data_1a13_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1a13 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 27.7 ttpt . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.612 0.72 . . . . 0.0 109.06 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.484 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -114.48 16.69 19.25 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 107.132 -2.387 . . . . 0.0 107.132 178.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.477 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 1.3 mp -141.37 -41.79 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.34 -1.33 58.02 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.479 ' O ' ' HB3' ' A' ' 12' ' ' LYS . . . -134.9 -26.3 1.35 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.543 -0.723 . . . . 0.0 109.552 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 13' ' ' LEU . 37.8 ttm -91.48 -95.92 0.13 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.996 -1.065 . . . . 0.0 108.998 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.491 ' N ' ' HG2' ' A' ' 9' ' ' MET . . . -46.19 -27.69 1.06 Allowed 'General case' 0 C--N 1.305 -1.335 0 O-C-N 120.943 -1.098 . . . . 0.0 108.785 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 6' ' ' ILE . 10.5 tptt -74.09 -45.5 48.81 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.264 -0.898 . . . . 0.0 108.668 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -109.81 -57.73 2.15 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.292 -0.88 . . . . 0.0 109.701 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 9' ' ' MET . 20.3 mt -59.83 -78.76 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.088 -1.007 . . . . 0.0 109.877 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 O-C-N 121.112 -0.993 . . . . 0.0 109.653 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.648 0.737 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.494 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -117.89 6.74 15.49 Favored Glycine 0 N--CA 1.483 1.816 0 N-CA-C 106.53 -2.628 . . . . 0.0 106.53 178.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.9 mm -126.5 -36.23 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -100.29 8.37 43.77 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -132.12 -31.04 1.49 Allowed 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.533 ' O ' ' N ' ' A' ' 13' ' ' LEU . 40.0 mtt -82.25 -97.3 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.345 -0.847 . . . . 0.0 109.168 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.527 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -47.38 -25.7 1.1 Allowed 'General case' 0 C--N 1.307 -1.24 0 O-C-N 120.829 -1.17 . . . . 0.0 108.274 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' N ' ' C ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -72.53 -46.18 55.76 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.076 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.88 -55.06 2.45 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.378 -0.826 . . . . 0.0 109.901 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.8 tt -53.33 -69.25 0.12 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.231 -0.918 . . . . 0.0 109.646 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.527 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.522 0 O-C-N 121.076 -1.015 . . . . 0.0 109.224 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 tptt . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.601 0.715 . . . . 0.0 109.181 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.508 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -113.26 5.11 25.17 Favored Glycine 0 N--CA 1.485 1.909 0 N-CA-C 106.9 -2.48 . . . . 0.0 106.9 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -134.56 -37.72 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.413 ' C ' ' HB3' ' A' ' 11' ' ' LYS . . . -84.3 -9.17 58.7 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -123.28 -24.86 4.57 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 13' ' ' LEU . 16.4 ttt -104.31 -82.64 0.51 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.17 -0.956 . . . . 0.0 109.048 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.428 ' C ' ' O ' ' A' ' 9' ' ' MET . . . -47.97 -25.55 1.41 Allowed 'General case' 0 C--N 1.307 -1.282 0 O-C-N 120.666 -1.271 . . . . 0.0 108.01 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.413 ' HB3' ' C ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -75.28 -44.87 43.37 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.46 -57.19 2.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 109.877 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.2 OUTLIER -54.83 -70.89 0.09 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.605 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.5 mt . . . . . 0 N--CA 1.487 1.416 0 O-C-N 121.28 -0.887 . . . . 0.0 108.958 179.893 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.457 0.646 . . . . 0.0 109.638 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.45 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -111.17 15.21 28.09 Favored Glycine 0 N--CA 1.487 2.049 0 N-CA-C 107.363 -2.295 . . . . 0.0 107.363 178.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.416 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -140.4 -39.07 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 -179.694 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -95.12 -4.54 46.0 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.005 -1.059 . . . . 0.0 108.274 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.472 ' HB2' ' O ' ' A' ' 4' ' ' LYS . . . -129.04 -24.52 2.89 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.576 ' HA ' ' HB2' ' A' ' 13' ' ' LEU . 1.6 tpp -91.5 -98.11 0.12 Allowed 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.558 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -44.61 -26.21 0.35 Allowed 'General case' 0 C--N 1.305 -1.354 0 O-C-N 120.794 -1.191 . . . . 0.0 108.837 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 6' ' ' ILE . 1.3 tmtm? -76.54 -45.17 31.84 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.187 -0.946 . . . . 0.0 108.958 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -115.81 -49.94 2.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.142 -0.973 . . . . 0.0 110.274 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.576 ' HB2' ' HA ' ' A' ' 9' ' ' MET . 11.7 tp -56.16 -68.27 0.22 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.166 -0.959 . . . . 0.0 110.048 -179.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.558 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 2.6 tt . . . . . 0 N--CA 1.492 1.657 0 O-C-N 120.789 -1.194 . . . . 0.0 109.309 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.713 0 CA-C-O 121.289 0.566 . . . . 0.0 109.639 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.46 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -111.83 3.46 27.4 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 108.133 -1.987 . . . . 0.0 108.133 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.428 HD11 ' O ' ' A' ' 5' ' ' GLY . 0.8 OUTLIER -134.53 -31.34 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 O-C-N 121.704 -0.88 . . . . 0.0 108.76 -179.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.426 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -101.18 -6.67 23.96 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.188 -0.945 . . . . 0.0 108.518 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.535 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -122.31 -26.16 4.7 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.104 -1.072 . . . . 0.0 108.104 179.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.542 ' O ' ' N ' ' A' ' 13' ' ' LEU . 1.4 tpp -89.27 -83.66 0.23 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.528 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -46.92 -28.94 1.78 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.123 -0.986 . . . . 0.0 108.394 178.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 10.2 tttm -80.29 -41.62 24.59 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.324 -0.86 . . . . 0.0 108.8 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.535 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.2 OUTLIER -105.67 -60.76 1.59 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.224 -0.923 . . . . 0.0 109.538 179.586 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.542 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.0 OUTLIER -61.79 -72.59 0.12 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.029 -1.044 . . . . 0.0 109.633 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.528 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.493 0 O-C-N 121.162 -0.961 . . . . 0.0 109.752 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.495 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -109.1 8.94 33.54 Favored Glycine 0 N--CA 1.485 1.953 0 N-CA-C 107.714 -2.155 . . . . 0.0 107.714 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.469 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -137.84 -41.67 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 179.908 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -87.92 7.52 30.51 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.413 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -146.35 -26.86 0.42 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.642 -0.661 . . . . 0.0 109.844 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.532 ' SD ' ' N ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -79.85 -97.63 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.095 -1.003 . . . . 0.0 108.915 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.549 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -47.76 -30.03 3.59 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 120.565 -1.335 . . . . 0.0 108.667 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.469 ' HG3' ' O ' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -70.44 -44.44 67.83 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.281 -0.887 . . . . 0.0 108.735 179.404 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.413 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.23 -59.85 1.88 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.135 -0.978 . . . . 0.0 109.714 179.587 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 9' ' ' MET . 2.9 tp -55.97 -72.72 0.07 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.193 -0.942 . . . . 0.0 109.755 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.549 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 O-C-N 121.094 -1.004 . . . . 0.0 109.465 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.654 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.457 ' C ' ' HB3' ' A' ' 9' ' ' MET . . . -103.98 16.73 50.08 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 107.33 -2.308 . . . . 0.0 107.33 178.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -143.64 -41.88 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.471 ' HA ' ' HG3' ' A' ' 11' ' ' LYS . . . -88.92 -10.87 46.22 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -125.39 -22.66 4.28 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.534 ' O ' ' N ' ' A' ' 13' ' ' LEU . 55.6 ttm -100.59 -79.27 0.5 Allowed 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.216 -0.927 . . . . 0.0 108.631 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.569 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -49.73 -28.28 5.9 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 120.828 -1.17 . . . . 0.0 108.024 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.471 ' HG3' ' HA ' ' A' ' 7' ' ' ALA . 0.9 OUTLIER -76.05 -41.07 51.86 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.041 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -110.81 -63.1 1.44 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.391 -0.818 . . . . 0.0 109.771 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.534 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -59.18 -73.73 0.08 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.197 -0.939 . . . . 0.0 110.034 -179.831 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.569 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.181 -0.949 . . . . 0.0 109.43 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.475 ' O ' ' HB1' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.488 0.661 . . . . 0.0 109.521 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.491 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -109.62 7.52 31.9 Favored Glycine 0 N--CA 1.485 1.946 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 178.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -135.93 -35.26 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.488 ' HA ' ' HD2' ' A' ' 11' ' ' LYS . . . -93.24 -3.4 53.78 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 121.12 -0.987 . . . . 0.0 108.728 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 4' ' ' LYS . . . -129.83 -28.88 2.17 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -85.86 -86.39 0.14 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.234 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.421 ' C ' ' O ' ' A' ' 9' ' ' MET . . . -45.78 -28.23 1.01 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.488 ' HD2' ' HA ' ' A' ' 7' ' ' ALA . 17.4 mttt -78.34 -44.02 26.27 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.16 -60.38 1.81 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.284 -0.885 . . . . 0.0 109.332 179.241 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.539 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.4 OUTLIER -51.41 -71.72 0.06 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.252 -0.905 . . . . 0.0 109.575 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.488 1.446 0 O-C-N 121.14 -0.975 . . . . 0.0 109.35 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.477 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -102.79 14.08 56.2 Favored Glycine 0 N--CA 1.487 2.041 0 N-CA-C 107.404 -2.279 . . . . 0.0 107.404 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -139.56 -40.75 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -95.74 -5.31 42.34 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.475 ' O ' ' HB2' ' A' ' 12' ' ' LYS . . . -129.53 -20.07 3.32 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.594 -0.691 . . . . 0.0 109.32 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.531 ' O ' ' N ' ' A' ' 13' ' ' LEU . 4.5 ttt -92.65 -89.87 0.19 Allowed 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.411 ' C ' ' O ' ' A' ' 9' ' ' MET . . . -48.21 -25.88 1.7 Allowed 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -46.62 53.67 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -111.02 -58.43 2.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.339 -0.851 . . . . 0.0 109.642 179.499 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.531 ' N ' ' O ' ' A' ' 9' ' ' MET . 6.0 mp -54.75 -70.89 0.09 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.092 -1.005 . . . . 0.0 109.479 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 mm? . . . . . 0 N--CA 1.491 1.579 0 O-C-N 121.221 -0.924 . . . . 0.0 109.359 -179.932 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.447 ' O ' ' HB1' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.584 0.707 . . . . 0.0 109.157 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.512 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -112.24 7.98 26.85 Favored Glycine 0 N--CA 1.485 1.92 0 N-CA-C 106.723 -2.551 . . . . 0.0 106.723 178.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mm -128.85 -38.54 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.469 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -89.49 -2.11 58.26 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 177.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.535 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -122.83 -33.92 3.29 Favored 'General case' 0 N--CA 1.485 1.3 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.555 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.3 OUTLIER -82.89 -96.96 0.05 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.18 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.542 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -43.31 -29.18 0.39 Allowed 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.818 -1.177 . . . . 0.0 108.782 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 12.6 tptp -74.06 -51.93 14.25 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.535 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -98.1 -62.33 1.26 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.142 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.555 ' N ' ' O ' ' A' ' 9' ' ' MET . 2.5 mm? -45.47 -69.23 0.14 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.342 -0.849 . . . . 0.0 109.305 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.542 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.752 0 O-C-N 120.834 -1.166 . . . . 0.0 109.455 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.0 mttt . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 121.643 0.735 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.509 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -122.91 6.28 9.56 Favored Glycine 0 N--CA 1.485 1.902 0 N-CA-C 107.0 -2.44 . . . . 0.0 107.0 178.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -134.23 -32.64 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -93.38 -5.0 50.45 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' A' ' 12' ' ' LYS . . . -125.93 -25.76 3.55 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.532 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -93.28 -94.31 0.16 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.212 -0.93 . . . . 0.0 108.685 179.708 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.437 ' C ' ' O ' ' A' ' 9' ' ' MET . . . -45.44 -25.93 0.49 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 120.954 -1.091 . . . . 0.0 108.514 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.0 OUTLIER -75.27 -46.52 33.09 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.086 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 53.0 mttt -109.23 -56.95 2.22 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.319 -0.863 . . . . 0.0 109.438 179.393 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.4 mm? -54.56 -75.3 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.131 -0.981 . . . . 0.0 109.455 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 0.0 109.299 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.496 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -102.12 13.23 57.35 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 107.531 -2.228 . . . . 0.0 107.531 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.94 -38.65 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.82 -8.4 28.47 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 12' ' ' LYS . . . -125.44 -18.21 5.37 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 13' ' ' LEU . 31.8 ttm -99.93 -83.24 0.44 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.494 ' HA ' ' HB2' ' A' ' 14' ' ' LEU . . . -48.36 -31.6 6.36 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.691 -1.256 . . . . 0.0 108.069 178.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -43.66 69.63 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.294 -0.879 . . . . 0.0 108.807 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 48.2 mttt -110.4 -61.56 1.65 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.207 -0.933 . . . . 0.0 109.329 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.564 ' N ' ' O ' ' A' ' 9' ' ' MET . 1.9 mp -51.46 -72.3 0.05 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.893 . . . . 0.0 109.88 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.525 ' CD1' ' HG2' ' A' ' 9' ' ' MET . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 O-C-N 120.949 -1.094 . . . . 0.0 109.286 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.468 ' O ' ' HB1' ' A' ' 8' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.549 0.69 . . . . 0.0 109.406 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.488 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -111.97 3.12 27.15 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 178.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.462 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -136.36 -32.9 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.455 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -91.47 -12.66 33.99 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 121.106 -0.996 . . . . 0.0 108.59 179.014 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.536 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -116.82 -31.06 5.57 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.576 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -93.74 -81.34 0.37 Allowed 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 178.861 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.497 ' HA ' ' HB3' ' A' ' 14' ' ' LEU . . . -41.2 -30.53 0.16 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.455 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 20.3 tptm -79.89 -47.17 15.51 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.536 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 4.6 tttt -96.89 -67.26 0.86 Allowed 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.576 ' N ' ' O ' ' A' ' 9' ' ' MET . 3.3 mm? -45.02 -68.05 0.23 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.447 -0.783 . . . . 0.0 109.136 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 10' ' ' ALA . 5.4 tp . . . . . 0 N--CA 1.494 1.739 0 O-C-N 120.965 -1.084 . . . . 0.0 109.328 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.458 ' HA ' ' HB1' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.502 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.469 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -103.85 14.26 52.9 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 107.864 -2.094 . . . . 0.0 107.864 178.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.4 mp -138.12 -41.47 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.63 -2.72 44.19 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -131.1 -21.98 2.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.607 -0.683 . . . . 0.0 109.374 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 13' ' ' LEU . 36.2 ttm -83.88 -89.21 0.1 Allowed 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.536 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -50.64 -23.4 2.58 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 178.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.44 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -79.86 -41.45 26.25 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.344 -0.848 . . . . 0.0 108.715 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.13 -59.77 1.89 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.405 -0.81 . . . . 0.0 109.151 179.683 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.541 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.8 mp -62.72 -73.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.106 -0.996 . . . . 0.0 109.349 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.536 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 3.8 mm? . . . . . 0 N--CA 1.489 1.497 0 O-C-N 121.209 -0.932 . . . . 0.0 109.393 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.455 ' O ' ' HB2' ' A' ' 2' ' ' ASN . 3.5 pt . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 121.416 0.627 . . . . 0.0 109.315 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.483 ' O ' ' HB ' ' A' ' 6' ' ' ILE . 0.2 OUTLIER 168.37 106.88 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.346 -0.846 . . . . 0.0 109.214 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.583 ' CE2' ' HB3' ' A' ' 7' ' ' ALA . 1.7 t-105 -83.76 12.98 5.17 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.178 -0.951 . . . . 0.0 109.835 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 27.7 ttpt -117.52 -18.12 9.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.268 -0.895 . . . . 0.0 109.06 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.484 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -114.48 16.69 19.25 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 107.132 -2.387 . . . . 0.0 107.132 178.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.483 ' HB ' ' O ' ' A' ' 2' ' ' ASN . 1.3 mp -141.37 -41.79 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.583 ' HB3' ' CE2' ' A' ' 3' ' ' TRP . . . -89.34 -1.33 58.02 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.479 ' O ' ' HB3' ' A' ' 12' ' ' LYS . . . -134.9 -26.3 1.35 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.543 -0.723 . . . . 0.0 109.552 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 13' ' ' LEU . 37.8 ttm -91.48 -95.92 0.13 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.996 -1.065 . . . . 0.0 108.998 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.516 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -46.19 -27.69 1.06 Allowed 'General case' 0 C--N 1.305 -1.335 0 O-C-N 120.943 -1.098 . . . . 0.0 108.785 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 6' ' ' ILE . 10.5 tptt -74.09 -45.5 48.81 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.264 -0.898 . . . . 0.0 108.668 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -109.81 -57.73 2.15 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.292 -0.88 . . . . 0.0 109.701 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 9' ' ' MET . 20.3 mt -59.83 -78.76 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.088 -1.007 . . . . 0.0 109.877 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 0.9 OUTLIER -84.7 19.97 1.89 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.112 -0.993 . . . . 0.0 109.653 -179.558 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . 0.516 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.308 0 O-C-N 119.892 -1.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.404 HG13 ' OD1' ' A' ' 2' ' ' ASN . 2.1 pt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.404 ' OD1' HG13 ' A' ' 1' ' ' ILE . 2.7 p-10 -156.36 60.16 0.56 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.274 -0.891 . . . . 0.0 109.68 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.578 ' CD2' ' HB1' ' A' ' 7' ' ' ALA . 10.5 t-105 66.27 10.71 7.38 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.149 -0.969 . . . . 0.0 109.831 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -113.98 -11.6 12.75 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.077 -1.014 . . . . 0.0 109.579 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.494 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -117.89 6.74 15.49 Favored Glycine 0 N--CA 1.483 1.816 0 N-CA-C 106.53 -2.628 . . . . 0.0 106.53 178.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.9 mm -126.5 -36.23 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.578 ' HB1' ' CD2' ' A' ' 3' ' ' TRP . . . -100.29 8.37 43.77 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -132.12 -31.04 1.49 Allowed 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.533 ' O ' ' N ' ' A' ' 13' ' ' LEU . 40.0 mtt -82.25 -97.3 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.345 -0.847 . . . . 0.0 109.168 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.527 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -47.38 -25.7 1.1 Allowed 'General case' 0 C--N 1.307 -1.24 0 O-C-N 120.829 -1.17 . . . . 0.0 108.274 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' N ' ' C ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -72.53 -46.18 55.76 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.076 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.88 -55.06 2.45 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.378 -0.826 . . . . 0.0 109.901 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.8 tt -53.33 -69.25 0.12 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.231 -0.918 . . . . 0.0 109.646 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.527 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -84.83 3.93 35.5 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.076 -1.015 . . . . 0.0 109.224 179.938 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.366 0 O-C-N 119.888 -1.757 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.476 HG21 ' OD1' ' A' ' 2' ' ' ASN . 5.3 mt . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.476 ' OD1' HG21 ' A' ' 1' ' ' ILE . 0.0 OUTLIER -171.79 -75.96 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.33 -0.856 . . . . 0.0 108.868 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.479 ' CD2' ' HB1' ' A' ' 7' ' ' ALA . 12.3 t-105 -109.6 -16.4 13.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.153 -0.967 . . . . 0.0 109.345 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 tptt -101.3 1.86 39.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.23 -0.919 . . . . 0.0 109.181 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.508 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -113.26 5.11 25.17 Favored Glycine 0 N--CA 1.485 1.909 0 N-CA-C 106.9 -2.48 . . . . 0.0 106.9 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -134.56 -37.72 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.479 ' HB1' ' CD2' ' A' ' 3' ' ' TRP . . . -84.3 -9.17 58.7 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -123.28 -24.86 4.57 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 13' ' ' LEU . 16.4 ttt -104.31 -82.64 0.51 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.17 -0.956 . . . . 0.0 109.048 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.507 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -47.97 -25.55 1.41 Allowed 'General case' 0 C--N 1.307 -1.282 0 O-C-N 120.666 -1.271 . . . . 0.0 108.01 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.413 ' HB3' ' C ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -75.28 -44.87 43.37 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.46 -57.19 2.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 109.877 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.2 OUTLIER -54.83 -70.89 0.09 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.605 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 18.5 mt -103.64 33.41 3.39 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.28 -0.887 . . . . 0.0 108.958 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . 0.507 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.29 0 O-C-N 120.015 -1.678 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.481 ' CG ' ' N ' ' A' ' 3' ' ' TRP . 2.7 p30 -149.43 -50.52 0.15 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.28 -0.887 . . . . 0.0 109.798 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.501 ' CZ2' ' HB3' ' A' ' 7' ' ' ALA . 15.5 t-105 -129.64 -16.98 3.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.129 -0.982 . . . . 0.0 110.422 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -93.64 -3.7 52.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.81 -1.182 . . . . 0.0 109.638 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.45 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -111.17 15.21 28.09 Favored Glycine 0 N--CA 1.487 2.049 0 N-CA-C 107.363 -2.295 . . . . 0.0 107.363 178.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.416 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -140.4 -39.07 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 -179.694 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.501 ' HB3' ' CZ2' ' A' ' 3' ' ' TRP . . . -95.12 -4.54 46.0 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.005 -1.059 . . . . 0.0 108.274 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.472 ' HB2' ' O ' ' A' ' 4' ' ' LYS . . . -129.04 -24.52 2.89 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.576 ' HA ' ' HB2' ' A' ' 13' ' ' LEU . 1.6 tpp -91.5 -98.11 0.12 Allowed 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.558 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -44.61 -26.21 0.35 Allowed 'General case' 0 C--N 1.305 -1.354 0 O-C-N 120.794 -1.191 . . . . 0.0 108.837 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 6' ' ' ILE . 1.3 tmtm? -76.54 -45.17 31.84 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.187 -0.946 . . . . 0.0 108.958 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -115.81 -49.94 2.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.142 -0.973 . . . . 0.0 110.274 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.576 ' HB2' ' HA ' ' A' ' 9' ' ' MET . 11.7 tp -56.16 -68.27 0.22 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.166 -0.959 . . . . 0.0 110.048 -179.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.558 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 2.6 tt -56.72 -15.62 4.92 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.789 -1.194 . . . . 0.0 109.309 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.432 0 O-C-N 120.033 -1.667 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.408 HD13 ' HB2' ' A' ' 2' ' ' ASN . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.202 0.525 . . . . 0.0 109.634 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.408 ' HB2' HD13 ' A' ' 1' ' ' ILE . 1.7 m-20 -125.91 147.64 49.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.236 -0.915 . . . . 0.0 108.597 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.498 ' CZ2' ' HB1' ' A' ' 7' ' ' ALA . 8.3 t-105 -170.0 -24.45 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.925 -1.11 . . . . 0.0 111.198 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 3.92 50.65 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.355 -1.465 . . . . 0.0 109.639 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.46 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -111.83 3.46 27.4 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 108.133 -1.987 . . . . 0.0 108.133 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.428 HD11 ' O ' ' A' ' 5' ' ' GLY . 0.8 OUTLIER -134.53 -31.34 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 O-C-N 121.704 -0.88 . . . . 0.0 108.76 -179.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.498 ' HB1' ' CZ2' ' A' ' 3' ' ' TRP . . . -101.18 -6.67 23.96 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.188 -0.945 . . . . 0.0 108.518 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.535 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -122.31 -26.16 4.7 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.104 -1.072 . . . . 0.0 108.104 179.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.542 ' O ' ' N ' ' A' ' 13' ' ' LEU . 1.4 tpp -89.27 -83.66 0.23 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.528 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -46.92 -28.94 1.78 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.123 -0.986 . . . . 0.0 108.394 178.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 10.2 tttm -80.29 -41.62 24.59 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.324 -0.86 . . . . 0.0 108.8 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.535 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.2 OUTLIER -105.67 -60.76 1.59 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.224 -0.923 . . . . 0.0 109.538 179.586 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.542 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.0 OUTLIER -61.79 -72.59 0.12 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.029 -1.044 . . . . 0.0 109.633 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.528 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -86.69 22.91 1.8 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.162 -0.961 . . . . 0.0 109.752 -179.614 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . 0.491 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.323 0 O-C-N 119.796 -1.815 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.3 mm . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.41 ' HB2' HD11 ' A' ' 6' ' ' ILE . 27.2 m120 -82.98 173.19 12.01 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.677 -1.264 . . . . 0.0 109.226 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.58 ' CD2' ' HB1' ' A' ' 7' ' ' ALA . 2.0 t-105 -122.41 -12.2 8.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.3 -0.875 . . . . 0.0 109.593 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -104.85 -18.3 14.27 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.161 -0.962 . . . . 0.0 108.963 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.495 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -109.1 8.94 33.54 Favored Glycine 0 N--CA 1.485 1.953 0 N-CA-C 107.714 -2.155 . . . . 0.0 107.714 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.469 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -137.84 -41.67 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 179.908 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.58 ' HB1' ' CD2' ' A' ' 3' ' ' TRP . . . -87.92 7.52 30.51 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.413 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -146.35 -26.86 0.42 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.642 -0.661 . . . . 0.0 109.844 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.532 ' SD ' ' N ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -79.85 -97.63 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.095 -1.003 . . . . 0.0 108.915 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.549 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -47.76 -30.03 3.59 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 120.565 -1.335 . . . . 0.0 108.667 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.469 ' HG3' ' O ' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -70.44 -44.44 67.83 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.281 -0.887 . . . . 0.0 108.735 179.404 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.413 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.23 -59.85 1.88 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.135 -0.978 . . . . 0.0 109.714 179.587 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 9' ' ' MET . 2.9 tp -55.97 -72.72 0.07 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.193 -0.942 . . . . 0.0 109.755 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.549 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.3 OUTLIER -84.46 17.65 2.56 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.094 -1.004 . . . . 0.0 109.465 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . 0.408 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.318 0 O-C-N 119.739 -1.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.457 ' O ' ' O ' ' A' ' 2' ' ' ASN . 9.7 mm . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.391 0.615 . . . . 0.0 109.456 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.479 ' O ' HD11 ' A' ' 6' ' ' ILE . 0.1 OUTLIER 45.63 94.28 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.253 -0.905 . . . . 0.0 109.632 179.657 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.419 ' CE3' ' HB1' ' A' ' 7' ' ' ALA . 13.5 t-105 -101.29 -16.32 16.98 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.032 -1.042 . . . . 0.0 109.365 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.67 -12.92 18.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.28 -0.888 . . . . 0.0 109.006 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.457 ' C ' ' HB3' ' A' ' 9' ' ' MET . . . -103.98 16.73 50.08 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 107.33 -2.308 . . . . 0.0 107.33 178.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.479 HD11 ' O ' ' A' ' 2' ' ' ASN . 0.3 OUTLIER -143.64 -41.88 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -179.973 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.471 ' HA ' ' HG3' ' A' ' 11' ' ' LYS . . . -88.92 -10.87 46.22 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -125.39 -22.66 4.28 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.534 ' O ' ' N ' ' A' ' 13' ' ' LEU . 55.6 ttm -100.59 -79.27 0.5 Allowed 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.216 -0.927 . . . . 0.0 108.631 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.569 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -49.73 -28.28 5.9 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 120.828 -1.17 . . . . 0.0 108.024 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.471 ' HG3' ' HA ' ' A' ' 7' ' ' ALA . 0.9 OUTLIER -76.05 -41.07 51.86 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.041 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -110.81 -63.1 1.44 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.391 -0.818 . . . . 0.0 109.771 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.534 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -59.18 -73.73 0.08 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.197 -0.939 . . . . 0.0 110.034 -179.831 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.569 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 1.0 OUTLIER -81.51 11.7 4.37 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.181 -0.949 . . . . 0.0 109.43 -179.654 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . 0.502 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.304 -1.378 0 O-C-N 119.878 -1.764 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 3.9 pt . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.12 0.486 . . . . 0.0 109.767 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 57.56 89.52 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.126 -0.984 . . . . 0.0 109.607 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.572 ' CD2' ' HB1' ' A' ' 7' ' ' ALA . 18.9 t-105 -94.01 -8.51 39.7 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.212 -0.93 . . . . 0.0 109.738 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.475 ' O ' ' HB1' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -103.32 -7.32 21.17 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.23 -0.919 . . . . 0.0 109.521 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.491 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -109.62 7.52 31.9 Favored Glycine 0 N--CA 1.485 1.946 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 178.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -135.93 -35.26 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.572 ' HB1' ' CD2' ' A' ' 3' ' ' TRP . . . -93.24 -3.4 53.78 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 121.12 -0.987 . . . . 0.0 108.728 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 4' ' ' LYS . . . -129.83 -28.88 2.17 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -85.86 -86.39 0.14 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.234 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -45.78 -28.23 1.01 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.488 ' HD2' ' HA ' ' A' ' 7' ' ' ALA . 17.4 mttt -78.34 -44.02 26.27 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.16 -60.38 1.81 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.284 -0.885 . . . . 0.0 109.332 179.241 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.539 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.4 OUTLIER -51.41 -71.72 0.06 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.252 -0.905 . . . . 0.0 109.575 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.7 28.86 5.73 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.14 -0.975 . . . . 0.0 109.35 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . 0.517 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.305 -1.336 0 O-C-N 119.945 -1.722 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.561 ' O ' ' CB ' ' A' ' 2' ' ' ASN . 5.8 tt . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.561 ' CB ' ' O ' ' A' ' 1' ' ' ILE . 0.7 OUTLIER 82.16 -66.12 0.11 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.6 -0.687 . . . . 0.0 109.895 179.84 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.403 ' HA ' ' CE3' ' A' ' 3' ' ' TRP . 12.7 t-105 -93.19 -11.72 32.04 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.098 -1.001 . . . . 0.0 109.999 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -103.17 -14.59 16.32 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.11 -0.994 . . . . 0.0 109.158 179.691 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.477 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -102.79 14.08 56.2 Favored Glycine 0 N--CA 1.487 2.041 0 N-CA-C 107.404 -2.279 . . . . 0.0 107.404 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -139.56 -40.75 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -95.74 -5.31 42.34 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.475 ' O ' ' HB2' ' A' ' 12' ' ' LYS . . . -129.53 -20.07 3.32 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.594 -0.691 . . . . 0.0 109.32 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.531 ' O ' ' N ' ' A' ' 13' ' ' LEU . 4.5 ttt -92.65 -89.87 0.19 Allowed 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.514 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -48.21 -25.88 1.7 Allowed 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -46.62 53.67 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -111.02 -58.43 2.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.339 -0.851 . . . . 0.0 109.642 179.499 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.531 ' N ' ' O ' ' A' ' 9' ' ' MET . 6.0 mp -54.75 -70.89 0.09 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.092 -1.005 . . . . 0.0 109.479 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -97.12 29.32 3.18 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.221 -0.924 . . . . 0.0 109.359 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . 0.514 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.305 -1.348 0 O-C-N 119.892 -1.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.426 ' O ' ' HB2' ' A' ' 2' ' ' ASN . 4.5 pt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 1' ' ' ILE . 2.0 m120 63.32 130.57 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.905 . . . . 0.0 109.492 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.582 ' CD2' ' HB1' ' A' ' 7' ' ' ALA . 15.1 t-105 -96.6 7.95 45.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.174 -0.954 . . . . 0.0 109.507 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.447 ' O ' ' HB1' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -112.15 -10.35 13.88 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.268 -0.895 . . . . 0.0 109.157 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.512 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -112.24 7.98 26.85 Favored Glycine 0 N--CA 1.485 1.92 0 N-CA-C 106.723 -2.551 . . . . 0.0 106.723 178.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mm -128.85 -38.54 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.582 ' HB1' ' CD2' ' A' ' 3' ' ' TRP . . . -89.49 -2.11 58.26 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 177.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.535 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -122.83 -33.92 3.29 Favored 'General case' 0 N--CA 1.485 1.3 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.555 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.3 OUTLIER -82.89 -96.96 0.05 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.18 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.542 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -43.31 -29.18 0.39 Allowed 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.818 -1.177 . . . . 0.0 108.782 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 12.6 tptp -74.06 -51.93 14.25 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.535 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -98.1 -62.33 1.26 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.142 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.555 ' N ' ' O ' ' A' ' 9' ' ' MET . 2.5 mm? -45.47 -69.23 0.14 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.342 -0.849 . . . . 0.0 109.305 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.542 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.6 OUTLIER -75.74 -7.07 53.48 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.834 -1.166 . . . . 0.0 109.455 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.422 0 O-C-N 119.812 -1.805 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 5.3 mt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.517 ' O ' ' HB3' ' A' ' 3' ' ' TRP . 0.0 OUTLIER -175.7 112.38 0.12 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.139 -0.975 . . . . 0.0 110.071 -179.814 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.517 ' HB3' ' O ' ' A' ' 2' ' ' ASN . 5.8 t-105 81.22 -35.45 0.11 Allowed 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.65 -0.656 . . . . 0.0 110.83 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.0 mttt -93.86 12.64 25.2 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.676 -1.265 . . . . 0.0 109.553 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.509 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -122.91 6.28 9.56 Favored Glycine 0 N--CA 1.485 1.902 0 N-CA-C 107.0 -2.44 . . . . 0.0 107.0 178.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -134.23 -32.64 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -93.38 -5.0 50.45 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' A' ' 12' ' ' LYS . . . -125.93 -25.76 3.55 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.532 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -93.28 -94.31 0.16 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.212 -0.93 . . . . 0.0 108.685 179.708 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.528 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -45.44 -25.93 0.49 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 120.954 -1.091 . . . . 0.0 108.514 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.0 OUTLIER -75.27 -46.52 33.09 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.086 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 53.0 mttt -109.23 -56.95 2.22 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.319 -0.863 . . . . 0.0 109.438 179.393 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.4 mm? -54.56 -75.3 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.131 -0.981 . . . . 0.0 109.455 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.76 32.23 2.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 0.0 109.299 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . 0.528 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.305 -1.355 0 O-C-N 119.95 -1.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 1' ' ' ILE . 10.4 pt . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -151.26 -70.54 0.17 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.157 -0.964 . . . . 0.0 109.683 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -71.21 -25.96 62.74 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.183 -0.948 . . . . 0.0 109.357 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.08 -6.55 50.73 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.282 -0.887 . . . . 0.0 109.148 179.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.496 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -102.12 13.23 57.35 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 107.531 -2.228 . . . . 0.0 107.531 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.94 -38.65 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.82 -8.4 28.47 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 12' ' ' LYS . . . -125.44 -18.21 5.37 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 13' ' ' LEU . 31.8 ttm -99.93 -83.24 0.44 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.494 ' HA ' ' HB2' ' A' ' 14' ' ' LEU . . . -48.36 -31.6 6.36 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.691 -1.256 . . . . 0.0 108.069 178.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -43.66 69.63 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.294 -0.879 . . . . 0.0 108.807 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 48.2 mttt -110.4 -61.56 1.65 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.207 -0.933 . . . . 0.0 109.329 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.564 ' N ' ' O ' ' A' ' 9' ' ' MET . 1.9 mp -51.46 -72.3 0.05 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.893 . . . . 0.0 109.88 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.525 ' CD1' ' HG2' ' A' ' 9' ' ' MET . 0.2 OUTLIER -93.49 24.34 4.05 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.949 -1.094 . . . . 0.0 109.286 -179.879 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.305 -1.354 0 O-C-N 119.889 -1.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 16.0 pt . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -107.96 -156.97 0.6 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.247 -0.908 . . . . 0.0 109.299 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.593 ' CD2' ' HB1' ' A' ' 7' ' ' ALA . 9.4 t-105 -125.16 -7.17 7.11 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.137 -0.977 . . . . 0.0 109.637 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.468 ' O ' ' HB1' ' A' ' 8' ' ' ALA . 0.1 OUTLIER -104.68 -1.79 25.85 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.182 -0.949 . . . . 0.0 109.406 179.65 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.488 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -111.97 3.12 27.15 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 178.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.462 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -136.36 -32.9 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.593 ' HB1' ' CD2' ' A' ' 3' ' ' TRP . . . -91.47 -12.66 33.99 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 121.106 -0.996 . . . . 0.0 108.59 179.014 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.536 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -116.82 -31.06 5.57 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.576 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -93.74 -81.34 0.37 Allowed 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 178.861 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.497 ' HA ' ' HB3' ' A' ' 14' ' ' LEU . . . -41.2 -30.53 0.16 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.455 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 20.3 tptm -79.89 -47.17 15.51 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.536 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 4.6 tttt -96.89 -67.26 0.86 Allowed 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.576 ' N ' ' O ' ' A' ' 9' ' ' MET . 3.3 mm? -45.02 -68.05 0.23 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.447 -0.783 . . . . 0.0 109.136 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 10' ' ' ALA . 5.4 tp -84.21 0.03 50.38 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.965 -1.084 . . . . 0.0 109.328 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.364 0 O-C-N 119.934 -1.729 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.494 ' O ' ' CG2' ' A' ' 1' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.453 ' ND2' ' N ' ' A' ' 3' ' ' TRP . 0.0 OUTLIER -171.98 -49.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.074 -1.016 . . . . 0.0 109.572 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.575 ' CD2' ' HB1' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -174.43 31.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.115 -0.99 . . . . 0.0 109.658 -179.687 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.458 ' HA ' ' HB1' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -131.73 -31.9 1.51 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.331 -0.855 . . . . 0.0 109.558 179.691 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.469 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -103.85 14.26 52.9 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 107.864 -2.094 . . . . 0.0 107.864 178.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.403 HD12 ' CD1' ' A' ' 1' ' ' ILE . 1.4 mp -138.12 -41.47 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.575 ' HB1' ' CD2' ' A' ' 3' ' ' TRP . . . -96.63 -2.72 44.19 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 178.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -131.1 -21.98 2.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.607 -0.683 . . . . 0.0 109.374 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 13' ' ' LEU . 36.2 ttm -83.88 -89.21 0.1 Allowed 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.536 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -50.64 -23.4 2.58 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 178.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.44 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -79.86 -41.45 26.25 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.344 -0.848 . . . . 0.0 108.715 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.13 -59.77 1.89 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.405 -0.81 . . . . 0.0 109.151 179.683 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.541 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.8 mp -62.72 -73.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.106 -0.996 . . . . 0.0 109.349 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.536 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 3.8 mm? -88.58 31.55 0.83 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.209 -0.932 . . . . 0.0 109.393 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' NH2 . . . . . 0.482 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.295 0 O-C-N 119.934 -1.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.549 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 27.7 ttpt . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.612 0.72 . . . . 0.0 109.06 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -114.48 16.69 19.25 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 107.132 -2.387 . . . . 0.0 107.132 178.216 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.503 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 1.3 mp -141.37 -41.79 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.34 -1.33 58.02 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -134.9 -26.3 1.35 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.543 -0.723 . . . . 0.0 109.552 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.561 ' HA ' HD12 ' A' ' 13' ' ' LEU . 37.8 ttm -91.48 -95.92 0.13 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.996 -1.065 . . . . 0.0 108.998 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.502 ' HA ' ' HB2' ' A' ' 14' ' ' LEU . . . -46.19 -27.69 1.06 Allowed 'General case' 0 C--N 1.305 -1.335 0 O-C-N 120.943 -1.098 . . . . 0.0 108.785 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 6' ' ' ILE . 10.5 tptt -74.09 -45.5 48.81 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.264 -0.898 . . . . 0.0 108.668 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.502 ' HB3' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -109.81 -57.73 2.15 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.292 -0.88 . . . . 0.0 109.701 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 9' ' ' MET . 20.3 mt -59.83 -78.76 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.088 -1.007 . . . . 0.0 109.877 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.502 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 O-C-N 121.112 -0.993 . . . . 0.0 109.653 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.835 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 11.2 mmtt . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.648 0.737 . . . . 0.0 109.579 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.505 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -117.89 6.74 15.49 Favored Glycine 0 N--CA 1.483 1.816 0 N-CA-C 106.53 -2.628 . . . . 0.0 106.53 178.067 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.457 HD13 ' HA ' ' A' ' 6' ' ' ILE . 11.9 mm -126.5 -36.23 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -100.29 8.37 43.77 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.835 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -132.12 -31.04 1.49 Allowed 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.533 ' O ' ' N ' ' A' ' 13' ' ' LEU . 40.0 mtt -82.25 -97.3 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.345 -0.847 . . . . 0.0 109.168 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.535 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -47.38 -25.7 1.1 Allowed 'General case' 0 C--N 1.307 -1.24 0 O-C-N 120.829 -1.17 . . . . 0.0 108.274 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' N ' ' C ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -72.53 -46.18 55.76 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.076 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.88 -55.06 2.45 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.378 -0.826 . . . . 0.0 109.901 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.8 tt -53.33 -69.25 0.12 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.231 -0.918 . . . . 0.0 109.646 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.535 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.522 0 O-C-N 121.076 -1.015 . . . . 0.0 109.224 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.533 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 3.8 tptt . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.601 0.715 . . . . 0.0 109.181 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.53 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -113.26 5.11 25.17 Favored Glycine 0 N--CA 1.485 1.909 0 N-CA-C 106.9 -2.48 . . . . 0.0 106.9 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -134.56 -37.72 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.437 ' C ' ' HB3' ' A' ' 11' ' ' LYS . . . -84.3 -9.17 58.7 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -123.28 -24.86 4.57 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.556 ' HA ' ' HB2' ' A' ' 13' ' ' LEU . 16.4 ttt -104.31 -82.64 0.51 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.17 -0.956 . . . . 0.0 109.048 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.428 ' C ' ' O ' ' A' ' 9' ' ' MET . . . -47.97 -25.55 1.41 Allowed 'General case' 0 C--N 1.307 -1.282 0 O-C-N 120.666 -1.271 . . . . 0.0 108.01 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.437 ' HB3' ' C ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -75.28 -44.87 43.37 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.46 -57.19 2.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 109.877 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 9' ' ' MET . 0.2 OUTLIER -54.83 -70.89 0.09 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.605 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.483 HD23 ' HA ' ' A' ' 14' ' ' LEU . 18.5 mt . . . . . 0 N--CA 1.487 1.416 0 O-C-N 121.28 -0.887 . . . . 0.0 108.958 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.615 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.457 0.646 . . . . 0.0 109.638 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.47 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -111.17 15.21 28.09 Favored Glycine 0 N--CA 1.487 2.049 0 N-CA-C 107.363 -2.295 . . . . 0.0 107.363 178.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.407 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -140.4 -39.07 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 -179.694 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -95.12 -4.54 46.0 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.005 -1.059 . . . . 0.0 108.274 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -129.04 -24.52 2.89 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.85 ' SD ' HD23 ' A' ' 13' ' ' LEU . 1.6 tpp -91.5 -98.11 0.12 Allowed 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.572 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -44.61 -26.21 0.35 Allowed 'General case' 0 C--N 1.305 -1.354 0 O-C-N 120.794 -1.191 . . . . 0.0 108.837 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.412 ' N ' ' O ' ' A' ' 9' ' ' MET . 1.3 tmtm? -76.54 -45.17 31.84 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.187 -0.946 . . . . 0.0 108.958 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -115.81 -49.94 2.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.142 -0.973 . . . . 0.0 110.274 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.85 HD23 ' SD ' ' A' ' 9' ' ' MET . 11.7 tp -56.16 -68.27 0.22 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.166 -0.959 . . . . 0.0 110.048 -179.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.572 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 2.6 tt . . . . . 0 N--CA 1.492 1.657 0 O-C-N 120.789 -1.194 . . . . 0.0 109.309 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.605 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.713 0 CA-C-O 121.289 0.566 . . . . 0.0 109.639 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.475 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -111.83 3.46 27.4 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 108.133 -1.987 . . . . 0.0 108.133 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.432 HD12 ' O ' ' A' ' 5' ' ' GLY . 0.8 OUTLIER -134.53 -31.34 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 O-C-N 121.704 -0.88 . . . . 0.0 108.76 -179.95 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -101.18 -6.67 23.96 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.188 -0.945 . . . . 0.0 108.518 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.605 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -122.31 -26.16 4.7 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.104 -1.072 . . . . 0.0 108.104 179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.626 ' SD ' HD22 ' A' ' 13' ' ' LEU . 1.4 tpp -89.27 -83.66 0.23 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.536 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -46.92 -28.94 1.78 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.123 -0.986 . . . . 0.0 108.394 178.679 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 10.2 tttm -80.29 -41.62 24.59 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.324 -0.86 . . . . 0.0 108.8 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.535 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.2 OUTLIER -105.67 -60.76 1.59 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.224 -0.923 . . . . 0.0 109.538 179.586 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.626 HD22 ' SD ' ' A' ' 9' ' ' MET . 0.0 OUTLIER -61.79 -72.59 0.12 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.029 -1.044 . . . . 0.0 109.633 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.536 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.493 0 O-C-N 121.162 -0.961 . . . . 0.0 109.752 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.569 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 2.3 ttpt . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.519 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -109.1 8.94 33.54 Favored Glycine 0 N--CA 1.485 1.953 0 N-CA-C 107.714 -2.155 . . . . 0.0 107.714 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.489 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -137.84 -41.67 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 179.908 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -87.92 7.52 30.51 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -146.35 -26.86 0.42 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.642 -0.661 . . . . 0.0 109.844 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.532 ' SD ' ' N ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -79.85 -97.63 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.095 -1.003 . . . . 0.0 108.915 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.563 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -47.76 -30.03 3.59 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 120.565 -1.335 . . . . 0.0 108.667 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -70.44 -44.44 67.83 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.281 -0.887 . . . . 0.0 108.735 179.404 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.413 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.23 -59.85 1.88 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.135 -0.978 . . . . 0.0 109.714 179.587 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 9' ' ' MET . 2.9 tp -55.97 -72.72 0.07 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.193 -0.942 . . . . 0.0 109.755 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.563 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 O-C-N 121.094 -1.004 . . . . 0.0 109.465 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.774 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.654 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.482 ' C ' ' HB3' ' A' ' 9' ' ' MET . . . -103.98 16.73 50.08 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 107.33 -2.308 . . . . 0.0 107.33 178.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -143.64 -41.88 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.475 ' HA ' ' HG3' ' A' ' 11' ' ' LYS . . . -88.92 -10.87 46.22 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.467 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.774 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -125.39 -22.66 4.28 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.534 ' O ' ' N ' ' A' ' 13' ' ' LEU . 55.6 ttm -100.59 -79.27 0.5 Allowed 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.216 -0.927 . . . . 0.0 108.631 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.582 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -49.73 -28.28 5.9 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 120.828 -1.17 . . . . 0.0 108.024 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HG3' ' HA ' ' A' ' 7' ' ' ALA . 0.9 OUTLIER -76.05 -41.07 51.86 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.041 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -110.81 -63.1 1.44 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.391 -0.818 . . . . 0.0 109.771 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.534 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -59.18 -73.73 0.08 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.197 -0.939 . . . . 0.0 110.034 -179.831 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.582 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.181 -0.949 . . . . 0.0 109.43 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.608 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.488 0.661 . . . . 0.0 109.521 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.514 ' HA2' ' HG3' ' A' ' 9' ' ' MET . . . -109.62 7.52 31.9 Favored Glycine 0 N--CA 1.485 1.946 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 178.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -135.93 -35.26 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.486 ' O ' ' HD2' ' A' ' 11' ' ' LYS . . . -93.24 -3.4 53.78 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 121.12 -0.987 . . . . 0.0 108.728 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -129.83 -28.88 2.17 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -85.86 -86.39 0.14 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.234 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.421 ' C ' ' O ' ' A' ' 9' ' ' MET . . . -45.78 -28.23 1.01 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.486 ' HD2' ' O ' ' A' ' 7' ' ' ALA . 17.4 mttt -78.34 -44.02 26.27 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.16 -60.38 1.81 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.284 -0.885 . . . . 0.0 109.332 179.241 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.539 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.4 OUTLIER -51.41 -71.72 0.06 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.252 -0.905 . . . . 0.0 109.575 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.497 HD22 ' HA ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.488 1.446 0 O-C-N 121.14 -0.975 . . . . 0.0 109.35 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.842 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.503 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -102.79 14.08 56.2 Favored Glycine 0 N--CA 1.487 2.041 0 N-CA-C 107.404 -2.279 . . . . 0.0 107.404 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -139.56 -40.75 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -95.74 -5.31 42.34 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.842 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -129.53 -20.07 3.32 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.594 -0.691 . . . . 0.0 109.32 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.531 ' O ' ' N ' ' A' ' 13' ' ' LEU . 4.5 ttt -92.65 -89.87 0.19 Allowed 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.411 ' C ' ' O ' ' A' ' 9' ' ' MET . . . -48.21 -25.88 1.7 Allowed 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -46.62 53.67 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -111.02 -58.43 2.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.339 -0.851 . . . . 0.0 109.642 179.499 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.531 ' N ' ' O ' ' A' ' 9' ' ' MET . 6.0 mp -54.75 -70.89 0.09 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.092 -1.005 . . . . 0.0 109.479 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.458 ' HA ' HD13 ' A' ' 14' ' ' LEU . 2.7 mm? . . . . . 0 N--CA 1.491 1.579 0 O-C-N 121.221 -0.924 . . . . 0.0 109.359 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.776 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.584 0.707 . . . . 0.0 109.157 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.531 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -112.24 7.98 26.85 Favored Glycine 0 N--CA 1.485 1.92 0 N-CA-C 106.723 -2.551 . . . . 0.0 106.723 178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' A' ' 6' ' ' ILE . 4.2 mm -128.85 -38.54 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.49 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -89.49 -2.11 58.26 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 177.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -122.83 -33.92 3.29 Favored 'General case' 0 N--CA 1.485 1.3 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.555 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.3 OUTLIER -82.89 -96.96 0.05 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.18 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.557 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -43.31 -29.18 0.39 Allowed 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.818 -1.177 . . . . 0.0 108.782 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 12.6 tptp -74.06 -51.93 14.25 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.535 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -98.1 -62.33 1.26 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.142 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.555 ' N ' ' O ' ' A' ' 9' ' ' MET . 2.5 mm? -45.47 -69.23 0.14 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.342 -0.849 . . . . 0.0 109.305 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.557 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.752 0 O-C-N 120.834 -1.166 . . . . 0.0 109.455 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.0 mttt . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 121.643 0.735 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.531 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -122.91 6.28 9.56 Favored Glycine 0 N--CA 1.485 1.902 0 N-CA-C 107.0 -2.44 . . . . 0.0 107.0 178.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -134.23 -32.64 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -93.38 -5.0 50.45 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.475 ' O ' ' HB2' ' A' ' 12' ' ' LYS . . . -125.93 -25.76 3.55 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.532 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -93.28 -94.31 0.16 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.212 -0.93 . . . . 0.0 108.685 179.708 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.437 ' C ' ' O ' ' A' ' 9' ' ' MET . . . -45.44 -25.93 0.49 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 120.954 -1.091 . . . . 0.0 108.514 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.0 OUTLIER -75.27 -46.52 33.09 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.086 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 53.0 mttt -109.23 -56.95 2.22 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.319 -0.863 . . . . 0.0 109.438 179.393 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.4 mm? -54.56 -75.3 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.131 -0.981 . . . . 0.0 109.455 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.502 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 0.0 109.299 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.836 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.53 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -102.12 13.23 57.35 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 107.531 -2.228 . . . . 0.0 107.531 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.94 -38.65 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.82 -8.4 28.47 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.836 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -125.44 -18.21 5.37 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 13' ' ' LEU . 31.8 ttm -99.93 -83.24 0.44 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 14' ' ' LEU . . . -48.36 -31.6 6.36 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.691 -1.256 . . . . 0.0 108.069 178.328 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -43.66 69.63 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.294 -0.879 . . . . 0.0 108.807 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 48.2 mttt -110.4 -61.56 1.65 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.207 -0.933 . . . . 0.0 109.329 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.564 ' N ' ' O ' ' A' ' 9' ' ' MET . 1.9 mp -51.46 -72.3 0.05 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.893 . . . . 0.0 109.88 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.536 ' CD1' ' HG2' ' A' ' 9' ' ' MET . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 O-C-N 120.949 -1.094 . . . . 0.0 109.286 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.477 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.549 0.69 . . . . 0.0 109.406 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.505 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -111.97 3.12 27.15 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 178.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.538 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -136.36 -32.9 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -91.47 -12.66 33.99 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 121.106 -0.996 . . . . 0.0 108.59 179.014 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.536 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -116.82 -31.06 5.57 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.154 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.576 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -93.74 -81.34 0.37 Allowed 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 178.861 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 6' ' ' ILE . . . -41.2 -30.53 0.16 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.464 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 20.3 tptm -79.89 -47.17 15.51 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.217 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.536 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 4.6 tttt -96.89 -67.26 0.86 Allowed 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.576 ' N ' ' O ' ' A' ' 9' ' ' MET . 3.3 mm? -45.02 -68.05 0.23 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.447 -0.783 . . . . 0.0 109.136 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.538 ' HB3' ' HA ' ' A' ' 10' ' ' ALA . 5.4 tp . . . . . 0 N--CA 1.494 1.739 0 O-C-N 120.965 -1.084 . . . . 0.0 109.328 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.973 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.502 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.829 ' O ' HD12 ' A' ' 6' ' ' ILE . . . -103.85 14.26 52.9 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 107.864 -2.094 . . . . 0.0 107.864 178.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.829 HD12 ' O ' ' A' ' 5' ' ' GLY . 1.4 mp -138.12 -41.47 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.63 -2.72 44.19 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.973 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -131.1 -21.98 2.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.607 -0.683 . . . . 0.0 109.374 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 13' ' ' LEU . 36.2 ttm -83.88 -89.21 0.1 Allowed 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.546 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -50.64 -23.4 2.58 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 178.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.474 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -79.86 -41.45 26.25 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.344 -0.848 . . . . 0.0 108.715 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.13 -59.77 1.89 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.405 -0.81 . . . . 0.0 109.151 179.683 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.541 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.8 mp -62.72 -73.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.106 -0.996 . . . . 0.0 109.349 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.546 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 3.8 mm? . . . . . 0 N--CA 1.489 1.497 0 O-C-N 121.209 -0.932 . . . . 0.0 109.393 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.439 ' O ' ' HB2' ' A' ' 2' ' ' ASN . 3.5 pt . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 121.416 0.627 . . . . 0.0 109.315 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.489 ' O ' ' HB ' ' A' ' 6' ' ' ILE . 0.2 OUTLIER 168.37 106.88 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.346 -0.846 . . . . 0.0 109.214 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.847 ' CD2' ' HB2' ' A' ' 7' ' ' ALA . 1.7 t-105 -83.76 12.98 5.17 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.178 -0.951 . . . . 0.0 109.835 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.549 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 27.7 ttpt -117.52 -18.12 9.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.268 -0.895 . . . . 0.0 109.06 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -114.48 16.69 19.25 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 107.132 -2.387 . . . . 0.0 107.132 178.216 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.503 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 1.3 mp -141.37 -41.79 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.847 ' HB2' ' CD2' ' A' ' 3' ' ' TRP . . . -89.34 -1.33 58.02 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -134.9 -26.3 1.35 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.543 -0.723 . . . . 0.0 109.552 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.561 ' HA ' HD12 ' A' ' 13' ' ' LEU . 37.8 ttm -91.48 -95.92 0.13 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.996 -1.065 . . . . 0.0 108.998 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.516 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -46.19 -27.69 1.06 Allowed 'General case' 0 C--N 1.305 -1.335 0 O-C-N 120.943 -1.098 . . . . 0.0 108.785 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 6' ' ' ILE . 10.5 tptt -74.09 -45.5 48.81 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.264 -0.898 . . . . 0.0 108.668 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.502 ' HB3' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -109.81 -57.73 2.15 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.292 -0.88 . . . . 0.0 109.701 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 9' ' ' MET . 20.3 mt -59.83 -78.76 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.088 -1.007 . . . . 0.0 109.877 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.502 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 0.9 OUTLIER -84.7 19.97 1.89 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.112 -0.993 . . . . 0.0 109.653 -179.558 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . 0.516 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.308 0 O-C-N 119.892 -1.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.413 HG13 ' OD1' ' A' ' 2' ' ' ASN . 2.1 pt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.413 ' OD1' HG13 ' A' ' 1' ' ' ILE . 2.7 p-10 -156.36 60.16 0.56 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.274 -0.891 . . . . 0.0 109.68 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.734 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 10.5 t-105 66.27 10.71 7.38 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.149 -0.969 . . . . 0.0 109.831 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.835 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 11.2 mmtt -113.98 -11.6 12.75 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.077 -1.014 . . . . 0.0 109.579 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.505 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -117.89 6.74 15.49 Favored Glycine 0 N--CA 1.483 1.816 0 N-CA-C 106.53 -2.628 . . . . 0.0 106.53 178.067 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.457 HD13 ' HA ' ' A' ' 6' ' ' ILE . 11.9 mm -126.5 -36.23 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.734 ' HB2' ' CE2' ' A' ' 3' ' ' TRP . . . -100.29 8.37 43.77 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.835 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -132.12 -31.04 1.49 Allowed 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.533 ' O ' ' N ' ' A' ' 13' ' ' LEU . 40.0 mtt -82.25 -97.3 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.345 -0.847 . . . . 0.0 109.168 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.535 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -47.38 -25.7 1.1 Allowed 'General case' 0 C--N 1.307 -1.24 0 O-C-N 120.829 -1.17 . . . . 0.0 108.274 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' N ' ' C ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -72.53 -46.18 55.76 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.076 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.88 -55.06 2.45 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.378 -0.826 . . . . 0.0 109.901 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.8 tt -53.33 -69.25 0.12 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.231 -0.918 . . . . 0.0 109.646 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.535 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -84.83 3.93 35.5 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.076 -1.015 . . . . 0.0 109.224 179.938 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.366 0 O-C-N 119.888 -1.757 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.606 HG22 ' ND2' ' A' ' 2' ' ' ASN . 5.3 mt . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.606 ' ND2' HG22 ' A' ' 1' ' ' ILE . 0.0 OUTLIER -171.79 -75.96 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.33 -0.856 . . . . 0.0 108.868 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.625 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 12.3 t-105 -109.6 -16.4 13.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.153 -0.967 . . . . 0.0 109.345 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.533 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 3.8 tptt -101.3 1.86 39.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.23 -0.919 . . . . 0.0 109.181 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.53 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -113.26 5.11 25.17 Favored Glycine 0 N--CA 1.485 1.909 0 N-CA-C 106.9 -2.48 . . . . 0.0 106.9 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -134.56 -37.72 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 3' ' ' TRP . . . -84.3 -9.17 58.7 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -123.28 -24.86 4.57 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.556 ' HA ' ' HB2' ' A' ' 13' ' ' LEU . 16.4 ttt -104.31 -82.64 0.51 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.17 -0.956 . . . . 0.0 109.048 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.507 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -47.97 -25.55 1.41 Allowed 'General case' 0 C--N 1.307 -1.282 0 O-C-N 120.666 -1.271 . . . . 0.0 108.01 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.437 ' HB3' ' C ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -75.28 -44.87 43.37 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.46 -57.19 2.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 109.877 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 9' ' ' MET . 0.2 OUTLIER -54.83 -70.89 0.09 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.605 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.483 HD23 ' HA ' ' A' ' 14' ' ' LEU . 18.5 mt -103.64 33.41 3.39 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.28 -0.887 . . . . 0.0 108.958 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . 0.507 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.29 0 O-C-N 120.015 -1.678 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.481 ' CG ' ' N ' ' A' ' 3' ' ' TRP . 2.7 p30 -149.43 -50.52 0.15 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.28 -0.887 . . . . 0.0 109.798 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.607 ' CZ2' ' HB2' ' A' ' 7' ' ' ALA . 15.5 t-105 -129.64 -16.98 3.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.129 -0.982 . . . . 0.0 110.422 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.615 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -93.64 -3.7 52.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.81 -1.182 . . . . 0.0 109.638 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.47 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -111.17 15.21 28.09 Favored Glycine 0 N--CA 1.487 2.049 0 N-CA-C 107.363 -2.295 . . . . 0.0 107.363 178.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.407 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -140.4 -39.07 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 -179.694 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HB2' ' CZ2' ' A' ' 3' ' ' TRP . . . -95.12 -4.54 46.0 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.005 -1.059 . . . . 0.0 108.274 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -129.04 -24.52 2.89 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.85 ' SD ' HD23 ' A' ' 13' ' ' LEU . 1.6 tpp -91.5 -98.11 0.12 Allowed 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.572 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -44.61 -26.21 0.35 Allowed 'General case' 0 C--N 1.305 -1.354 0 O-C-N 120.794 -1.191 . . . . 0.0 108.837 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.412 ' N ' ' O ' ' A' ' 9' ' ' MET . 1.3 tmtm? -76.54 -45.17 31.84 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.187 -0.946 . . . . 0.0 108.958 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -115.81 -49.94 2.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.142 -0.973 . . . . 0.0 110.274 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.85 HD23 ' SD ' ' A' ' 9' ' ' MET . 11.7 tp -56.16 -68.27 0.22 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.166 -0.959 . . . . 0.0 110.048 -179.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.572 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 2.6 tt -56.72 -15.62 4.92 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.789 -1.194 . . . . 0.0 109.309 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.432 0 O-C-N 120.033 -1.667 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.421 HD12 ' HB2' ' A' ' 2' ' ' ASN . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.202 0.525 . . . . 0.0 109.634 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.421 ' HB2' HD12 ' A' ' 1' ' ' ILE . 1.7 m-20 -125.91 147.64 49.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.236 -0.915 . . . . 0.0 108.597 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.515 ' CZ2' ' HB2' ' A' ' 7' ' ' ALA . 8.3 t-105 -170.0 -24.45 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.925 -1.11 . . . . 0.0 111.198 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.605 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -89.37 3.92 50.65 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.355 -1.465 . . . . 0.0 109.639 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.475 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -111.83 3.46 27.4 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 108.133 -1.987 . . . . 0.0 108.133 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.432 HD12 ' O ' ' A' ' 5' ' ' GLY . 0.8 OUTLIER -134.53 -31.34 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 O-C-N 121.704 -0.88 . . . . 0.0 108.76 -179.95 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.515 ' HB2' ' CZ2' ' A' ' 3' ' ' TRP . . . -101.18 -6.67 23.96 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.188 -0.945 . . . . 0.0 108.518 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.605 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -122.31 -26.16 4.7 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.104 -1.072 . . . . 0.0 108.104 179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.626 ' SD ' HD22 ' A' ' 13' ' ' LEU . 1.4 tpp -89.27 -83.66 0.23 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.536 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -46.92 -28.94 1.78 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.123 -0.986 . . . . 0.0 108.394 178.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 10.2 tttm -80.29 -41.62 24.59 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.324 -0.86 . . . . 0.0 108.8 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.535 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.2 OUTLIER -105.67 -60.76 1.59 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.224 -0.923 . . . . 0.0 109.538 179.586 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.626 HD22 ' SD ' ' A' ' 9' ' ' MET . 0.0 OUTLIER -61.79 -72.59 0.12 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.029 -1.044 . . . . 0.0 109.633 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.536 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -86.69 22.91 1.8 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.162 -0.961 . . . . 0.0 109.752 -179.614 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . 0.491 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.323 0 O-C-N 119.796 -1.815 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.447 HG22 ' N ' ' A' ' 2' ' ' ASN . 19.3 mm . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.447 ' N ' HG22 ' A' ' 1' ' ' ILE . 27.2 m120 -82.98 173.19 12.01 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.677 -1.264 . . . . 0.0 109.226 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.997 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 2.0 t-105 -122.41 -12.2 8.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.3 -0.875 . . . . 0.0 109.593 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.569 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 2.3 ttpt -104.85 -18.3 14.27 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.161 -0.962 . . . . 0.0 108.963 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.519 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -109.1 8.94 33.54 Favored Glycine 0 N--CA 1.485 1.953 0 N-CA-C 107.714 -2.155 . . . . 0.0 107.714 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.489 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -137.84 -41.67 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 179.908 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.997 ' HB3' ' O ' ' A' ' 3' ' ' TRP . . . -87.92 7.52 30.51 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -146.35 -26.86 0.42 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.642 -0.661 . . . . 0.0 109.844 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.532 ' SD ' ' N ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -79.85 -97.63 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.095 -1.003 . . . . 0.0 108.915 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.563 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -47.76 -30.03 3.59 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 120.565 -1.335 . . . . 0.0 108.667 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -70.44 -44.44 67.83 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.281 -0.887 . . . . 0.0 108.735 179.404 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.413 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.23 -59.85 1.88 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.135 -0.978 . . . . 0.0 109.714 179.587 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 9' ' ' MET . 2.9 tp -55.97 -72.72 0.07 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.193 -0.942 . . . . 0.0 109.755 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.563 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.3 OUTLIER -84.46 17.65 2.56 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.094 -1.004 . . . . 0.0 109.465 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . 0.408 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.318 0 O-C-N 119.739 -1.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.457 ' O ' ' O ' ' A' ' 2' ' ' ASN . 9.7 mm . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.391 0.615 . . . . 0.0 109.456 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.662 ' HB3' HD12 ' A' ' 6' ' ' ILE . 0.1 OUTLIER 45.63 94.28 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.253 -0.905 . . . . 0.0 109.632 179.657 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.63 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 13.5 t-105 -101.29 -16.32 16.98 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.032 -1.042 . . . . 0.0 109.365 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.774 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -101.67 -12.92 18.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.28 -0.888 . . . . 0.0 109.006 179.547 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.482 ' C ' ' HB3' ' A' ' 9' ' ' MET . . . -103.98 16.73 50.08 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 107.33 -2.308 . . . . 0.0 107.33 178.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.662 HD12 ' HB3' ' A' ' 2' ' ' ASN . 0.3 OUTLIER -143.64 -41.88 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' A' ' 3' ' ' TRP . . . -88.92 -10.87 46.22 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.467 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.774 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -125.39 -22.66 4.28 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.534 ' O ' ' N ' ' A' ' 13' ' ' LEU . 55.6 ttm -100.59 -79.27 0.5 Allowed 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.216 -0.927 . . . . 0.0 108.631 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.582 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -49.73 -28.28 5.9 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 120.828 -1.17 . . . . 0.0 108.024 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HG3' ' HA ' ' A' ' 7' ' ' ALA . 0.9 OUTLIER -76.05 -41.07 51.86 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.041 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -110.81 -63.1 1.44 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.391 -0.818 . . . . 0.0 109.771 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.534 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -59.18 -73.73 0.08 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.197 -0.939 . . . . 0.0 110.034 -179.831 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.582 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 1.0 OUTLIER -81.51 11.7 4.37 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.181 -0.949 . . . . 0.0 109.43 -179.654 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . 0.502 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.304 -1.378 0 O-C-N 119.878 -1.764 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 3.9 pt . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.12 0.486 . . . . 0.0 109.767 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 57.56 89.52 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.126 -0.984 . . . . 0.0 109.607 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.704 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 18.9 t-105 -94.01 -8.51 39.7 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.212 -0.93 . . . . 0.0 109.738 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.608 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -103.32 -7.32 21.17 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.23 -0.919 . . . . 0.0 109.521 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.514 ' HA2' ' HG3' ' A' ' 9' ' ' MET . . . -109.62 7.52 31.9 Favored Glycine 0 N--CA 1.485 1.946 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 178.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -135.93 -35.26 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.704 ' HB3' ' O ' ' A' ' 3' ' ' TRP . . . -93.24 -3.4 53.78 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 121.12 -0.987 . . . . 0.0 108.728 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -129.83 -28.88 2.17 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -85.86 -86.39 0.14 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.234 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -45.78 -28.23 1.01 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.486 ' HD2' ' O ' ' A' ' 7' ' ' ALA . 17.4 mttt -78.34 -44.02 26.27 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.16 -60.38 1.81 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.284 -0.885 . . . . 0.0 109.332 179.241 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.539 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.4 OUTLIER -51.41 -71.72 0.06 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.252 -0.905 . . . . 0.0 109.575 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.497 ' HA ' HD22 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -102.7 28.86 5.73 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.14 -0.975 . . . . 0.0 109.35 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . 0.517 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.305 -1.336 0 O-C-N 119.945 -1.722 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.768 ' O ' HG23 ' A' ' 1' ' ' ILE . 5.8 tt . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.561 ' CB ' ' O ' ' A' ' 1' ' ' ILE . 4.8 t30 82.16 -66.12 0.11 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.6 -0.687 . . . . 0.0 109.895 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.578 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 12.7 t-105 -93.19 -11.72 32.04 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.098 -1.001 . . . . 0.0 109.999 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.842 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -103.17 -14.59 16.32 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.11 -0.994 . . . . 0.0 109.158 179.691 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.503 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -102.79 14.08 56.2 Favored Glycine 0 N--CA 1.487 2.041 0 N-CA-C 107.404 -2.279 . . . . 0.0 107.404 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -139.56 -40.75 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.578 ' HB3' ' O ' ' A' ' 3' ' ' TRP . . . -95.74 -5.31 42.34 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.842 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -129.53 -20.07 3.32 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.594 -0.691 . . . . 0.0 109.32 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.531 ' O ' ' N ' ' A' ' 13' ' ' LEU . 4.5 ttt -92.65 -89.87 0.19 Allowed 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.514 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -48.21 -25.88 1.7 Allowed 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -46.62 53.67 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -111.02 -58.43 2.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.339 -0.851 . . . . 0.0 109.642 179.499 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.531 ' N ' ' O ' ' A' ' 9' ' ' MET . 6.0 mp -54.75 -70.89 0.09 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.092 -1.005 . . . . 0.0 109.479 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.458 ' HA ' HD13 ' A' ' 14' ' ' LEU . 2.7 mm? -97.12 29.32 3.18 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.221 -0.924 . . . . 0.0 109.359 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . 0.514 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.305 -1.348 0 O-C-N 119.892 -1.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.427 ' O ' ' HB2' ' A' ' 2' ' ' ASN . 4.5 pt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 1' ' ' ILE . 2.0 m120 63.32 130.57 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.905 . . . . 0.0 109.492 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.779 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 15.1 t-105 -96.6 7.95 45.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.174 -0.954 . . . . 0.0 109.507 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.776 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -112.15 -10.35 13.88 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.268 -0.895 . . . . 0.0 109.157 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.531 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -112.24 7.98 26.85 Favored Glycine 0 N--CA 1.485 1.92 0 N-CA-C 106.723 -2.551 . . . . 0.0 106.723 178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' A' ' 6' ' ' ILE . 4.2 mm -128.85 -38.54 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.779 ' HB2' ' CE2' ' A' ' 3' ' ' TRP . . . -89.49 -2.11 58.26 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 177.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -122.83 -33.92 3.29 Favored 'General case' 0 N--CA 1.485 1.3 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.555 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.3 OUTLIER -82.89 -96.96 0.05 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.18 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.557 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -43.31 -29.18 0.39 Allowed 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.818 -1.177 . . . . 0.0 108.782 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 12.6 tptp -74.06 -51.93 14.25 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.535 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -98.1 -62.33 1.26 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.142 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.555 ' N ' ' O ' ' A' ' 9' ' ' MET . 2.5 mm? -45.47 -69.23 0.14 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.342 -0.849 . . . . 0.0 109.305 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.557 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.6 OUTLIER -75.74 -7.07 53.48 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.834 -1.166 . . . . 0.0 109.455 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.422 0 O-C-N 119.812 -1.805 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 5.3 mt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.533 ' O ' ' HB3' ' A' ' 3' ' ' TRP . 0.0 OUTLIER -175.7 112.38 0.12 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.139 -0.975 . . . . 0.0 110.071 -179.814 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.533 ' HB3' ' O ' ' A' ' 2' ' ' ASN . 5.8 t-105 81.22 -35.45 0.11 Allowed 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.65 -0.656 . . . . 0.0 110.83 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.0 mttt -93.86 12.64 25.2 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.676 -1.265 . . . . 0.0 109.553 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.531 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -122.91 6.28 9.56 Favored Glycine 0 N--CA 1.485 1.902 0 N-CA-C 107.0 -2.44 . . . . 0.0 107.0 178.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -134.23 -32.64 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -93.38 -5.0 50.45 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.475 ' O ' ' HB2' ' A' ' 12' ' ' LYS . . . -125.93 -25.76 3.55 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.532 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -93.28 -94.31 0.16 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.212 -0.93 . . . . 0.0 108.685 179.708 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.528 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -45.44 -25.93 0.49 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 120.954 -1.091 . . . . 0.0 108.514 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.0 OUTLIER -75.27 -46.52 33.09 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.086 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 53.0 mttt -109.23 -56.95 2.22 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.319 -0.863 . . . . 0.0 109.438 179.393 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.4 mm? -54.56 -75.3 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.131 -0.981 . . . . 0.0 109.455 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.502 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -98.76 32.23 2.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 0.0 109.299 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . 0.528 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.305 -1.355 0 O-C-N 119.95 -1.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.474 HG13 ' O ' ' A' ' 1' ' ' ILE . 10.4 pt . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -151.26 -70.54 0.17 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.157 -0.964 . . . . 0.0 109.683 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -71.21 -25.96 62.74 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.183 -0.948 . . . . 0.0 109.357 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.836 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.1 OUTLIER -92.08 -6.55 50.73 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.282 -0.887 . . . . 0.0 109.148 179.528 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.53 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -102.12 13.23 57.35 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 107.531 -2.228 . . . . 0.0 107.531 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.94 -38.65 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.82 -8.4 28.47 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.836 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -125.44 -18.21 5.37 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 13' ' ' LEU . 31.8 ttm -99.93 -83.24 0.44 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 14' ' ' LEU . . . -48.36 -31.6 6.36 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.691 -1.256 . . . . 0.0 108.069 178.328 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -43.66 69.63 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.294 -0.879 . . . . 0.0 108.807 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 48.2 mttt -110.4 -61.56 1.65 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.207 -0.933 . . . . 0.0 109.329 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.564 ' N ' ' O ' ' A' ' 9' ' ' MET . 1.9 mp -51.46 -72.3 0.05 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.893 . . . . 0.0 109.88 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.536 ' CD1' ' HG2' ' A' ' 9' ' ' MET . 0.2 OUTLIER -93.49 24.34 4.05 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.949 -1.094 . . . . 0.0 109.286 -179.879 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.305 -1.354 0 O-C-N 119.889 -1.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 16.0 pt . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -107.96 -156.97 0.6 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.247 -0.908 . . . . 0.0 109.299 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.826 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 9.4 t-105 -125.16 -7.17 7.11 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.137 -0.977 . . . . 0.0 109.637 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.477 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.1 OUTLIER -104.68 -1.79 25.85 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.182 -0.949 . . . . 0.0 109.406 179.65 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.505 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -111.97 3.12 27.15 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 178.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.538 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -136.36 -32.9 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.826 ' HB3' ' O ' ' A' ' 3' ' ' TRP . . . -91.47 -12.66 33.99 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 121.106 -0.996 . . . . 0.0 108.59 179.014 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.536 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -116.82 -31.06 5.57 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.154 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.576 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -93.74 -81.34 0.37 Allowed 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 178.861 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 6' ' ' ILE . . . -41.2 -30.53 0.16 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 20.3 tptm -79.89 -47.17 15.51 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.217 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.536 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 4.6 tttt -96.89 -67.26 0.86 Allowed 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.576 ' N ' ' O ' ' A' ' 9' ' ' MET . 3.3 mm? -45.02 -68.05 0.23 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.447 -0.783 . . . . 0.0 109.136 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.538 ' HB3' ' HA ' ' A' ' 10' ' ' ALA . 5.4 tp -84.21 0.03 50.38 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.965 -1.084 . . . . 0.0 109.328 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.364 0 O-C-N 119.934 -1.729 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.53 HD11 HD11 ' A' ' 6' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -171.98 -49.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.074 -1.016 . . . . 0.0 109.572 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.573 ' HA ' ' CE3' ' A' ' 3' ' ' TRP . 0.0 OUTLIER -174.43 31.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.115 -0.99 . . . . 0.0 109.658 -179.687 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.973 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -131.73 -31.9 1.51 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.331 -0.855 . . . . 0.0 109.558 179.691 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.829 ' O ' HD12 ' A' ' 6' ' ' ILE . . . -103.85 14.26 52.9 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 107.864 -2.094 . . . . 0.0 107.864 178.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.829 HD12 ' O ' ' A' ' 5' ' ' GLY . 1.4 mp -138.12 -41.47 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.565 ' HB2' ' CD2' ' A' ' 3' ' ' TRP . . . -96.63 -2.72 44.19 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 178.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.973 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -131.1 -21.98 2.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.607 -0.683 . . . . 0.0 109.374 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 13' ' ' LEU . 36.2 ttm -83.88 -89.21 0.1 Allowed 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.546 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -50.64 -23.4 2.58 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 178.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.474 ' HA ' ' HE2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -79.86 -41.45 26.25 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.344 -0.848 . . . . 0.0 108.715 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.13 -59.77 1.89 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.405 -0.81 . . . . 0.0 109.151 179.683 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.541 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.8 mp -62.72 -73.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.106 -0.996 . . . . 0.0 109.349 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.546 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 3.8 mm? -88.58 31.55 0.83 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.209 -0.932 . . . . 0.0 109.393 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' NH2 . . . . . 0.482 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.295 0 O-C-N 119.934 -1.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.549 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 27.7 ttpt . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.612 0.72 . . . . 0.0 109.06 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -114.48 16.69 19.25 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 107.132 -2.387 . . . . 0.0 107.132 178.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.503 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 1.3 mp -141.37 -41.79 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.34 -1.33 58.02 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -134.9 -26.3 1.35 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.543 -0.723 . . . . 0.0 109.552 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.561 ' HA ' HD12 ' A' ' 13' ' ' LEU . 37.8 ttm -91.48 -95.92 0.13 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.996 -1.065 . . . . 0.0 108.998 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.502 ' HA ' ' HB2' ' A' ' 14' ' ' LEU . . . -46.19 -27.69 1.06 Allowed 'General case' 0 C--N 1.305 -1.335 0 O-C-N 120.943 -1.098 . . . . 0.0 108.785 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 6' ' ' ILE . 10.5 tptt -74.09 -45.5 48.81 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.264 -0.898 . . . . 0.0 108.668 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.502 ' HB3' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -109.81 -57.73 2.15 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.292 -0.88 . . . . 0.0 109.701 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 9' ' ' MET . 20.3 mt -59.83 -78.76 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.088 -1.007 . . . . 0.0 109.877 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.502 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 O-C-N 121.112 -0.993 . . . . 0.0 109.653 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.835 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 11.2 mmtt . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.648 0.737 . . . . 0.0 109.579 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.505 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -117.89 6.74 15.49 Favored Glycine 0 N--CA 1.483 1.816 0 N-CA-C 106.53 -2.628 . . . . 0.0 106.53 178.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.457 HD13 ' HA ' ' A' ' 6' ' ' ILE . 11.9 mm -126.5 -36.23 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -100.29 8.37 43.77 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.835 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -132.12 -31.04 1.49 Allowed 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.533 ' O ' ' N ' ' A' ' 13' ' ' LEU . 40.0 mtt -82.25 -97.3 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.345 -0.847 . . . . 0.0 109.168 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.535 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -47.38 -25.7 1.1 Allowed 'General case' 0 C--N 1.307 -1.24 0 O-C-N 120.829 -1.17 . . . . 0.0 108.274 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' N ' ' C ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -72.53 -46.18 55.76 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.076 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.88 -55.06 2.45 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.378 -0.826 . . . . 0.0 109.901 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.8 tt -53.33 -69.25 0.12 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.231 -0.918 . . . . 0.0 109.646 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.535 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.522 0 O-C-N 121.076 -1.015 . . . . 0.0 109.224 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.533 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 3.8 tptt . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.601 0.715 . . . . 0.0 109.181 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.53 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -113.26 5.11 25.17 Favored Glycine 0 N--CA 1.485 1.909 0 N-CA-C 106.9 -2.48 . . . . 0.0 106.9 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -134.56 -37.72 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.437 ' C ' ' HB3' ' A' ' 11' ' ' LYS . . . -84.3 -9.17 58.7 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -123.28 -24.86 4.57 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.556 ' HA ' ' HB2' ' A' ' 13' ' ' LEU . 16.4 ttt -104.31 -82.64 0.51 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.17 -0.956 . . . . 0.0 109.048 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.428 ' C ' ' O ' ' A' ' 9' ' ' MET . . . -47.97 -25.55 1.41 Allowed 'General case' 0 C--N 1.307 -1.282 0 O-C-N 120.666 -1.271 . . . . 0.0 108.01 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.437 ' HB3' ' C ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -75.28 -44.87 43.37 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.46 -57.19 2.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 109.877 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 9' ' ' MET . 0.2 OUTLIER -54.83 -70.89 0.09 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.605 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.483 HD23 ' HA ' ' A' ' 14' ' ' LEU . 18.5 mt . . . . . 0 N--CA 1.487 1.416 0 O-C-N 121.28 -0.887 . . . . 0.0 108.958 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.615 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.457 0.646 . . . . 0.0 109.638 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.47 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -111.17 15.21 28.09 Favored Glycine 0 N--CA 1.487 2.049 0 N-CA-C 107.363 -2.295 . . . . 0.0 107.363 178.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.407 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -140.4 -39.07 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 -179.694 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -95.12 -4.54 46.0 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.005 -1.059 . . . . 0.0 108.274 178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -129.04 -24.52 2.89 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.85 ' SD ' HD23 ' A' ' 13' ' ' LEU . 1.6 tpp -91.5 -98.11 0.12 Allowed 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.572 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -44.61 -26.21 0.35 Allowed 'General case' 0 C--N 1.305 -1.354 0 O-C-N 120.794 -1.191 . . . . 0.0 108.837 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.412 ' N ' ' O ' ' A' ' 9' ' ' MET . 1.3 tmtm? -76.54 -45.17 31.84 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.187 -0.946 . . . . 0.0 108.958 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -115.81 -49.94 2.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.142 -0.973 . . . . 0.0 110.274 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.85 HD23 ' SD ' ' A' ' 9' ' ' MET . 11.7 tp -56.16 -68.27 0.22 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.166 -0.959 . . . . 0.0 110.048 -179.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.572 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 2.6 tt . . . . . 0 N--CA 1.492 1.657 0 O-C-N 120.789 -1.194 . . . . 0.0 109.309 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.605 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.713 0 CA-C-O 121.289 0.566 . . . . 0.0 109.639 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.475 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -111.83 3.46 27.4 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 108.133 -1.987 . . . . 0.0 108.133 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.432 HD12 ' O ' ' A' ' 5' ' ' GLY . 0.8 OUTLIER -134.53 -31.34 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 O-C-N 121.704 -0.88 . . . . 0.0 108.76 -179.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -101.18 -6.67 23.96 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.188 -0.945 . . . . 0.0 108.518 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.605 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -122.31 -26.16 4.7 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.104 -1.072 . . . . 0.0 108.104 179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.626 ' SD ' HD22 ' A' ' 13' ' ' LEU . 1.4 tpp -89.27 -83.66 0.23 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.536 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -46.92 -28.94 1.78 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.123 -0.986 . . . . 0.0 108.394 178.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 10.2 tttm -80.29 -41.62 24.59 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.324 -0.86 . . . . 0.0 108.8 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.535 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.2 OUTLIER -105.67 -60.76 1.59 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.224 -0.923 . . . . 0.0 109.538 179.586 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.626 HD22 ' SD ' ' A' ' 9' ' ' MET . 0.0 OUTLIER -61.79 -72.59 0.12 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.029 -1.044 . . . . 0.0 109.633 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.536 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.493 0 O-C-N 121.162 -0.961 . . . . 0.0 109.752 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.569 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 2.3 ttpt . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.519 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -109.1 8.94 33.54 Favored Glycine 0 N--CA 1.485 1.953 0 N-CA-C 107.714 -2.155 . . . . 0.0 107.714 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.489 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -137.84 -41.67 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 179.908 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -87.92 7.52 30.51 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -146.35 -26.86 0.42 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.642 -0.661 . . . . 0.0 109.844 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.532 ' SD ' ' N ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -79.85 -97.63 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.095 -1.003 . . . . 0.0 108.915 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.563 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -47.76 -30.03 3.59 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 120.565 -1.335 . . . . 0.0 108.667 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -70.44 -44.44 67.83 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.281 -0.887 . . . . 0.0 108.735 179.404 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.413 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.23 -59.85 1.88 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.135 -0.978 . . . . 0.0 109.714 179.587 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 9' ' ' MET . 2.9 tp -55.97 -72.72 0.07 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.193 -0.942 . . . . 0.0 109.755 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.563 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 O-C-N 121.094 -1.004 . . . . 0.0 109.465 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.774 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.654 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.482 ' C ' ' HB3' ' A' ' 9' ' ' MET . . . -103.98 16.73 50.08 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 107.33 -2.308 . . . . 0.0 107.33 178.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -143.64 -41.88 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.475 ' HA ' ' HG3' ' A' ' 11' ' ' LYS . . . -88.92 -10.87 46.22 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.774 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -125.39 -22.66 4.28 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.534 ' O ' ' N ' ' A' ' 13' ' ' LEU . 55.6 ttm -100.59 -79.27 0.5 Allowed 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.216 -0.927 . . . . 0.0 108.631 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.582 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -49.73 -28.28 5.9 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 120.828 -1.17 . . . . 0.0 108.024 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HG3' ' HA ' ' A' ' 7' ' ' ALA . 0.9 OUTLIER -76.05 -41.07 51.86 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.041 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -110.81 -63.1 1.44 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.391 -0.818 . . . . 0.0 109.771 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.534 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -59.18 -73.73 0.08 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.197 -0.939 . . . . 0.0 110.034 -179.831 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.582 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.181 -0.949 . . . . 0.0 109.43 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.608 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.488 0.661 . . . . 0.0 109.521 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.514 ' HA2' ' HG3' ' A' ' 9' ' ' MET . . . -109.62 7.52 31.9 Favored Glycine 0 N--CA 1.485 1.946 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 178.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -135.93 -35.26 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.486 ' O ' ' HD2' ' A' ' 11' ' ' LYS . . . -93.24 -3.4 53.78 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 121.12 -0.987 . . . . 0.0 108.728 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -129.83 -28.88 2.17 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -85.86 -86.39 0.14 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.234 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.421 ' C ' ' O ' ' A' ' 9' ' ' MET . . . -45.78 -28.23 1.01 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.486 ' HD2' ' O ' ' A' ' 7' ' ' ALA . 17.4 mttt -78.34 -44.02 26.27 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.16 -60.38 1.81 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.284 -0.885 . . . . 0.0 109.332 179.241 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.539 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.4 OUTLIER -51.41 -71.72 0.06 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.252 -0.905 . . . . 0.0 109.575 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.497 HD22 ' HA ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.488 1.446 0 O-C-N 121.14 -0.975 . . . . 0.0 109.35 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.842 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.503 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -102.79 14.08 56.2 Favored Glycine 0 N--CA 1.487 2.041 0 N-CA-C 107.404 -2.279 . . . . 0.0 107.404 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -139.56 -40.75 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -95.74 -5.31 42.34 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.842 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -129.53 -20.07 3.32 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.594 -0.691 . . . . 0.0 109.32 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.531 ' O ' ' N ' ' A' ' 13' ' ' LEU . 4.5 ttt -92.65 -89.87 0.19 Allowed 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.411 ' C ' ' O ' ' A' ' 9' ' ' MET . . . -48.21 -25.88 1.7 Allowed 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -46.62 53.67 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -111.02 -58.43 2.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.339 -0.851 . . . . 0.0 109.642 179.499 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.531 ' N ' ' O ' ' A' ' 9' ' ' MET . 6.0 mp -54.75 -70.89 0.09 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.092 -1.005 . . . . 0.0 109.479 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.458 ' HA ' HD13 ' A' ' 14' ' ' LEU . 2.7 mm? . . . . . 0 N--CA 1.491 1.579 0 O-C-N 121.221 -0.924 . . . . 0.0 109.359 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.776 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.584 0.707 . . . . 0.0 109.157 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.531 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -112.24 7.98 26.85 Favored Glycine 0 N--CA 1.485 1.92 0 N-CA-C 106.723 -2.551 . . . . 0.0 106.723 178.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' A' ' 6' ' ' ILE . 4.2 mm -128.85 -38.54 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.49 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -89.49 -2.11 58.26 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 177.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -122.83 -33.92 3.29 Favored 'General case' 0 N--CA 1.485 1.3 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.555 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.3 OUTLIER -82.89 -96.96 0.05 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.18 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.557 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -43.31 -29.18 0.39 Allowed 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.818 -1.177 . . . . 0.0 108.782 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 12.6 tptp -74.06 -51.93 14.25 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.535 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -98.1 -62.33 1.26 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.142 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.555 ' N ' ' O ' ' A' ' 9' ' ' MET . 2.5 mm? -45.47 -69.23 0.14 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.342 -0.849 . . . . 0.0 109.305 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.557 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.752 0 O-C-N 120.834 -1.166 . . . . 0.0 109.455 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.0 mttt . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 121.643 0.735 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.531 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -122.91 6.28 9.56 Favored Glycine 0 N--CA 1.485 1.902 0 N-CA-C 107.0 -2.44 . . . . 0.0 107.0 178.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -134.23 -32.64 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -93.38 -5.0 50.45 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.475 ' O ' ' HB2' ' A' ' 12' ' ' LYS . . . -125.93 -25.76 3.55 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.532 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -93.28 -94.31 0.16 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.212 -0.93 . . . . 0.0 108.685 179.708 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.437 ' C ' ' O ' ' A' ' 9' ' ' MET . . . -45.44 -25.93 0.49 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 120.954 -1.091 . . . . 0.0 108.514 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.0 OUTLIER -75.27 -46.52 33.09 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.086 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 53.0 mttt -109.23 -56.95 2.22 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.319 -0.863 . . . . 0.0 109.438 179.393 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.4 mm? -54.56 -75.3 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.131 -0.981 . . . . 0.0 109.455 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.502 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 0.0 109.299 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.836 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.53 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -102.12 13.23 57.35 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 107.531 -2.228 . . . . 0.0 107.531 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.94 -38.65 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.82 -8.4 28.47 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.836 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -125.44 -18.21 5.37 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 13' ' ' LEU . 31.8 ttm -99.93 -83.24 0.44 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 14' ' ' LEU . . . -48.36 -31.6 6.36 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.691 -1.256 . . . . 0.0 108.069 178.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -43.66 69.63 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.294 -0.879 . . . . 0.0 108.807 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 48.2 mttt -110.4 -61.56 1.65 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.207 -0.933 . . . . 0.0 109.329 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.564 ' N ' ' O ' ' A' ' 9' ' ' MET . 1.9 mp -51.46 -72.3 0.05 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.893 . . . . 0.0 109.88 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.536 ' CD1' ' HG2' ' A' ' 9' ' ' MET . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 O-C-N 120.949 -1.094 . . . . 0.0 109.286 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.477 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.549 0.69 . . . . 0.0 109.406 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.505 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -111.97 3.12 27.15 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 178.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.538 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -136.36 -32.9 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -91.47 -12.66 33.99 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 121.106 -0.996 . . . . 0.0 108.59 179.014 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.536 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -116.82 -31.06 5.57 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.576 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -93.74 -81.34 0.37 Allowed 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 178.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 6' ' ' ILE . . . -41.2 -30.53 0.16 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 20.3 tptm -79.89 -47.17 15.51 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.536 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 4.6 tttt -96.89 -67.26 0.86 Allowed 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.576 ' N ' ' O ' ' A' ' 9' ' ' MET . 3.3 mm? -45.02 -68.05 0.23 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.447 -0.783 . . . . 0.0 109.136 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.538 ' HB3' ' HA ' ' A' ' 10' ' ' ALA . 5.4 tp . . . . . 0 N--CA 1.494 1.739 0 O-C-N 120.965 -1.084 . . . . 0.0 109.328 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.973 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.502 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.829 ' O ' HD12 ' A' ' 6' ' ' ILE . . . -103.85 14.26 52.9 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 107.864 -2.094 . . . . 0.0 107.864 178.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.829 HD12 ' O ' ' A' ' 5' ' ' GLY . 1.4 mp -138.12 -41.47 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.63 -2.72 44.19 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.973 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -131.1 -21.98 2.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.607 -0.683 . . . . 0.0 109.374 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 13' ' ' LEU . 36.2 ttm -83.88 -89.21 0.1 Allowed 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.546 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -50.64 -23.4 2.58 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 178.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.474 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -79.86 -41.45 26.25 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.344 -0.848 . . . . 0.0 108.715 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.13 -59.77 1.89 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.405 -0.81 . . . . 0.0 109.151 179.683 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.541 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.8 mp -62.72 -73.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.106 -0.996 . . . . 0.0 109.349 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.546 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 3.8 mm? . . . . . 0 N--CA 1.489 1.497 0 O-C-N 121.209 -0.932 . . . . 0.0 109.393 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.439 ' O ' ' HB2' ' A' ' 2' ' ' ASN . 3.5 pt . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 121.416 0.627 . . . . 0.0 109.315 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.489 ' O ' ' HB ' ' A' ' 6' ' ' ILE . 0.2 OUTLIER 168.37 106.88 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.346 -0.846 . . . . 0.0 109.214 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.847 ' CD2' ' HB2' ' A' ' 7' ' ' ALA . 1.7 t-105 -83.76 12.98 5.17 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.178 -0.951 . . . . 0.0 109.835 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.549 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 27.7 ttpt -117.52 -18.12 9.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.268 -0.895 . . . . 0.0 109.06 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -114.48 16.69 19.25 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 107.132 -2.387 . . . . 0.0 107.132 178.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.503 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 1.3 mp -141.37 -41.79 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.847 ' HB2' ' CD2' ' A' ' 3' ' ' TRP . . . -89.34 -1.33 58.02 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -134.9 -26.3 1.35 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.543 -0.723 . . . . 0.0 109.552 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.561 ' HA ' HD12 ' A' ' 13' ' ' LEU . 37.8 ttm -91.48 -95.92 0.13 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.996 -1.065 . . . . 0.0 108.998 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.516 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -46.19 -27.69 1.06 Allowed 'General case' 0 C--N 1.305 -1.335 0 O-C-N 120.943 -1.098 . . . . 0.0 108.785 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 6' ' ' ILE . 10.5 tptt -74.09 -45.5 48.81 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.264 -0.898 . . . . 0.0 108.668 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.502 ' HB3' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -109.81 -57.73 2.15 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.292 -0.88 . . . . 0.0 109.701 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 9' ' ' MET . 20.3 mt -59.83 -78.76 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.088 -1.007 . . . . 0.0 109.877 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.502 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 0.9 OUTLIER -84.7 19.97 1.89 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.112 -0.993 . . . . 0.0 109.653 -179.558 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . 0.516 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.308 0 O-C-N 119.892 -1.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.413 HG13 ' OD1' ' A' ' 2' ' ' ASN . 2.1 pt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.413 ' OD1' HG13 ' A' ' 1' ' ' ILE . 2.7 p-10 -156.36 60.16 0.56 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.274 -0.891 . . . . 0.0 109.68 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.734 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 10.5 t-105 66.27 10.71 7.38 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.149 -0.969 . . . . 0.0 109.831 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.835 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 11.2 mmtt -113.98 -11.6 12.75 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.077 -1.014 . . . . 0.0 109.579 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.505 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -117.89 6.74 15.49 Favored Glycine 0 N--CA 1.483 1.816 0 N-CA-C 106.53 -2.628 . . . . 0.0 106.53 178.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.457 HD13 ' HA ' ' A' ' 6' ' ' ILE . 11.9 mm -126.5 -36.23 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.734 ' HB2' ' CE2' ' A' ' 3' ' ' TRP . . . -100.29 8.37 43.77 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.835 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -132.12 -31.04 1.49 Allowed 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.533 ' O ' ' N ' ' A' ' 13' ' ' LEU . 40.0 mtt -82.25 -97.3 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.345 -0.847 . . . . 0.0 109.168 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.535 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -47.38 -25.7 1.1 Allowed 'General case' 0 C--N 1.307 -1.24 0 O-C-N 120.829 -1.17 . . . . 0.0 108.274 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' N ' ' C ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -72.53 -46.18 55.76 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.076 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.88 -55.06 2.45 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.378 -0.826 . . . . 0.0 109.901 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.8 tt -53.33 -69.25 0.12 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.231 -0.918 . . . . 0.0 109.646 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.535 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -84.83 3.93 35.5 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.076 -1.015 . . . . 0.0 109.224 179.938 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.366 0 O-C-N 119.888 -1.757 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.606 HG22 ' ND2' ' A' ' 2' ' ' ASN . 5.3 mt . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.606 ' ND2' HG22 ' A' ' 1' ' ' ILE . 0.0 OUTLIER -171.79 -75.96 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.33 -0.856 . . . . 0.0 108.868 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.625 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 12.3 t-105 -109.6 -16.4 13.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.153 -0.967 . . . . 0.0 109.345 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.533 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 3.8 tptt -101.3 1.86 39.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.23 -0.919 . . . . 0.0 109.181 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.53 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -113.26 5.11 25.17 Favored Glycine 0 N--CA 1.485 1.909 0 N-CA-C 106.9 -2.48 . . . . 0.0 106.9 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -134.56 -37.72 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 3' ' ' TRP . . . -84.3 -9.17 58.7 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -123.28 -24.86 4.57 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.556 ' HA ' ' HB2' ' A' ' 13' ' ' LEU . 16.4 ttt -104.31 -82.64 0.51 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.17 -0.956 . . . . 0.0 109.048 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.507 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -47.97 -25.55 1.41 Allowed 'General case' 0 C--N 1.307 -1.282 0 O-C-N 120.666 -1.271 . . . . 0.0 108.01 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.437 ' HB3' ' C ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -75.28 -44.87 43.37 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.46 -57.19 2.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 109.877 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 9' ' ' MET . 0.2 OUTLIER -54.83 -70.89 0.09 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.605 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.483 HD23 ' HA ' ' A' ' 14' ' ' LEU . 18.5 mt -103.64 33.41 3.39 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.28 -0.887 . . . . 0.0 108.958 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . 0.507 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.29 0 O-C-N 120.015 -1.678 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.481 ' CG ' ' N ' ' A' ' 3' ' ' TRP . 2.7 p30 -149.43 -50.52 0.15 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.28 -0.887 . . . . 0.0 109.798 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.607 ' CZ2' ' HB2' ' A' ' 7' ' ' ALA . 15.5 t-105 -129.64 -16.98 3.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.129 -0.982 . . . . 0.0 110.422 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.615 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -93.64 -3.7 52.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.81 -1.182 . . . . 0.0 109.638 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.47 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -111.17 15.21 28.09 Favored Glycine 0 N--CA 1.487 2.049 0 N-CA-C 107.363 -2.295 . . . . 0.0 107.363 178.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.407 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -140.4 -39.07 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 -179.694 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HB2' ' CZ2' ' A' ' 3' ' ' TRP . . . -95.12 -4.54 46.0 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.005 -1.059 . . . . 0.0 108.274 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -129.04 -24.52 2.89 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.85 ' SD ' HD23 ' A' ' 13' ' ' LEU . 1.6 tpp -91.5 -98.11 0.12 Allowed 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.572 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -44.61 -26.21 0.35 Allowed 'General case' 0 C--N 1.305 -1.354 0 O-C-N 120.794 -1.191 . . . . 0.0 108.837 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.412 ' N ' ' O ' ' A' ' 9' ' ' MET . 1.3 tmtm? -76.54 -45.17 31.84 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.187 -0.946 . . . . 0.0 108.958 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -115.81 -49.94 2.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.142 -0.973 . . . . 0.0 110.274 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.85 HD23 ' SD ' ' A' ' 9' ' ' MET . 11.7 tp -56.16 -68.27 0.22 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.166 -0.959 . . . . 0.0 110.048 -179.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.572 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 2.6 tt -56.72 -15.62 4.92 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.789 -1.194 . . . . 0.0 109.309 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.432 0 O-C-N 120.033 -1.667 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.421 HD12 ' HB2' ' A' ' 2' ' ' ASN . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.202 0.525 . . . . 0.0 109.634 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.421 ' HB2' HD12 ' A' ' 1' ' ' ILE . 1.7 m-20 -125.91 147.64 49.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.236 -0.915 . . . . 0.0 108.597 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.515 ' CZ2' ' HB2' ' A' ' 7' ' ' ALA . 8.3 t-105 -170.0 -24.45 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.925 -1.11 . . . . 0.0 111.198 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.605 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -89.37 3.92 50.65 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.355 -1.465 . . . . 0.0 109.639 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.475 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -111.83 3.46 27.4 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 108.133 -1.987 . . . . 0.0 108.133 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.432 HD12 ' O ' ' A' ' 5' ' ' GLY . 0.8 OUTLIER -134.53 -31.34 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 O-C-N 121.704 -0.88 . . . . 0.0 108.76 -179.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.515 ' HB2' ' CZ2' ' A' ' 3' ' ' TRP . . . -101.18 -6.67 23.96 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.188 -0.945 . . . . 0.0 108.518 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.605 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -122.31 -26.16 4.7 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.104 -1.072 . . . . 0.0 108.104 179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.626 ' SD ' HD22 ' A' ' 13' ' ' LEU . 1.4 tpp -89.27 -83.66 0.23 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.536 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -46.92 -28.94 1.78 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.123 -0.986 . . . . 0.0 108.394 178.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 10.2 tttm -80.29 -41.62 24.59 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.324 -0.86 . . . . 0.0 108.8 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.535 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.2 OUTLIER -105.67 -60.76 1.59 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.224 -0.923 . . . . 0.0 109.538 179.586 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.626 HD22 ' SD ' ' A' ' 9' ' ' MET . 0.0 OUTLIER -61.79 -72.59 0.12 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.029 -1.044 . . . . 0.0 109.633 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.536 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -86.69 22.91 1.8 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.162 -0.961 . . . . 0.0 109.752 -179.614 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . 0.491 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.323 0 O-C-N 119.796 -1.815 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.447 HG22 ' N ' ' A' ' 2' ' ' ASN . 19.3 mm . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.447 ' N ' HG22 ' A' ' 1' ' ' ILE . 27.2 m120 -82.98 173.19 12.01 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.677 -1.264 . . . . 0.0 109.226 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.997 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 2.0 t-105 -122.41 -12.2 8.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.3 -0.875 . . . . 0.0 109.593 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.569 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 2.3 ttpt -104.85 -18.3 14.27 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.161 -0.962 . . . . 0.0 108.963 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.519 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -109.1 8.94 33.54 Favored Glycine 0 N--CA 1.485 1.953 0 N-CA-C 107.714 -2.155 . . . . 0.0 107.714 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.489 ' O ' ' HG3' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -137.84 -41.67 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 179.908 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.997 ' HB3' ' O ' ' A' ' 3' ' ' TRP . . . -87.92 7.52 30.51 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -146.35 -26.86 0.42 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.642 -0.661 . . . . 0.0 109.844 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.532 ' SD ' ' N ' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -79.85 -97.63 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.095 -1.003 . . . . 0.0 108.915 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.563 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -47.76 -30.03 3.59 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 120.565 -1.335 . . . . 0.0 108.667 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -70.44 -44.44 67.83 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 121.281 -0.887 . . . . 0.0 108.735 179.404 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.413 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.23 -59.85 1.88 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.135 -0.978 . . . . 0.0 109.714 179.587 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 9' ' ' MET . 2.9 tp -55.97 -72.72 0.07 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.193 -0.942 . . . . 0.0 109.755 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.563 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.3 OUTLIER -84.46 17.65 2.56 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.094 -1.004 . . . . 0.0 109.465 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . 0.408 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.318 0 O-C-N 119.739 -1.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.457 ' O ' ' O ' ' A' ' 2' ' ' ASN . 9.7 mm . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.391 0.615 . . . . 0.0 109.456 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.662 ' HB3' HD12 ' A' ' 6' ' ' ILE . 0.1 OUTLIER 45.63 94.28 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.253 -0.905 . . . . 0.0 109.632 179.657 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.63 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 13.5 t-105 -101.29 -16.32 16.98 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.032 -1.042 . . . . 0.0 109.365 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.774 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -101.67 -12.92 18.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.28 -0.888 . . . . 0.0 109.006 179.547 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.482 ' C ' ' HB3' ' A' ' 9' ' ' MET . . . -103.98 16.73 50.08 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 107.33 -2.308 . . . . 0.0 107.33 178.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.662 HD12 ' HB3' ' A' ' 2' ' ' ASN . 0.3 OUTLIER -143.64 -41.88 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' A' ' 3' ' ' TRP . . . -88.92 -10.87 46.22 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.774 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -125.39 -22.66 4.28 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.534 ' O ' ' N ' ' A' ' 13' ' ' LEU . 55.6 ttm -100.59 -79.27 0.5 Allowed 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.216 -0.927 . . . . 0.0 108.631 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.582 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -49.73 -28.28 5.9 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 120.828 -1.17 . . . . 0.0 108.024 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HG3' ' HA ' ' A' ' 7' ' ' ALA . 0.9 OUTLIER -76.05 -41.07 51.86 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 179.041 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -110.81 -63.1 1.44 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.391 -0.818 . . . . 0.0 109.771 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.534 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.1 OUTLIER -59.18 -73.73 0.08 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.197 -0.939 . . . . 0.0 110.034 -179.831 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.582 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 1.0 OUTLIER -81.51 11.7 4.37 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.181 -0.949 . . . . 0.0 109.43 -179.654 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . 0.502 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.304 -1.378 0 O-C-N 119.878 -1.764 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 3.9 pt . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.12 0.486 . . . . 0.0 109.767 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 57.56 89.52 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.126 -0.984 . . . . 0.0 109.607 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.704 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 18.9 t-105 -94.01 -8.51 39.7 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.212 -0.93 . . . . 0.0 109.738 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.608 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -103.32 -7.32 21.17 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.23 -0.919 . . . . 0.0 109.521 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.514 ' HA2' ' HG3' ' A' ' 9' ' ' MET . . . -109.62 7.52 31.9 Favored Glycine 0 N--CA 1.485 1.946 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 178.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -135.93 -35.26 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.704 ' HB3' ' O ' ' A' ' 3' ' ' TRP . . . -93.24 -3.4 53.78 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 121.12 -0.987 . . . . 0.0 108.728 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -129.83 -28.88 2.17 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.539 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -85.86 -86.39 0.14 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.234 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -45.78 -28.23 1.01 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.486 ' HD2' ' O ' ' A' ' 7' ' ' ALA . 17.4 mttt -78.34 -44.02 26.27 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.16 -60.38 1.81 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.284 -0.885 . . . . 0.0 109.332 179.241 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.539 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.4 OUTLIER -51.41 -71.72 0.06 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.252 -0.905 . . . . 0.0 109.575 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.497 ' HA ' HD22 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -102.7 28.86 5.73 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.14 -0.975 . . . . 0.0 109.35 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . 0.517 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.305 -1.336 0 O-C-N 119.945 -1.722 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.768 ' O ' HG23 ' A' ' 1' ' ' ILE . 5.8 tt . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.561 ' CB ' ' O ' ' A' ' 1' ' ' ILE . 0.7 OUTLIER 82.16 -66.12 0.11 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.6 -0.687 . . . . 0.0 109.895 179.84 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.578 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 12.7 t-105 -93.19 -11.72 32.04 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.098 -1.001 . . . . 0.0 109.999 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.842 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -103.17 -14.59 16.32 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.11 -0.994 . . . . 0.0 109.158 179.691 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.503 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -102.79 14.08 56.2 Favored Glycine 0 N--CA 1.487 2.041 0 N-CA-C 107.404 -2.279 . . . . 0.0 107.404 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -139.56 -40.75 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.578 ' HB3' ' O ' ' A' ' 3' ' ' TRP . . . -95.74 -5.31 42.34 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.842 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -129.53 -20.07 3.32 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.594 -0.691 . . . . 0.0 109.32 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.531 ' O ' ' N ' ' A' ' 13' ' ' LEU . 4.5 ttt -92.65 -89.87 0.19 Allowed 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.514 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -48.21 -25.88 1.7 Allowed 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 178.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -46.62 53.67 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.493 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -111.02 -58.43 2.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.339 -0.851 . . . . 0.0 109.642 179.499 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.531 ' N ' ' O ' ' A' ' 9' ' ' MET . 6.0 mp -54.75 -70.89 0.09 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.092 -1.005 . . . . 0.0 109.479 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.458 ' HA ' HD13 ' A' ' 14' ' ' LEU . 2.7 mm? -97.12 29.32 3.18 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.221 -0.924 . . . . 0.0 109.359 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . 0.514 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.305 -1.348 0 O-C-N 119.892 -1.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.427 ' O ' ' HB2' ' A' ' 2' ' ' ASN . 4.5 pt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 1' ' ' ILE . 2.0 m120 63.32 130.57 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.905 . . . . 0.0 109.492 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.779 ' CE2' ' HB2' ' A' ' 7' ' ' ALA . 15.1 t-105 -96.6 7.95 45.33 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.174 -0.954 . . . . 0.0 109.507 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.776 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -112.15 -10.35 13.88 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.268 -0.895 . . . . 0.0 109.157 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.531 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -112.24 7.98 26.85 Favored Glycine 0 N--CA 1.485 1.92 0 N-CA-C 106.723 -2.551 . . . . 0.0 106.723 178.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' A' ' 6' ' ' ILE . 4.2 mm -128.85 -38.54 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.779 ' HB2' ' CE2' ' A' ' 3' ' ' TRP . . . -89.49 -2.11 58.26 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 177.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -122.83 -33.92 3.29 Favored 'General case' 0 N--CA 1.485 1.3 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.555 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.3 OUTLIER -82.89 -96.96 0.05 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.18 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.557 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -43.31 -29.18 0.39 Allowed 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.818 -1.177 . . . . 0.0 108.782 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 12.6 tptp -74.06 -51.93 14.25 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.535 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -98.1 -62.33 1.26 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.142 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.555 ' N ' ' O ' ' A' ' 9' ' ' MET . 2.5 mm? -45.47 -69.23 0.14 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.342 -0.849 . . . . 0.0 109.305 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.557 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 0.6 OUTLIER -75.74 -7.07 53.48 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.834 -1.166 . . . . 0.0 109.455 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.422 0 O-C-N 119.812 -1.805 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 5.3 mt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.533 ' O ' ' HB3' ' A' ' 3' ' ' TRP . 0.0 OUTLIER -175.7 112.38 0.12 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.139 -0.975 . . . . 0.0 110.071 -179.814 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.533 ' HB3' ' O ' ' A' ' 2' ' ' ASN . 5.8 t-105 81.22 -35.45 0.11 Allowed 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.65 -0.656 . . . . 0.0 110.83 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.0 mttt -93.86 12.64 25.2 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.676 -1.265 . . . . 0.0 109.553 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.531 ' O ' ' HB3' ' A' ' 9' ' ' MET . . . -122.91 6.28 9.56 Favored Glycine 0 N--CA 1.485 1.902 0 N-CA-C 107.0 -2.44 . . . . 0.0 107.0 178.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -134.23 -32.64 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -93.38 -5.0 50.45 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 178.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.475 ' O ' ' HB2' ' A' ' 12' ' ' LYS . . . -125.93 -25.76 3.55 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.532 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -93.28 -94.31 0.16 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.212 -0.93 . . . . 0.0 108.685 179.708 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.528 ' O ' ' N ' ' A' ' 15' ' ' NH2 . . . -45.44 -25.93 0.49 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 120.954 -1.091 . . . . 0.0 108.514 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 9' ' ' MET . 0.0 OUTLIER -75.27 -46.52 33.09 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.086 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 53.0 mttt -109.23 -56.95 2.22 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.319 -0.863 . . . . 0.0 109.438 179.393 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.4 mm? -54.56 -75.3 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.131 -0.981 . . . . 0.0 109.455 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.502 ' HA ' HD13 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -98.76 32.23 2.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 0.0 109.299 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . 0.528 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.305 -1.355 0 O-C-N 119.95 -1.719 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.474 HG13 ' O ' ' A' ' 1' ' ' ILE . 10.4 pt . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -151.26 -70.54 0.17 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.157 -0.964 . . . . 0.0 109.683 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -71.21 -25.96 62.74 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.183 -0.948 . . . . 0.0 109.357 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.836 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.1 OUTLIER -92.08 -6.55 50.73 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.282 -0.887 . . . . 0.0 109.148 179.528 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.53 ' HA2' ' HB2' ' A' ' 9' ' ' MET . . . -102.12 13.23 57.35 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 107.531 -2.228 . . . . 0.0 107.531 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.94 -38.65 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.82 -8.4 28.47 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.836 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -125.44 -18.21 5.37 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 13' ' ' LEU . 31.8 ttm -99.93 -83.24 0.44 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 14' ' ' LEU . . . -48.36 -31.6 6.36 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.691 -1.256 . . . . 0.0 108.069 178.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -43.66 69.63 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.294 -0.879 . . . . 0.0 108.807 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 48.2 mttt -110.4 -61.56 1.65 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.207 -0.933 . . . . 0.0 109.329 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.564 ' N ' ' O ' ' A' ' 9' ' ' MET . 1.9 mp -51.46 -72.3 0.05 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.893 . . . . 0.0 109.88 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.536 ' CD1' ' HG2' ' A' ' 9' ' ' MET . 0.2 OUTLIER -93.49 24.34 4.05 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.949 -1.094 . . . . 0.0 109.286 -179.879 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.305 -1.354 0 O-C-N 119.889 -1.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 16.0 pt . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -107.96 -156.97 0.6 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.247 -0.908 . . . . 0.0 109.299 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.826 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 9.4 t-105 -125.16 -7.17 7.11 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.137 -0.977 . . . . 0.0 109.637 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.477 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.1 OUTLIER -104.68 -1.79 25.85 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.182 -0.949 . . . . 0.0 109.406 179.65 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.505 ' O ' ' HB2' ' A' ' 9' ' ' MET . . . -111.97 3.12 27.15 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 107.511 -2.236 . . . . 0.0 107.511 178.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.538 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 0.2 OUTLIER -136.36 -32.9 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.826 ' HB3' ' O ' ' A' ' 3' ' ' TRP . . . -91.47 -12.66 33.99 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 121.106 -0.996 . . . . 0.0 108.59 179.014 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.536 ' O ' ' CB ' ' A' ' 12' ' ' LYS . . . -116.82 -31.06 5.57 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.576 ' O ' ' N ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -93.74 -81.34 0.37 Allowed 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 178.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 6' ' ' ILE . . . -41.2 -30.53 0.16 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' A' ' 7' ' ' ALA . 20.3 tptm -79.89 -47.17 15.51 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.536 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 4.6 tttt -96.89 -67.26 0.86 Allowed 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.576 ' N ' ' O ' ' A' ' 9' ' ' MET . 3.3 mm? -45.02 -68.05 0.23 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.447 -0.783 . . . . 0.0 109.136 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.538 ' HB3' ' HA ' ' A' ' 10' ' ' ALA . 5.4 tp -84.21 0.03 50.38 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.965 -1.084 . . . . 0.0 109.328 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.364 0 O-C-N 119.934 -1.729 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.53 HD11 HD11 ' A' ' 6' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.453 ' ND2' ' N ' ' A' ' 3' ' ' TRP . 0.0 OUTLIER -171.98 -49.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.074 -1.016 . . . . 0.0 109.572 179.904 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.573 ' HA ' ' CE3' ' A' ' 3' ' ' TRP . 0.0 OUTLIER -174.43 31.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.115 -0.99 . . . . 0.0 109.658 -179.687 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.973 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -131.73 -31.9 1.51 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.331 -0.855 . . . . 0.0 109.558 179.691 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.829 ' O ' HD12 ' A' ' 6' ' ' ILE . . . -103.85 14.26 52.9 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 107.864 -2.094 . . . . 0.0 107.864 178.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.829 HD12 ' O ' ' A' ' 5' ' ' GLY . 1.4 mp -138.12 -41.47 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.565 ' HB2' ' CD2' ' A' ' 3' ' ' TRP . . . -96.63 -2.72 44.19 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 178.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.973 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -131.1 -21.98 2.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.607 -0.683 . . . . 0.0 109.374 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.541 ' O ' ' N ' ' A' ' 13' ' ' LEU . 36.2 ttm -83.88 -89.21 0.1 Allowed 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.546 ' HA ' ' CB ' ' A' ' 14' ' ' LEU . . . -50.64 -23.4 2.58 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 178.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.474 ' HA ' ' HE2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -79.86 -41.45 26.25 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.344 -0.848 . . . . 0.0 108.715 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -110.13 -59.77 1.89 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.405 -0.81 . . . . 0.0 109.151 179.683 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.541 ' N ' ' O ' ' A' ' 9' ' ' MET . 4.8 mp -62.72 -73.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.106 -0.996 . . . . 0.0 109.349 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.546 ' CB ' ' HA ' ' A' ' 10' ' ' ALA . 3.8 mm? -88.58 31.55 0.83 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.209 -0.932 . . . . 0.0 109.393 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' NH2 . . . . . 0.482 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . . . . . . 0 C--N 1.306 -1.295 0 O-C-N 119.934 -1.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 stop_ save_