0.314 . . . . 0.3 111.847 -179.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.674 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.9 tppp? . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.192 -0.908 . . . . 1.46 110.877 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 81.9 mt . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.734 0.302 . . . . 2.53 111.087 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.528 ' HB3' ' N ' ' A' ' 6' ' ' SER . 35.8 mtmm -98.25 133.91 42.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.289 -0.414 . . . . 1.15 111.334 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -101.2 -70.4 0.74 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.218 -1.03 . . . . 2.0 108.218 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.5 mm -91.1 -32.78 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 108.72 -0.844 . . . . 0.56 108.72 177.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.489 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.7 mp -67.51 -10.52 52.43 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.185 -0.916 . . . . 1.43 110.136 178.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.528 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.3 t -74.34 -65.88 0.8 Allowed 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.882 -0.599 . . . . 0.1 110.288 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -59.98 -23.36 63.56 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.7 -0.852 . . . . 2.09 108.7 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.519 HD13 HD12 ' A' ' 11' ' ' LEU . 10.7 mm -80.2 -34.08 14.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.919 -1.037 . . . . 0.16 110.311 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.69 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 14.5 tttm -47.37 -34.53 7.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.798 -0.637 . . . . 1.63 110.919 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -90.92 -25.06 19.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.964 -0.562 . . . . 2.02 111.212 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.541 ' HB3' HD23 ' A' ' 12' ' ' LEU . 98.5 mt -78.84 -66.93 0.8 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.308 -0.406 . . . . 0.18 111.338 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.541 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -135.43 -64.57 0.63 Allowed 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 111.791 0.293 . . . . 0.3 111.791 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.69 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.355 -0.831 . . . . 1.46 110.825 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 41.7 mm . . . . . 0 N--CA 1.484 1.263 0 CA-C-O 120.809 0.338 . . . . 2.53 110.975 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.509 ' HB3' ' N ' ' A' ' 6' ' ' SER . 31.8 mtmm -94.75 137.67 33.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.095 -0.502 . . . . 1.15 111.197 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -103.1 -71.37 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.319 -0.993 . . . . 2.0 108.319 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 43.0 mm -91.04 -31.14 4.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 108.667 -0.864 . . . . 0.56 108.667 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.466 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.4 mm? -68.63 -10.51 56.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.179 -0.919 . . . . 1.43 109.812 178.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.509 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 47.0 t -76.68 -63.72 1.28 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.758 -0.655 . . . . 0.1 109.72 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.88 -24.85 59.51 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.523 -0.917 . . . . 2.09 108.523 178.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.466 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.1 mm -80.26 -36.08 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 CA-C-N 114.78 -1.1 . . . . 0.16 110.522 179.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.483 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 8.2 tttp -49.94 -31.81 13.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.014 -0.539 . . . . 1.63 111.118 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -90.28 -23.69 21.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.898 -0.592 . . . . 2.02 111.036 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.509 ' HB3' HD23 ' A' ' 12' ' ' LEU . 96.3 mt -84.92 -67.78 0.77 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.197 -0.456 . . . . 0.18 111.452 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.533 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -134.62 -69.94 0.51 Allowed 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.169 0.433 . . . . 0.3 112.169 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.533 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 12.3 ttmm . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.161 -0.923 . . . . 1.46 110.836 -178.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.466 ' N ' HD12 ' A' ' 1' ' ' ILE . 4.6 mp . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.929 0.395 . . . . 2.53 110.841 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.2 mtmm -95.05 137.95 33.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.173 -0.467 . . . . 1.15 111.169 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -104.32 -68.61 0.84 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.613 -0.884 . . . . 2.0 108.613 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.478 HG23 ' HE2' ' A' ' 7' ' ' LYS . 43.7 mm -90.95 -34.18 6.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 108.977 -0.749 . . . . 0.56 108.977 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.48 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.1 mp -68.26 -10.69 56.44 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.333 -0.848 . . . . 1.43 110.022 178.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.496 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.5 t -76.18 -64.96 0.98 Allowed 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 115.814 -0.63 . . . . 0.1 109.957 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.478 ' HE2' HG23 ' A' ' 4' ' ' ILE . 65.0 pttt -56.6 -24.85 50.63 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.496 -0.928 . . . . 2.09 108.496 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.492 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.5 mm -80.56 -35.74 15.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 114.564 -1.198 . . . . 0.16 110.769 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.667 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 20.8 tttt -49.39 -31.97 10.62 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.039 -0.528 . . . . 1.63 111.153 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -90.62 -23.33 20.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.043 -0.526 . . . . 2.02 111.164 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.538 ' HB3' HD23 ' A' ' 12' ' ' LEU . 97.5 mt -85.11 -68.7 0.71 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.18 111.591 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.538 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -131.21 -69.44 0.63 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.559 -0.292 . . . . 0.3 111.78 -179.622 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.667 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.286 -0.864 . . . . 1.46 110.881 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 45.4 mm . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 120.769 0.318 . . . . 2.53 110.957 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.552 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 35.6 mtmm -82.47 132.68 35.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.152 -0.476 . . . . 1.15 111.218 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -100.91 -70.4 0.74 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.216 -1.031 . . . . 2.0 108.216 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 41.9 mm -91.03 -30.8 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 108.825 -0.806 . . . . 0.56 108.825 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.458 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mt -68.85 -11.09 60.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.091 -0.958 . . . . 1.43 109.985 178.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.524 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.8 t -76.51 -63.67 1.29 Allowed 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.571 -0.741 . . . . 0.1 109.804 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.438 ' NZ ' ' HB3' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -57.67 -25.42 60.22 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.435 -0.95 . . . . 2.09 108.435 178.127 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.458 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.7 mm -78.97 -36.33 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 114.792 -1.094 . . . . 0.16 110.387 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.669 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 21.3 tttt -49.42 -31.69 10.21 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.009 -0.541 . . . . 1.63 111.007 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -90.81 -26.18 19.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.005 -0.543 . . . . 2.02 111.128 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.533 ' HB3' HD23 ' A' ' 12' ' ' LEU . 98.0 mt -80.78 -69.05 0.63 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.439 . . . . 0.18 111.443 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.533 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -131.89 -68.45 0.64 Allowed 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.857 0.317 . . . . 0.3 111.857 -179.619 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.669 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.4 tppp? . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.141 -0.933 . . . . 1.46 110.835 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 54.0 mt . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.918 0.389 . . . . 2.53 110.941 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.492 ' HB3' ' N ' ' A' ' 6' ' ' SER . 32.7 mtmm -86.03 139.39 31.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 1.15 111.346 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -105.86 -71.59 0.74 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.659 -0.867 . . . . 2.0 108.659 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.4 mm -90.95 -32.35 5.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.857 -0.794 . . . . 0.56 108.857 177.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.499 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.6 mm? -69.1 -10.38 57.31 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.015 -0.993 . . . . 1.43 109.453 178.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.492 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 32.5 t -74.15 -63.66 1.18 Allowed 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.322 -0.854 . . . . 0.1 109.879 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -57.7 -26.82 62.27 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.429 -0.952 . . . . 2.09 108.429 178.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.543 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.6 mm -75.93 -36.93 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 114.811 -1.086 . . . . 0.16 110.522 178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -52.57 -36.16 55.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.867 -0.606 . . . . 1.63 111.275 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -91.02 -18.91 23.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 2.02 111.151 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.574 ' HB3' HD23 ' A' ' 12' ' ' LEU . 58.3 mt -87.16 -67.98 0.78 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.32 -0.4 . . . . 0.18 111.208 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.574 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -126.67 -84.31 0.62 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.522 -0.308 . . . . 0.3 111.786 -179.797 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.446 ' HB2' HG22 ' A' ' 8' ' ' ILE . 20.1 ttmm . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.447 -0.787 . . . . 1.46 111.141 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.452 ' N ' HD12 ' A' ' 1' ' ' ILE . 4.8 mp . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.766 0.317 . . . . 2.53 110.949 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.57 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 35.1 mtmm -64.02 136.09 57.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 1.15 111.204 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -98.92 -72.29 0.66 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.99 -1.115 . . . . 2.0 107.99 178.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.9 mm -91.42 -29.52 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 115.498 -0.774 . . . . 0.56 108.964 177.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.434 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 4.3 mt -67.83 -11.65 59.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.274 -0.875 . . . . 1.43 110.177 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.482 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.9 t -77.22 -64.45 1.14 Allowed 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.831 -0.622 . . . . 0.1 110.101 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -56.49 -25.0 49.85 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.548 -0.908 . . . . 2.09 108.548 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.523 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.9 mm -79.63 -36.95 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-N 114.746 -1.115 . . . . 0.16 110.698 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.686 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 7.5 tttp -50.54 -31.16 14.82 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.075 -0.511 . . . . 1.63 111.216 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -90.69 -23.72 20.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.122 -0.49 . . . . 2.02 111.2 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.453 ' HB3' HD23 ' A' ' 12' ' ' LEU . 97.1 mt -86.45 -68.59 0.73 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.18 111.556 -179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.525 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -129.23 -71.23 0.63 Allowed 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.963 0.357 . . . . 0.3 111.963 -179.628 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.686 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.8 tppp? . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.238 -0.887 . . . . 1.46 110.913 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 79.5 mt . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.815 0.34 . . . . 2.53 110.983 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.503 ' HB3' ' N ' ' A' ' 6' ' ' SER . 35.9 mtmm -81.32 136.27 35.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.159 -0.473 . . . . 1.15 111.33 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -102.79 -71.49 0.72 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.294 -1.002 . . . . 2.0 108.294 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.561 ' N ' HD12 ' A' ' 4' ' ' ILE . 3.4 mp -90.18 -32.68 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 108.988 -0.745 . . . . 0.56 108.988 177.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.473 HD22 ' N ' ' A' ' 5' ' ' LEU . 3.1 mm? -68.07 -10.68 55.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.27 -0.877 . . . . 1.43 110.114 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.503 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.7 t -74.96 -67.8 0.61 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.019 -0.537 . . . . 0.1 110.269 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.476 ' HZ3' ' HA ' ' A' ' 4' ' ' ILE . 25.1 pttm -57.67 -23.55 52.02 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.849 -0.797 . . . . 2.09 108.849 178.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.438 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.9 mm -79.86 -35.55 16.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.001 -1.0 . . . . 0.16 110.377 178.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.526 ' HA ' ' HB3' ' A' ' 13' ' ' LYS . 4.7 tttp -50.29 -30.02 10.97 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.994 -0.548 . . . . 1.63 111.077 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -90.68 -23.94 20.6 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.008 -0.542 . . . . 2.02 111.065 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.0 mt -87.45 -69.24 0.7 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.49 . . . . 0.18 111.749 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.13 -74.61 0.65 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.478 -0.328 . . . . 0.3 111.735 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.526 ' HB3' ' HA ' ' A' ' 9' ' ' LYS . 23.5 ttpp . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.252 -0.88 . . . . 1.46 111.839 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 59.2 mt . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 120.82 0.343 . . . . 2.53 110.964 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.513 ' HB3' ' N ' ' A' ' 6' ' ' SER . 56.8 mttm -118.01 134.09 55.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 1.15 111.22 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -104.56 -72.67 0.7 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.41 -0.959 . . . . 2.0 108.41 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.577 HG23 ' HE2' ' A' ' 7' ' ' LYS . 39.4 mm -90.72 -29.23 4.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 108.35 -0.981 . . . . 0.56 108.35 177.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 9' ' ' LYS . 3.9 mm? -71.14 -9.8 58.68 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 114.838 -1.073 . . . . 1.43 109.636 178.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.513 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 45.7 t -76.63 -65.52 0.93 Allowed 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.483 -0.78 . . . . 0.1 110.045 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.577 ' HE2' HG23 ' A' ' 4' ' ' ILE . 62.7 pttt -56.49 -24.58 47.13 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.431 -0.951 . . . . 2.09 108.431 178.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.425 HD13 ' HA ' ' A' ' 8' ' ' ILE . 10.8 mm -81.7 -36.35 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 114.76 -1.109 . . . . 0.16 110.744 178.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.499 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.7 tttm -48.26 -35.07 11.37 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.284 -0.416 . . . . 1.63 110.882 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -90.42 -25.77 20.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.889 -0.596 . . . . 2.02 111.279 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.541 ' HB3' HD23 ' A' ' 12' ' ' LEU . 79.3 mt -77.54 -67.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.18 111.149 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.541 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -139.09 -65.14 0.49 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.044 0.387 . . . . 0.3 112.044 -179.744 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.54 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 12.4 ttmm . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.155 -0.926 . . . . 1.46 110.797 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 7.3 tp . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.785 0.326 . . . . 2.53 111.045 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.564 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.8 mtmm -92.44 134.21 35.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 1.15 111.24 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -102.15 -69.95 0.77 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.474 -0.936 . . . . 2.0 108.474 178.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -90.75 -33.19 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 108.732 -0.84 . . . . 0.56 108.732 177.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.5 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.1 mp -68.02 -10.5 54.2 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.069 -0.969 . . . . 1.43 109.951 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.517 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 44.2 t -74.73 -64.84 0.95 Allowed 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.854 -0.612 . . . . 0.1 110.094 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -59.56 -23.86 63.25 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.638 -0.875 . . . . 2.09 108.638 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.513 HG23 ' HG ' ' A' ' 12' ' ' LEU . 12.6 mm -80.7 -34.25 14.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 114.816 -1.084 . . . . 0.16 110.549 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.693 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.0 ttpp -47.26 -33.87 5.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.771 -0.649 . . . . 1.63 111.139 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -90.6 -25.68 20.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.047 -0.524 . . . . 2.02 111.389 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.51 HD12 HD13 ' A' ' 8' ' ' ILE . 93.7 mt -80.41 -67.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.488 -0.324 . . . . 0.18 111.483 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.513 ' HG ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -133.07 -66.29 0.67 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.888 0.329 . . . . 0.3 111.888 -179.604 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.693 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 3.3 tppp? . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.177 -0.916 . . . . 1.46 110.821 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 38.4 mm . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 120.923 0.392 . . . . 2.53 110.747 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.481 ' HB3' ' N ' ' A' ' 6' ' ' SER . 9.0 mtmp? -64.98 138.67 58.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.896 -0.593 . . . . 1.15 111.43 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -108.14 -71.95 0.74 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.662 -0.866 . . . . 2.0 108.662 178.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.1 mm -90.79 -31.8 5.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 108.634 -0.876 . . . . 0.56 108.634 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.519 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mm? -70.27 -10.3 58.52 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.134 -0.939 . . . . 1.43 109.257 178.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.481 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 36.8 t -72.39 -65.67 0.75 Allowed 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.369 -0.832 . . . . 0.1 109.959 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -58.83 -24.98 62.76 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.628 -0.879 . . . . 2.09 108.628 178.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.519 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.5 mm -76.62 -36.51 27.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.062 -0.972 . . . . 0.16 110.35 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -52.46 -33.24 43.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.734 -0.666 . . . . 1.63 110.944 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -91.32 -23.77 20.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.995 -0.548 . . . . 2.02 110.939 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.633 ' HB3' HD23 ' A' ' 12' ' ' LEU . 68.9 mt -81.31 -69.35 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.073 -0.512 . . . . 0.18 111.369 -179.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.633 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -129.69 -78.35 0.55 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.529 -0.305 . . . . 0.3 111.719 -179.659 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.496 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 17.1 ttmm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.414 -0.803 . . . . 1.46 111.115 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 71.8 mt . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.807 0.337 . . . . 2.53 111.103 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.543 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 31.1 mtmm -89.18 137.8 31.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 1.15 111.261 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -103.12 -70.02 0.77 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.621 -0.881 . . . . 2.0 108.621 178.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.478 HG23 ' NZ ' ' A' ' 7' ' ' LYS . 46.7 mm -90.95 -33.06 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 108.772 -0.825 . . . . 0.56 108.772 177.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.543 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 3.7 mm? -68.79 -10.37 56.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.281 -0.872 . . . . 1.43 109.932 178.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.53 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.8 t -73.65 -68.05 0.54 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.926 -0.579 . . . . 0.1 110.351 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.478 ' NZ ' HG23 ' A' ' 4' ' ' ILE . 23.9 pttm -57.91 -24.74 59.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.721 -0.844 . . . . 2.09 108.721 178.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.55 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.4 mm -78.76 -35.15 17.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 114.882 -1.054 . . . . 0.16 110.44 178.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.663 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 28.4 tttt -47.4 -33.72 6.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.827 -0.624 . . . . 1.63 111.137 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -90.66 -27.42 19.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 2.02 111.445 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.448 ' HB3' HD23 ' A' ' 12' ' ' LEU . 95.3 mt -79.67 -67.99 0.71 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.279 -0.419 . . . . 0.18 111.584 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.55 ' HG ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -130.72 -69.54 0.64 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.797 0.295 . . . . 0.3 111.797 -179.579 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.663 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.0 tppp? . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.176 -0.916 . . . . 1.46 110.807 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 46.8 mt . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 120.809 0.338 . . . . 2.53 110.81 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.545 ' HB3' ' N ' ' A' ' 6' ' ' SER . 34.3 mtmm -64.87 130.84 44.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 1.15 111.368 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -101.19 -70.71 0.73 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 108.215 -1.031 . . . . 2.0 108.215 178.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 40.1 mm -91.42 -32.92 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 108.558 -0.904 . . . . 0.56 108.558 177.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.532 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.9 mt -66.59 -10.99 51.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.276 -0.874 . . . . 1.43 109.825 178.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.545 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.4 t -74.48 -62.91 1.36 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.554 -0.748 . . . . 0.1 109.735 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -60.04 -24.73 64.77 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.536 -0.912 . . . . 2.09 108.536 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.532 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 15.1 mm -77.37 -37.21 24.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.914 -1.039 . . . . 0.16 110.462 178.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.472 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 13.0 tttt -52.08 -32.76 36.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.682 -0.69 . . . . 1.63 111.167 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -91.18 -24.55 19.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.055 -0.52 . . . . 2.02 111.119 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.543 ' HB3' HD23 ' A' ' 12' ' ' LEU . 88.3 mt -83.73 -69.9 0.6 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.132 -0.486 . . . . 0.18 111.392 -179.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.543 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -126.46 -77.74 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.004 0.372 . . . . 0.3 112.004 -179.432 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.485 ' H ' ' HG ' ' A' ' 12' ' ' LEU . 13.6 ttmm . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.104 -0.951 . . . . 1.46 110.956 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 60.3 mt . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 120.829 0.347 . . . . 2.53 111.082 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.533 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 31.8 mtmm -83.81 137.8 33.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 1.15 111.379 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -102.63 -69.47 0.79 Allowed 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.472 -0.936 . . . . 2.0 108.472 178.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.5 mm -91.2 -33.56 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-N 115.476 -0.784 . . . . 0.56 108.98 177.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.493 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.0 mp -68.14 -10.57 55.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.358 -0.837 . . . . 1.43 110.134 178.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.512 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.5 t -75.58 -65.34 0.91 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.827 -0.624 . . . . 0.1 110.032 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -56.89 -25.72 57.57 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 108.551 -0.907 . . . . 2.09 108.551 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.515 HG23 ' HG ' ' A' ' 12' ' ' LEU . 14.8 mm -79.59 -35.75 16.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.7 -1.136 . . . . 0.16 110.74 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.662 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.7 ttpp -48.41 -32.31 7.47 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.037 -0.529 . . . . 1.63 111.109 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 51.9 mtmt -90.62 -25.16 20.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.007 -0.542 . . . . 2.02 111.263 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.446 ' HB3' HD23 ' A' ' 12' ' ' LEU . 96.0 mt -83.64 -68.32 0.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.324 -0.398 . . . . 0.18 111.61 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.549 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -131.26 -67.82 0.69 Allowed 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 112.009 0.374 . . . . 0.3 112.009 -179.636 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.662 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.4 tppp? . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.113 -0.946 . . . . 1.46 110.766 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 45.2 mm . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.833 0.349 . . . . 2.53 110.963 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.56 ' HD3' ' HZ1' ' A' ' 13' ' ' LYS . 34.6 mtmm -98.9 135.8 39.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.164 -0.471 . . . . 1.15 111.293 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -102.75 -70.59 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.486 -0.931 . . . . 2.0 108.486 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 42.8 mm -90.84 -32.55 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 108.834 -0.802 . . . . 0.56 108.834 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.507 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 7.2 mp -68.05 -10.41 53.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.245 -0.889 . . . . 1.43 109.931 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.505 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 43.3 t -74.89 -64.91 0.94 Allowed 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.845 -0.616 . . . . 0.1 110.026 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -59.13 -24.68 63.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.537 -0.912 . . . . 2.09 108.537 178.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.505 HG23 ' HG ' ' A' ' 12' ' ' LEU . 11.5 mm -80.03 -34.27 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 114.74 -1.118 . . . . 0.16 110.332 178.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.656 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.1 tttt -46.37 -36.14 6.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.856 -0.611 . . . . 1.63 110.945 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -90.9 -25.17 19.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.847 -0.615 . . . . 2.02 111.266 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.484 HD12 HD13 ' A' ' 8' ' ' ILE . 82.5 mt -77.47 -66.82 0.79 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.18 111.281 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.544 ' HG ' ' H ' ' A' ' 13' ' ' LYS . 0.2 OUTLIER -136.36 -64.58 0.6 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.486 -0.325 . . . . 0.3 111.76 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.656 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.1 tppp? . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.377 -0.821 . . . . 1.46 110.861 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 83.9 mt . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 120.738 0.304 . . . . 2.53 111.208 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.556 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 31.9 mtmm -92.75 131.78 37.52 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.224 -0.444 . . . . 1.15 110.976 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -98.52 -68.88 0.78 Allowed 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.222 -1.029 . . . . 2.0 108.222 178.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -91.36 -32.92 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 115.385 -0.825 . . . . 0.56 108.919 177.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.446 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.6 mt -67.08 -10.9 54.88 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.146 -0.934 . . . . 1.43 110.466 179.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.535 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 41.5 t -75.65 -66.77 0.74 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.962 -0.563 . . . . 0.1 110.054 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -57.67 -23.98 54.29 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.717 -0.846 . . . . 2.09 108.717 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.537 HG23 ' HG ' ' A' ' 12' ' ' LEU . 13.5 mm -81.25 -35.01 13.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 114.826 -1.079 . . . . 0.16 110.577 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.685 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 18.9 tttm -46.6 -32.3 3.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.975 -0.557 . . . . 1.63 111.067 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -90.85 -26.77 19.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 2.02 111.372 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.576 ' HB3' HD23 ' A' ' 12' ' ' LEU . 99.6 mt -80.22 -68.2 0.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.18 111.695 -179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.576 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -131.87 -67.61 0.67 Allowed 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.801 0.297 . . . . 0.3 111.801 -179.528 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.685 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 2.6 tppp? . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.344 -0.836 . . . . 1.46 110.767 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 24.3 mt . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.969 0.414 . . . . 2.53 111.039 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.561 ' HE3' ' HD2' ' A' ' 9' ' ' LYS . 33.4 mtmm -82.5 140.03 33.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.495 . . . . 1.15 111.255 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -105.26 -70.21 0.79 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.535 -0.913 . . . . 2.0 108.535 178.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.0 mm -90.95 -32.69 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 108.844 -0.798 . . . . 0.56 108.844 177.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.494 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 3.7 mm? -69.48 -10.49 58.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.209 -0.905 . . . . 1.43 109.782 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.493 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 42.2 t -74.46 -65.77 0.82 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.746 -0.661 . . . . 0.1 109.916 179.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -58.3 -23.99 58.19 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.695 -0.854 . . . . 2.09 108.695 178.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.568 HG23 ' HG ' ' A' ' 12' ' ' LEU . 11.6 mm -80.55 -34.88 14.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 114.9 -1.045 . . . . 0.16 110.458 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.674 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 16.0 tttm -47.11 -34.42 6.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.731 -0.668 . . . . 1.63 111.159 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -90.63 -25.58 20.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.942 -0.572 . . . . 2.02 111.304 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.437 HD12 HD13 ' A' ' 8' ' ' ILE . 96.2 mt -79.87 -68.02 0.71 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.278 -0.419 . . . . 0.18 111.433 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.568 ' HG ' HG23 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -130.63 -70.33 0.62 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.77 0.285 . . . . 0.3 111.77 -179.627 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.674 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.9 tppp? . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.285 -0.865 . . . . 1.46 110.788 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 44.7 mm . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.795 0.331 . . . . 2.53 110.939 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.553 ' HE3' ' HD3' ' A' ' 9' ' ' LYS . 34.7 mtmm -82.06 133.61 35.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.285 -0.416 . . . . 1.15 111.206 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -101.81 -69.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.349 -0.982 . . . . 2.0 108.349 178.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.2 mm -91.1 -34.38 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 N-CA-C 108.783 -0.821 . . . . 0.56 108.783 177.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.53 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 7.7 mp -66.92 -10.55 50.09 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.247 -0.888 . . . . 1.43 110.144 178.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.52 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 44.2 t -75.13 -64.21 1.1 Allowed 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.986 -0.552 . . . . 0.1 109.863 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -59.08 -25.23 63.6 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.482 -0.933 . . . . 2.09 108.482 178.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 13.7 mm -79.01 -35.21 17.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 114.851 -1.068 . . . . 0.16 110.468 178.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.65 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 4.5 ttpp -47.24 -34.17 6.22 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.854 -0.612 . . . . 1.63 110.843 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -90.95 -25.67 19.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.886 -0.597 . . . . 2.02 111.175 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.554 ' HB3' HD23 ' A' ' 12' ' ' LEU . 87.2 mt -79.09 -67.63 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.18 111.534 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.554 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -133.99 -67.3 0.59 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.508 -0.315 . . . . 0.3 111.765 -179.689 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.65 ' HB2' ' HA ' ' A' ' 9' ' ' LYS . 1.3 tppp? . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.316 -0.85 . . . . 1.46 110.804 -179.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 79.2 mt . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.667 0.27 . . . . 2.53 111.082 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.536 ' HE2' ' HG3' ' A' ' 9' ' ' LYS . 61.0 mttp -82.3 132.08 35.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.368 -0.378 . . . . 1.15 111.16 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -104.51 -70.44 0.77 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.549 -0.908 . . . . 2.0 108.549 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.1 mm -90.99 -29.42 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 108.841 -0.8 . . . . 0.56 108.841 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.603 ' HB3' ' HE2' ' A' ' 13' ' ' LYS . 2.6 mm? -72.75 -10.16 59.47 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.139 -0.937 . . . . 1.43 109.591 178.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.507 ' N ' ' HB3' ' A' ' 2' ' ' LYS . 40.8 t -76.22 -66.17 0.83 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.607 -0.724 . . . . 0.1 109.855 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -54.12 -28.18 38.08 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.513 -0.921 . . . . 2.09 108.513 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.513 HG22 ' HD3' ' A' ' 13' ' ' LYS . 15.9 mm -77.43 -37.39 24.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.768 -1.105 . . . . 0.16 110.758 178.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.561 ' HA ' ' HB2' ' A' ' 13' ' ' LYS . 27.5 tttm -50.38 -37.06 35.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.017 -0.538 . . . . 1.63 111.251 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -91.23 -29.44 17.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 2.02 111.994 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.581 ' HB3' HD23 ' A' ' 12' ' ' LEU . 69.0 mt -75.87 -67.36 0.68 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.688 -0.233 . . . . 0.18 111.533 -179.161 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.581 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -129.12 -68.33 0.74 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.516 -0.311 . . . . 0.3 111.449 -179.794 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.603 ' HE2' ' HB3' ' A' ' 5' ' ' LEU . 13.5 tptp . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.345 -0.836 . . . . 1.46 111.161 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 60.8 mt . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 120.862 0.363 . . . . 2.53 111.049 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.576 ' HD3' ' HE3' ' A' ' 13' ' ' LYS . 9.9 mtmp? -95.22 134.02 38.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.078 -0.51 . . . . 1.15 111.231 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -104.22 -68.81 0.83 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.561 -0.903 . . . . 2.0 108.561 178.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 46.7 mm -90.88 -33.33 5.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 108.768 -0.827 . . . . 0.56 108.768 177.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.49 ' HA ' ' HB ' ' A' ' 8' ' ' ILE . 4.0 mm? -69.38 -10.45 58.01 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.182 -0.917 . . . . 1.43 109.832 178.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.535 ' HA ' ' HZ2' ' A' ' 2' ' ' LYS . 48.4 t -74.85 -65.88 0.82 Allowed 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.728 -0.669 . . . . 0.1 109.809 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -57.34 -25.28 59.16 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.598 -0.89 . . . . 2.09 108.598 178.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.49 ' HB ' ' HA ' ' A' ' 5' ' ' LEU . 11.7 mm -78.38 -36.39 20.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 114.926 -1.033 . . . . 0.16 110.474 178.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 5' ' ' LEU . 14.8 tttt -51.04 -31.32 18.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.002 -0.544 . . . . 1.63 111.044 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -90.23 -24.51 20.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 2.02 110.894 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.526 ' HB3' HD23 ' A' ' 12' ' ' LEU . 97.0 mt -84.0 -68.56 0.71 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.18 111.422 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.526 HD23 ' HB3' ' A' ' 11' ' ' LEU . 0.2 OUTLIER -133.04 -73.63 0.5 Allowed 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.098 0.407 . . . . 0.3 112.098 -179.859 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.576 ' HE3' ' HD3' ' A' ' 2' ' ' LYS . 9.7 ttmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.174 -0.917 . . . . 1.46 110.799 -178.697 . . . . . . . . 1 1 . 1 stop_ save_