data_2mzl_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 2mzl _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.386 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -48.27 -38.87 19.82 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.21 -1.171 . . . . 0.0 109.57 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.461 ' C ' ' CD1' ' A' ' 5' ' ' LEU . 0.7 OUTLIER -75.38 -60.73 2.17 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.316 -0.865 . . . . 0.0 109.428 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.458 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 0.3 OUTLIER -48.03 -42.73 29.03 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.329 -0.857 . . . . 0.0 109.718 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -122.83 38.44 4.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 109.41 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.563 ' O ' ' C ' ' A' ' 10' ' ' HYP . 4.6 pt20 -63.51 147.7 50.66 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.28 -0.887 . . . . 0.0 110.191 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . 0.687 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CGU . . . . . 0.687 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.413 ' N ' ' O ' ' A' ' 9' ' ' GLN . 17.1 mt -60.39 -33.52 72.6 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.472 HG22 ' N ' ' A' ' 14' ' ' ARG . 5.2 tt -74.81 -33.74 31.58 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.104 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.535 ' C ' ' H ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -88.84 -58.04 2.69 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -179.525 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CGU . . . . . 0.522 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.535 ' H ' ' C ' ' A' ' 14' ' ' ARG . 24.2 tptt -45.09 -48.42 11.97 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.224 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.6 p -88.32 -35.36 17.25 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.338 -0.851 . . . . 0.0 109.67 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 -89.37 76.33 7.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.169 -0.957 . . . . 0.0 109.447 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.339 0 O-C-N 119.901 -1.749 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -76.56 -16.62 59.56 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.335 -1.097 . . . . 0.0 109.431 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CGU . . . . . 0.554 ' O ' OE21 ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.467 ' C ' ' CD1' ' A' ' 5' ' ' LEU . 0.6 OUTLIER -67.23 -57.07 7.39 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.147 -0.971 . . . . 0.0 109.734 -179.408 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.423 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 11.7 mt-30 -51.08 -21.45 1.88 Allowed 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.341 -0.849 . . . . 0.0 109.898 -179.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -123.1 38.61 4.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.211 -0.931 . . . . 0.0 109.132 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.561 ' O ' ' C ' ' A' ' 10' ' ' HYP . 7.3 pt20 -63.42 148.57 48.16 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.268 -0.895 . . . . 0.0 110.075 -179.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . 0.688 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CGU . . . . . 0.688 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 9' ' ' GLN . 20.5 mt -60.53 -31.07 70.17 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 106.803 -1.555 . . . . 0.0 106.803 178.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.499 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.3 tt -71.96 -35.7 55.11 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-O 121.393 0.616 . . . . 0.0 109.668 179.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.54 ' C ' ' H ' ' A' ' 16' ' ' LYS . 5.3 tpp180 -88.04 -59.29 2.28 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CGU . . . . . 0.543 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.54 ' H ' ' C ' ' A' ' 14' ' ' ARG . 22.2 tptt -44.34 -51.01 8.85 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.345 -0.942 . . . . 0.0 108.795 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.18 -27.64 26.01 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.319 -0.863 . . . . 0.0 109.2 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 57.09 19.09 4.47 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.372 -0.83 . . . . 0.0 109.454 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.275 0 O-C-N 119.875 -1.766 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 N-CA-C 109.387 -1.485 . . . . 0.0 109.387 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -69.58 -23.08 63.49 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.274 -1.133 . . . . 0.0 109.408 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CGU . . . . . 0.634 OE21 ' CD2' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.406 ' C ' ' O ' ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.462 ' HG ' ' N ' ' A' ' 6' ' ' GLN . 0.8 OUTLIER -69.19 -61.06 1.95 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.087 -1.008 . . . . 0.0 109.273 -179.874 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.462 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 1.8 tt0 -55.4 -33.59 63.63 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.373 -0.829 . . . . 0.0 109.543 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.634 ' CD2' OE21 ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -118.33 38.52 3.69 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.324 -0.86 . . . . 0.0 109.1 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.577 ' O ' ' C ' ' A' ' 10' ' ' HYP . 1.7 mt-30 -67.25 144.77 55.75 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.283 -0.886 . . . . 0.0 109.827 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . 0.687 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CGU . . . . . 0.687 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.455 ' N ' ' O ' ' A' ' 9' ' ' GLN . 13.5 mt -58.37 -31.48 67.67 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 178.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.489 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.1 tt -74.19 -35.72 41.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 CA-C-O 121.352 0.596 . . . . 0.0 109.906 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.549 ' C ' ' H ' ' A' ' 16' ' ' LYS . 4.3 ttm180 -87.19 -59.35 2.28 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CGU . . . . . 0.573 OE11 OE21 ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.549 ' H ' ' C ' ' A' ' 14' ' ' ARG . 13.2 tptt -44.69 -52.51 8.2 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.573 -0.851 . . . . 0.0 109.147 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.4 ' O ' ' CB ' ' A' ' 18' ' ' ASN . 1.5 t -83.42 -27.76 29.33 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.242 -0.912 . . . . 0.0 109.526 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.4 ' CB ' ' O ' ' A' ' 17' ' ' SER . 3.9 t30 69.01 146.98 0.06 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.25 -0.906 . . . . 0.0 109.365 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.342 0 O-C-N 119.847 -1.783 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -78.5 -16.87 57.03 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.258 -1.143 . . . . 0.0 109.447 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.481 ' C ' ' CD1' ' A' ' 5' ' ' LEU . 0.4 OUTLIER -59.91 -56.31 23.31 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.171 -0.955 . . . . 0.0 109.228 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.558 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 16.9 mt-30 -48.01 -39.98 21.35 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.38 -0.825 . . . . 0.0 109.531 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -119.41 36.76 4.37 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.143 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.584 ' O ' ' C ' ' A' ' 10' ' ' HYP . 0.4 OUTLIER -65.63 143.31 57.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.365 -0.834 . . . . 0.0 109.651 -179.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . 0.692 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CGU . . . . . 0.692 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.465 ' N ' ' O ' ' A' ' 9' ' ' GLN . 21.3 mt -59.08 -30.38 68.04 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 107.124 -1.435 . . . . 0.0 107.124 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.473 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.1 tt -75.52 -34.81 30.49 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-O 121.424 0.63 . . . . 0.0 109.494 179.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.542 ' C ' ' N ' ' A' ' 16' ' ' LYS . 2.1 mtp180 -87.85 -59.49 2.23 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CGU . . . . . 0.561 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.542 ' N ' ' C ' ' A' ' 14' ' ' ARG . 27.3 tptt -45.39 -50.54 12.23 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.599 -0.84 . . . . 0.0 109.153 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 7.9 t -79.68 -35.19 39.52 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.369 -0.832 . . . . 0.0 109.513 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 47.48 73.58 0.19 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.211 -0.93 . . . . 0.0 109.418 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.29 0 O-C-N 119.834 -1.791 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.355 0 N-CA-C 109.451 -1.459 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -61.58 -24.08 66.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.268 -1.137 . . . . 0.0 109.433 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.454 ' HG ' ' N ' ' A' ' 6' ' ' GLN . 0.9 OUTLIER -77.64 -60.92 2.17 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.323 -0.86 . . . . 0.0 109.159 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.454 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 4.1 mt-30 -60.29 -32.62 71.37 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.338 -0.852 . . . . 0.0 109.503 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -113.85 38.58 2.93 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.373 -0.829 . . . . 0.0 109.136 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.544 ' O ' ' C ' ' A' ' 10' ' ' HYP . 1.2 mt-30 -60.24 143.72 51.98 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.302 -0.874 . . . . 0.0 109.891 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . 0.685 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CGU . . . . . 0.685 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.478 ' N ' ' O ' ' A' ' 9' ' ' GLN . 52.4 mt -61.82 -31.37 71.61 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 178.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.472 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 6.5 tt -74.54 -34.23 34.82 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.837 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.551 ' C ' ' H ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -87.64 -60.06 2.08 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CGU . . . . . 0.479 ' C ' ' O ' ' A' ' 14' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.551 ' H ' ' C ' ' A' ' 14' ' ' ARG . 17.9 tptt -44.45 -47.27 9.91 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.464 -0.895 . . . . 0.0 109.029 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -87.35 -35.55 18.32 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.35 -0.844 . . . . 0.0 109.487 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -83.24 53.88 2.61 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.176 -0.952 . . . . 0.0 109.459 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.37 0 O-C-N 119.844 -1.785 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.477 ' O ' ' C ' ' A' ' 3' ' ' CGU . 3.5 pt-20 -61.21 -24.36 66.28 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.319 -1.107 . . . . 0.0 109.659 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CGU . . . . . 0.477 ' C ' ' O ' ' A' ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.462 ' C ' ' CD1' ' A' ' 5' ' ' LEU . 0.6 OUTLIER -77.37 -60.34 2.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.306 -0.872 . . . . 0.0 109.365 -179.924 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.462 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 2.8 mt-30 -47.48 -38.86 14.61 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.423 -0.798 . . . . 0.0 109.582 -179.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -119.72 38.44 3.9 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.356 -0.84 . . . . 0.0 109.344 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.551 ' O ' ' C ' ' A' ' 10' ' ' HYP . 1.1 mm-40 -56.02 140.48 43.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.371 -0.83 . . . . 0.0 109.523 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . 0.688 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CGU . . . . . 0.688 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.428 ' N ' ' O ' ' A' ' 9' ' ' GLN . 4.1 mt -60.88 -30.11 69.96 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.498 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 6.5 tt -73.76 -35.42 43.45 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 CA-C-O 121.276 0.56 . . . . 0.0 109.975 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.579 ' C ' ' H ' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -91.31 -58.75 2.35 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CGU . . . . . 0.534 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.579 ' H ' ' C ' ' A' ' 14' ' ' ARG . 9.8 tptt -44.87 -56.64 4.36 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.552 -0.859 . . . . 0.0 109.188 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -88.58 -43.47 11.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.176 -0.952 . . . . 0.0 109.396 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.47 ' O ' ' CG ' ' A' ' 18' ' ' ASN . 7.4 t-20 52.0 56.35 7.91 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.28 -0.887 . . . . 0.0 109.599 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.354 0 O-C-N 119.893 -1.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.475 ' O ' ' C ' ' A' ' 3' ' ' CGU . 17.0 pt-20 -74.46 -34.01 63.05 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.26 -1.141 . . . . 0.0 109.582 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CGU . . . . . 0.475 ' C ' ' O ' ' A' ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.525 ' C ' ' CD1' ' A' ' 5' ' ' LEU . 0.4 OUTLIER -58.15 -54.83 42.59 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.227 -0.92 . . . . 0.0 109.288 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.419 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 1.6 tp60 -46.78 -43.14 18.02 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.407 -0.808 . . . . 0.0 109.977 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -123.08 38.72 4.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.214 -0.929 . . . . 0.0 109.517 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.54 ' O ' ' C ' ' A' ' 10' ' ' HYP . 0.1 OUTLIER -63.85 149.21 47.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.263 -0.898 . . . . 0.0 110.277 -179.324 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . 0.68 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CGU . . . . . 0.68 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.437 ' N ' ' O ' ' A' ' 9' ' ' GLN . 7.6 mt -55.45 -39.95 70.98 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 177.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.497 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.0 tt -65.6 -35.11 74.44 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 CA-C-O 121.45 0.643 . . . . 0.0 109.962 178.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.563 ' C ' ' N ' ' A' ' 16' ' ' LYS . 10.5 ttp180 -86.26 -60.47 1.99 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CGU . . . . . 0.564 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.563 ' N ' ' C ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -49.38 -40.83 37.37 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.419 -0.912 . . . . 0.0 109.278 179.154 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.1 m -83.57 -58.26 2.89 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.306 -0.871 . . . . 0.0 109.621 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.478 ' CG ' ' HN1' ' A' ' 19' ' ' NH2 . 63.2 t30 -72.13 -140.14 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.28 -0.887 . . . . 0.0 109.487 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' NH2 . . . . . 0.478 ' HN1' ' CG ' ' A' ' 18' ' ' ASN . . . . . . . . 0 C--N 1.305 -1.339 0 O-C-N 119.856 -1.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -79.29 -29.67 42.57 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.166 -1.196 . . . . 0.0 109.439 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.481 ' C ' ' CD1' ' A' ' 5' ' ' LEU . 0.6 OUTLIER -70.04 -60.33 2.36 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.224 -0.922 . . . . 0.0 109.332 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.469 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 48.9 mt-30 -45.57 -42.41 11.04 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.318 -0.864 . . . . 0.0 109.657 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -112.95 38.1 2.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.319 -0.863 . . . . 0.0 109.402 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.576 ' O ' ' C ' ' A' ' 10' ' ' HYP . 0.7 OUTLIER -67.51 141.69 56.82 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.193 -0.942 . . . . 0.0 109.75 -179.651 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . 0.705 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CGU . . . . . 0.705 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.413 ' N ' ' O ' ' A' ' 9' ' ' GLN . 33.3 mt -59.16 -31.34 68.9 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.514 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.4 tt -71.9 -36.38 57.73 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 CA-C-O 121.411 0.624 . . . . 0.0 109.962 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.623 ' C ' ' H ' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -91.66 -59.07 2.22 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -179.722 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CGU . . . . . 0.542 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.623 ' H ' ' C ' ' A' ' 14' ' ' ARG . 19.9 tptt -44.18 -56.65 3.94 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.399 -0.92 . . . . 0.0 109.024 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 55.4 m -88.75 -37.27 15.59 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.254 -0.904 . . . . 0.0 109.412 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -167.87 -47.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.283 -0.886 . . . . 0.0 109.363 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.363 0 O-C-N 119.87 -1.769 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.65 -19.33 64.4 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.316 -1.108 . . . . 0.0 109.634 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CGU . . . . . 0.571 OE22 ' O ' ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.47 ' C ' ' CD1' ' A' ' 5' ' ' LEU . 0.8 OUTLIER -75.9 -60.89 2.13 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.303 -0.873 . . . . 0.0 109.561 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.443 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 1.5 tp-100 -49.75 -24.03 2.12 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.31 -0.869 . . . . 0.0 109.775 -179.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.406 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -120.4 38.26 4.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.187 -0.946 . . . . 0.0 109.534 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.574 ' O ' ' C ' ' A' ' 10' ' ' HYP . 5.1 mt-30 -61.12 144.14 54.12 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.326 -0.859 . . . . 0.0 109.402 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . 0.686 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CGU . . . . . 0.686 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.504 ' N ' ' O ' ' A' ' 9' ' ' GLN . 20.0 mt -58.97 -32.67 69.87 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 178.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.496 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 6.1 tt -71.02 -35.54 59.7 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 CA-C-O 121.364 0.602 . . . . 0.0 110.004 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.563 ' C ' ' H ' ' A' ' 16' ' ' LYS . 34.4 ttt85 -88.29 -58.64 2.49 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CGU . . . . . 0.534 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.563 ' H ' ' C ' ' A' ' 14' ' ' ARG . 27.3 tptt -44.9 -54.61 6.27 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.571 -0.852 . . . . 0.0 109.381 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.27 -52.83 6.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.341 -0.85 . . . . 0.0 109.662 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.8 m-20 -59.77 127.53 32.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.221 -0.925 . . . . 0.0 109.379 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.348 0 O-C-N 119.916 -1.74 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -20.46 65.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.28 -1.13 . . . . 0.0 109.576 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.451 ' C ' ' CD1' ' A' ' 5' ' ' LEU . 0.7 OUTLIER -71.34 -58.83 3.16 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.237 -0.915 . . . . 0.0 109.195 179.813 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.454 ' C ' ' H ' ' A' ' 8' ' ' ASN . 33.3 mt-30 -62.15 -26.31 68.25 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.438 -0.789 . . . . 0.0 109.676 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.454 ' H ' ' C ' ' A' ' 6' ' ' GLN . 40.3 m-80 -123.72 38.18 4.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.118 -0.989 . . . . 0.0 109.533 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.564 ' O ' ' C ' ' A' ' 10' ' ' HYP . 6.7 pt20 -72.26 147.26 46.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.12 -0.988 . . . . 0.0 110.17 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . 0.676 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CGU . . . . . 0.676 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.568 ' N ' OE12 ' A' ' 11' ' ' CGU . 21.7 mt -59.74 -31.85 70.01 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 178.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.478 HG23 ' N ' ' A' ' 14' ' ' ARG . 4.2 tt -75.96 -34.33 27.06 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.717 179.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.486 ' C ' ' H ' ' A' ' 16' ' ' LYS . 1.0 OUTLIER -85.4 -59.05 2.43 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CGU . . . . . 0.526 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.486 ' H ' ' C ' ' A' ' 14' ' ' ARG . 23.4 tptt -46.57 -56.83 5.44 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.159 179.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.78 -32.48 17.85 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.339 -0.85 . . . . 0.0 109.387 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 68.49 -137.93 0.09 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.203 -0.936 . . . . 0.0 109.492 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.334 0 O-C-N 119.886 -1.759 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.386 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -48.27 -38.87 19.82 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.21 -1.171 . . . . 0.0 109.57 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.662 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.7 OUTLIER -75.38 -60.73 2.17 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.316 -0.865 . . . . 0.0 109.428 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.467 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 0.3 OUTLIER -48.03 -42.73 29.03 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.329 -0.857 . . . . 0.0 109.718 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -122.83 38.44 4.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 109.41 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.563 ' O ' ' C ' ' A' ' 10' ' ' HYP . 4.6 pt20 -63.51 147.7 50.66 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.28 -0.887 . . . . 0.0 110.191 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HYP . . . . . 0.687 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CGU . . . . . 0.687 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.413 ' N ' ' O ' ' A' ' 9' ' ' GLN . 17.1 mt -60.39 -33.52 72.6 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.459 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.2 tt -74.81 -33.74 31.58 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.104 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.522 ' C ' ' N ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -88.84 -58.04 2.69 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -179.525 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CGU . . . . . 0.53 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.522 ' N ' ' C ' ' A' ' 14' ' ' ARG . 24.2 tptt -45.09 -48.42 11.97 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.224 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.6 p -88.32 -35.36 17.25 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.338 -0.851 . . . . 0.0 109.67 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 -89.37 76.33 7.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.169 -0.957 . . . . 0.0 109.447 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.339 0 O-C-N 119.901 -1.749 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -76.56 -16.62 59.56 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.335 -1.097 . . . . 0.0 109.431 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CGU . . . . . 0.554 ' C ' OE21 ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.737 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -67.23 -57.07 7.39 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.147 -0.971 . . . . 0.0 109.734 -179.408 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.433 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 11.7 mt-30 -51.08 -21.45 1.88 Allowed 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.341 -0.849 . . . . 0.0 109.898 -179.161 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -123.1 38.61 4.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.211 -0.931 . . . . 0.0 109.132 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.561 ' O ' ' C ' ' A' ' 10' ' ' HYP . 7.3 pt20 -63.42 148.57 48.16 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.268 -0.895 . . . . 0.0 110.075 -179.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HYP . . . . . 0.688 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CGU . . . . . 0.688 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.455 ' N ' ' O ' ' A' ' 9' ' ' GLN . 20.5 mt -60.53 -31.07 70.17 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 106.803 -1.555 . . . . 0.0 106.803 178.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.499 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.3 tt -71.96 -35.7 55.11 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-O 121.393 0.616 . . . . 0.0 109.668 179.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.536 ' C ' ' N ' ' A' ' 16' ' ' LYS . 5.3 tpp180 -88.04 -59.29 2.28 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CGU . . . . . 0.545 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.536 ' N ' ' C ' ' A' ' 14' ' ' ARG . 22.2 tptt -44.34 -51.01 8.85 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.345 -0.942 . . . . 0.0 108.795 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.18 -27.64 26.01 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.319 -0.863 . . . . 0.0 109.2 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 57.09 19.09 4.47 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.372 -0.83 . . . . 0.0 109.454 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.275 0 O-C-N 119.875 -1.766 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 N-CA-C 109.387 -1.485 . . . . 0.0 109.387 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -69.58 -23.08 63.49 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.274 -1.133 . . . . 0.0 109.408 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CGU . . . . . 0.634 OE21 ' CD2' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.406 ' C ' ' O ' ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.654 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -69.19 -61.06 1.95 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.087 -1.008 . . . . 0.0 109.273 -179.874 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.469 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 1.8 tt0 -55.4 -33.59 63.63 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.373 -0.829 . . . . 0.0 109.543 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.634 ' CD2' OE21 ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -118.33 38.52 3.69 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.324 -0.86 . . . . 0.0 109.1 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.577 ' O ' ' C ' ' A' ' 10' ' ' HYP . 1.7 mt-30 -67.25 144.77 55.75 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.283 -0.886 . . . . 0.0 109.827 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HYP . . . . . 0.687 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CGU . . . . . 0.687 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.491 HD23 ' HA ' ' A' ' 12' ' ' LEU . 13.5 mt -58.37 -31.48 67.67 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 178.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.489 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.1 tt -74.19 -35.72 41.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 CA-C-O 121.352 0.596 . . . . 0.0 109.906 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.489 ' N ' ' CG2' ' A' ' 13' ' ' ILE . 4.3 ttm180 -87.19 -59.35 2.28 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CGU . . . . . 0.573 OE11 OE21 ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.486 ' H ' ' C ' ' A' ' 14' ' ' ARG . 13.2 tptt -44.69 -52.51 8.2 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.573 -0.851 . . . . 0.0 109.147 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.4 ' O ' ' CB ' ' A' ' 18' ' ' ASN . 1.5 t -83.42 -27.76 29.33 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.242 -0.912 . . . . 0.0 109.526 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.4 ' CB ' ' O ' ' A' ' 17' ' ' SER . 3.9 t30 69.01 146.98 0.06 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.25 -0.906 . . . . 0.0 109.365 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.342 0 O-C-N 119.847 -1.783 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -78.5 -16.87 57.03 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.258 -1.143 . . . . 0.0 109.447 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.769 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -59.91 -56.31 23.31 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.171 -0.955 . . . . 0.0 109.228 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.443 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 16.9 mt-30 -48.01 -39.98 21.35 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.38 -0.825 . . . . 0.0 109.531 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -119.41 36.76 4.37 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.143 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.614 ' HB2' HD12 ' A' ' 12' ' ' LEU . 3.7 mt-30 -65.63 143.31 57.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.365 -0.834 . . . . 0.0 109.651 -179.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HYP . . . . . 0.692 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CGU . . . . . 0.692 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.614 HD12 ' HB2' ' A' ' 9' ' ' GLN . 21.3 mt -59.08 -30.38 68.04 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 107.124 -1.435 . . . . 0.0 107.124 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.473 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.1 tt -75.52 -34.81 30.49 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-O 121.424 0.63 . . . . 0.0 109.494 179.005 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.542 ' C ' ' N ' ' A' ' 16' ' ' LYS . 2.1 mtp180 -87.85 -59.49 2.23 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CGU . . . . . 0.571 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.542 ' N ' ' C ' ' A' ' 14' ' ' ARG . 27.3 tptt -45.39 -50.54 12.23 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.599 -0.84 . . . . 0.0 109.153 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 7.9 t -79.68 -35.19 39.52 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.369 -0.832 . . . . 0.0 109.513 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 47.48 73.58 0.19 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.211 -0.93 . . . . 0.0 109.418 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.29 0 O-C-N 119.834 -1.791 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.355 0 N-CA-C 109.451 -1.459 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -61.58 -24.08 66.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.268 -1.137 . . . . 0.0 109.433 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CGU . . . . . 0.41 ' O ' ' N ' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.645 ' C ' HD12 ' A' ' 5' ' ' LEU . 0.9 OUTLIER -77.64 -60.92 2.17 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.323 -0.86 . . . . 0.0 109.159 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.462 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 4.1 mt-30 -60.29 -32.62 71.37 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.338 -0.852 . . . . 0.0 109.503 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.41 ' N ' ' O ' ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -113.85 38.58 2.93 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.373 -0.829 . . . . 0.0 109.136 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.648 ' HB2' HD12 ' A' ' 12' ' ' LEU . 1.2 mt-30 -60.24 143.72 51.98 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.302 -0.874 . . . . 0.0 109.891 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HYP . . . . . 0.685 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CGU . . . . . 0.685 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.648 HD12 ' HB2' ' A' ' 9' ' ' GLN . 52.4 mt -61.82 -31.37 71.61 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 178.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.472 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 6.5 tt -74.54 -34.23 34.82 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.837 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.547 ' C ' ' N ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -87.64 -60.06 2.08 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CGU . . . . . 0.479 ' C ' ' O ' ' A' ' 14' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.547 ' N ' ' C ' ' A' ' 14' ' ' ARG . 17.9 tptt -44.45 -47.27 9.91 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.464 -0.895 . . . . 0.0 109.029 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -87.35 -35.55 18.32 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.35 -0.844 . . . . 0.0 109.487 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -83.24 53.88 2.61 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.176 -0.952 . . . . 0.0 109.459 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.37 0 O-C-N 119.844 -1.785 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.477 ' O ' ' C ' ' A' ' 3' ' ' CGU . 3.5 pt-20 -61.21 -24.36 66.28 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.319 -1.107 . . . . 0.0 109.659 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CGU . . . . . 0.477 ' C ' ' O ' ' A' ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.682 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -77.37 -60.34 2.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.306 -0.872 . . . . 0.0 109.365 -179.924 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.47 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 2.8 mt-30 -47.48 -38.86 14.61 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.423 -0.798 . . . . 0.0 109.582 -179.414 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.524 ' HB3' HD12 ' A' ' 13' ' ' ILE . 67.6 m-20 -119.72 38.44 3.9 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.356 -0.84 . . . . 0.0 109.344 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.551 ' O ' ' C ' ' A' ' 10' ' ' HYP . 1.1 mm-40 -56.02 140.48 43.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.371 -0.83 . . . . 0.0 109.523 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HYP . . . . . 0.688 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CGU . . . . . 0.688 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.518 HD12 ' HB2' ' A' ' 9' ' ' GLN . 4.1 mt -60.88 -30.11 69.96 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.524 HD12 ' HB3' ' A' ' 8' ' ' ASN . 6.5 tt -73.76 -35.42 43.45 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 CA-C-O 121.276 0.56 . . . . 0.0 109.975 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.568 ' C ' ' N ' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -91.31 -58.75 2.35 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CGU . . . . . 0.539 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.568 ' N ' ' C ' ' A' ' 14' ' ' ARG . 9.8 tptt -44.87 -56.64 4.36 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.552 -0.859 . . . . 0.0 109.188 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -88.58 -43.47 11.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.176 -0.952 . . . . 0.0 109.396 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.47 ' CG ' ' O ' ' A' ' 18' ' ' ASN . 7.4 t-20 52.0 56.35 7.91 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.28 -0.887 . . . . 0.0 109.599 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.354 0 O-C-N 119.893 -1.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.575 ' HG3' ' HN2' ' A' ' 3' ' ' CGU . 17.0 pt-20 -74.46 -34.01 63.05 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.26 -1.141 . . . . 0.0 109.582 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CGU . . . . . 0.575 ' HN2' ' HG3' ' A' ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.779 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -58.15 -54.83 42.59 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.227 -0.92 . . . . 0.0 109.288 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.424 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 1.6 tp60 -46.78 -43.14 18.02 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.407 -0.808 . . . . 0.0 109.977 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -123.08 38.72 4.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.214 -0.929 . . . . 0.0 109.517 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.54 ' O ' ' C ' ' A' ' 10' ' ' HYP . 2.1 pt20 -63.85 149.21 47.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.263 -0.898 . . . . 0.0 110.277 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HYP . . . . . 0.68 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CGU . . . . . 0.68 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 12' ' ' LEU . 7.6 mt -55.45 -39.95 70.98 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 177.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.497 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.0 tt -65.6 -35.11 74.44 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 CA-C-O 121.45 0.643 . . . . 0.0 109.962 178.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.563 ' C ' ' N ' ' A' ' 16' ' ' LYS . 10.5 ttp180 -86.26 -60.47 1.99 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CGU . . . . . 0.601 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.563 ' N ' ' C ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -49.38 -40.83 37.37 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.419 -0.912 . . . . 0.0 109.278 179.154 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.1 m -83.57 -58.26 2.89 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.306 -0.871 . . . . 0.0 109.621 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -72.13 -140.14 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.28 -0.887 . . . . 0.0 109.487 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.339 0 O-C-N 119.856 -1.778 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -79.29 -29.67 42.57 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.166 -1.196 . . . . 0.0 109.439 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.696 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -70.04 -60.33 2.36 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.224 -0.922 . . . . 0.0 109.332 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.478 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 48.9 mt-30 -45.57 -42.41 11.04 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.318 -0.864 . . . . 0.0 109.657 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -112.95 38.1 2.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.319 -0.863 . . . . 0.0 109.402 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.72 ' HB2' HD12 ' A' ' 12' ' ' LEU . 1.9 mt-30 -67.51 141.69 56.82 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.193 -0.942 . . . . 0.0 109.75 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HYP . . . . . 0.705 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CGU . . . . . 0.705 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.72 HD12 ' HB2' ' A' ' 9' ' ' GLN . 33.3 mt -59.16 -31.34 68.9 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.514 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.4 tt -71.9 -36.38 57.73 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 CA-C-O 121.411 0.624 . . . . 0.0 109.962 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.561 ' C ' ' H ' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -91.66 -59.07 2.22 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -179.722 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CGU . . . . . 0.542 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.561 ' H ' ' C ' ' A' ' 14' ' ' ARG . 19.9 tptt -44.18 -56.65 3.94 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.399 -0.92 . . . . 0.0 109.024 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 55.4 m -88.75 -37.27 15.59 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.254 -0.904 . . . . 0.0 109.412 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -167.87 -47.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.283 -0.886 . . . . 0.0 109.363 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.363 0 O-C-N 119.87 -1.769 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.65 -19.33 64.4 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.316 -1.108 . . . . 0.0 109.634 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CGU . . . . . 0.571 OE22 ' O ' ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.668 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -75.9 -60.89 2.13 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.303 -0.873 . . . . 0.0 109.561 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.453 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 1.5 tp-100 -49.75 -24.03 2.12 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.31 -0.869 . . . . 0.0 109.775 -179.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.406 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -120.4 38.26 4.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.187 -0.946 . . . . 0.0 109.534 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.712 ' HB2' HD12 ' A' ' 12' ' ' LEU . 5.1 mt-30 -61.12 144.14 54.12 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.326 -0.859 . . . . 0.0 109.402 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HYP . . . . . 0.686 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CGU . . . . . 0.686 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.712 HD12 ' HB2' ' A' ' 9' ' ' GLN . 20.0 mt -58.97 -32.67 69.87 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 178.007 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.496 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 6.1 tt -71.02 -35.54 59.7 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 CA-C-O 121.364 0.602 . . . . 0.0 110.004 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.506 ' C ' ' H ' ' A' ' 16' ' ' LYS . 34.4 ttt85 -88.29 -58.64 2.49 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CGU . . . . . 0.534 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.506 ' H ' ' C ' ' A' ' 14' ' ' ARG . 27.3 tptt -44.9 -54.61 6.27 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.571 -0.852 . . . . 0.0 109.381 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.27 -52.83 6.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.341 -0.85 . . . . 0.0 109.662 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.8 m-20 -59.77 127.53 32.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.221 -0.925 . . . . 0.0 109.379 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.348 0 O-C-N 119.916 -1.74 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -20.46 65.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.28 -1.13 . . . . 0.0 109.576 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.675 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.7 OUTLIER -71.34 -58.83 3.16 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.237 -0.915 . . . . 0.0 109.195 179.813 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.438 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 33.3 mt-30 -62.15 -26.31 68.25 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.438 -0.789 . . . . 0.0 109.676 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.411 ' H ' ' C ' ' A' ' 6' ' ' GLN . 40.3 m-80 -123.72 38.18 4.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.118 -0.989 . . . . 0.0 109.533 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.564 ' O ' ' C ' ' A' ' 10' ' ' HYP . 6.7 pt20 -72.26 147.26 46.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.12 -0.988 . . . . 0.0 110.17 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HYP . . . . . 0.676 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CGU . . . . . 0.676 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.568 ' N ' OE12 ' A' ' 11' ' ' CGU . 21.7 mt -59.74 -31.85 70.01 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 178.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.46 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 4.2 tt -75.96 -34.33 27.06 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.717 179.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.481 ' C ' ' N ' ' A' ' 16' ' ' LYS . 1.0 OUTLIER -85.4 -59.05 2.43 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CGU . . . . . 0.542 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.481 ' N ' ' C ' ' A' ' 14' ' ' ARG . 23.4 tptt -46.57 -56.83 5.44 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.159 179.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.78 -32.48 17.85 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.339 -0.85 . . . . 0.0 109.387 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 68.49 -137.93 0.09 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.203 -0.936 . . . . 0.0 109.492 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.334 0 O-C-N 119.886 -1.759 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.386 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -48.27 -38.87 19.82 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.21 -1.171 . . . . 0.0 109.57 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.662 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.7 OUTLIER -75.38 -60.73 2.17 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.316 -0.865 . . . . 0.0 109.428 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.467 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 0.3 OUTLIER -48.03 -42.73 29.03 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.329 -0.857 . . . . 0.0 109.718 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.427 HD22 HG13 ' A' ' 13' ' ' ILE . 9.5 m120 -122.83 38.44 4.18 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 109.41 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.563 ' O ' ' C ' ' A' ' 10' ' ' HYP . 4.6 pt20 -63.51 147.7 50.66 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.28 -0.887 . . . . 0.0 110.191 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . 0.687 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CGU . . . . . 0.687 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.413 ' N ' ' O ' ' A' ' 9' ' ' GLN . 17.1 mt -60.39 -33.52 72.6 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.459 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.2 tt -74.81 -33.74 31.58 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.104 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.522 ' C ' ' N ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -88.84 -58.04 2.69 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -179.525 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CGU . . . . . 0.53 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.522 ' N ' ' C ' ' A' ' 14' ' ' ARG . 24.2 tptt -45.09 -48.42 11.97 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 119.561 -0.856 . . . . 0.0 109.224 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.6 p -88.32 -35.36 17.25 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.338 -0.851 . . . . 0.0 109.67 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 -89.37 76.33 7.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.169 -0.957 . . . . 0.0 109.447 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.339 0 O-C-N 119.901 -1.749 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -76.56 -16.62 59.56 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.335 -1.097 . . . . 0.0 109.431 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CGU . . . . . 0.554 ' C ' OE21 ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.737 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -67.23 -57.07 7.39 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.147 -0.971 . . . . 0.0 109.734 -179.408 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.433 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 11.7 mt-30 -51.08 -21.45 1.88 Allowed 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.341 -0.849 . . . . 0.0 109.898 -179.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -123.1 38.61 4.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.211 -0.931 . . . . 0.0 109.132 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.561 ' O ' ' C ' ' A' ' 10' ' ' HYP . 7.3 pt20 -63.42 148.57 48.16 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.268 -0.895 . . . . 0.0 110.075 -179.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . 0.688 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CGU . . . . . 0.688 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.455 ' N ' ' O ' ' A' ' 9' ' ' GLN . 20.5 mt -60.53 -31.07 70.17 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 106.803 -1.555 . . . . 0.0 106.803 178.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.499 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.3 tt -71.96 -35.7 55.11 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-O 121.393 0.616 . . . . 0.0 109.668 179.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.536 ' C ' ' N ' ' A' ' 16' ' ' LYS . 5.3 tpp180 -88.04 -59.29 2.28 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CGU . . . . . 0.545 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.536 ' N ' ' C ' ' A' ' 14' ' ' ARG . 22.2 tptt -44.34 -51.01 8.85 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.345 -0.942 . . . . 0.0 108.795 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.18 -27.64 26.01 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.319 -0.863 . . . . 0.0 109.2 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 57.09 19.09 4.47 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.372 -0.83 . . . . 0.0 109.454 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.275 0 O-C-N 119.875 -1.766 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 N-CA-C 109.387 -1.485 . . . . 0.0 109.387 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -69.58 -23.08 63.49 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.274 -1.133 . . . . 0.0 109.408 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CGU . . . . . 0.634 OE21 ' CD2' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.406 ' C ' ' O ' ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.654 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -69.19 -61.06 1.95 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.087 -1.008 . . . . 0.0 109.273 -179.874 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.469 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 1.8 tt0 -55.4 -33.59 63.63 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.373 -0.829 . . . . 0.0 109.543 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.634 ' CD2' OE21 ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -118.33 38.52 3.69 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.324 -0.86 . . . . 0.0 109.1 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.577 ' O ' ' C ' ' A' ' 10' ' ' HYP . 1.7 mt-30 -67.25 144.77 55.75 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.283 -0.886 . . . . 0.0 109.827 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . 0.687 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CGU . . . . . 0.687 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.491 HD23 ' HA ' ' A' ' 12' ' ' LEU . 13.5 mt -58.37 -31.48 67.67 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 178.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.489 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.1 tt -74.19 -35.72 41.5 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 CA-C-O 121.352 0.596 . . . . 0.0 109.906 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.489 ' N ' ' CG2' ' A' ' 13' ' ' ILE . 4.3 ttm180 -87.19 -59.35 2.28 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CGU . . . . . 0.573 OE11 OE21 ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.486 ' H ' ' C ' ' A' ' 14' ' ' ARG . 13.2 tptt -44.69 -52.51 8.2 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.573 -0.851 . . . . 0.0 109.147 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.4 ' O ' ' CB ' ' A' ' 18' ' ' ASN . 1.5 t -83.42 -27.76 29.33 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.242 -0.912 . . . . 0.0 109.526 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.4 ' CB ' ' O ' ' A' ' 17' ' ' SER . 3.9 t30 69.01 146.98 0.06 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.25 -0.906 . . . . 0.0 109.365 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.342 0 O-C-N 119.847 -1.783 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -78.5 -16.87 57.03 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.258 -1.143 . . . . 0.0 109.447 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.769 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -59.91 -56.31 23.31 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.171 -0.955 . . . . 0.0 109.228 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.558 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 16.9 mt-30 -48.01 -39.98 21.35 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.38 -0.825 . . . . 0.0 109.531 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -119.41 36.76 4.37 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.143 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.708 HE21 HD12 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -65.63 143.31 57.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.365 -0.834 . . . . 0.0 109.651 -179.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . 0.692 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CGU . . . . . 0.692 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.708 HD12 HE21 ' A' ' 9' ' ' GLN . 21.3 mt -59.08 -30.38 68.04 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 107.124 -1.435 . . . . 0.0 107.124 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.473 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.1 tt -75.52 -34.81 30.49 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-O 121.424 0.63 . . . . 0.0 109.494 179.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.542 ' C ' ' N ' ' A' ' 16' ' ' LYS . 2.1 mtp180 -87.85 -59.49 2.23 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CGU . . . . . 0.571 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.542 ' N ' ' C ' ' A' ' 14' ' ' ARG . 27.3 tptt -45.39 -50.54 12.23 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.599 -0.84 . . . . 0.0 109.153 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 7.9 t -79.68 -35.19 39.52 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.369 -0.832 . . . . 0.0 109.513 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 47.48 73.58 0.19 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.211 -0.93 . . . . 0.0 109.418 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.29 0 O-C-N 119.834 -1.791 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.355 0 N-CA-C 109.451 -1.459 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -61.58 -24.08 66.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.268 -1.137 . . . . 0.0 109.433 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CGU . . . . . 0.41 ' O ' ' N ' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.645 ' C ' HD12 ' A' ' 5' ' ' LEU . 0.9 OUTLIER -77.64 -60.92 2.17 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.323 -0.86 . . . . 0.0 109.159 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.462 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 4.1 mt-30 -60.29 -32.62 71.37 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.338 -0.852 . . . . 0.0 109.503 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.41 ' N ' ' O ' ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -113.85 38.58 2.93 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.373 -0.829 . . . . 0.0 109.136 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.648 ' HB2' HD12 ' A' ' 12' ' ' LEU . 1.2 mt-30 -60.24 143.72 51.98 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.302 -0.874 . . . . 0.0 109.891 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . 0.685 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CGU . . . . . 0.685 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.648 HD12 ' HB2' ' A' ' 9' ' ' GLN . 52.4 mt -61.82 -31.37 71.61 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 178.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.472 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 6.5 tt -74.54 -34.23 34.82 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.837 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.547 ' C ' ' N ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -87.64 -60.06 2.08 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CGU . . . . . 0.479 ' C ' ' O ' ' A' ' 14' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.547 ' N ' ' C ' ' A' ' 14' ' ' ARG . 17.9 tptt -44.45 -47.27 9.91 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.464 -0.895 . . . . 0.0 109.029 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -87.35 -35.55 18.32 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.35 -0.844 . . . . 0.0 109.487 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -83.24 53.88 2.61 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.176 -0.952 . . . . 0.0 109.459 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.37 0 O-C-N 119.844 -1.785 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.477 ' O ' ' C ' ' A' ' 3' ' ' CGU . 3.5 pt-20 -61.21 -24.36 66.28 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.319 -1.107 . . . . 0.0 109.659 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CGU . . . . . 0.477 ' C ' ' O ' ' A' ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.682 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -77.37 -60.34 2.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.306 -0.872 . . . . 0.0 109.365 -179.924 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.47 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 2.8 mt-30 -47.48 -38.86 14.61 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.423 -0.798 . . . . 0.0 109.582 -179.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.524 ' HB3' HD12 ' A' ' 13' ' ' ILE . 67.6 m-20 -119.72 38.44 3.9 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.356 -0.84 . . . . 0.0 109.344 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.551 ' O ' ' C ' ' A' ' 10' ' ' HYP . 1.1 mm-40 -56.02 140.48 43.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.371 -0.83 . . . . 0.0 109.523 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . 0.688 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CGU . . . . . 0.688 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.518 HD12 ' HB2' ' A' ' 9' ' ' GLN . 4.1 mt -60.88 -30.11 69.96 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.524 HD12 ' HB3' ' A' ' 8' ' ' ASN . 6.5 tt -73.76 -35.42 43.45 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 CA-C-O 121.276 0.56 . . . . 0.0 109.975 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.568 ' C ' ' N ' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -91.31 -58.75 2.35 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CGU . . . . . 0.539 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.568 ' N ' ' C ' ' A' ' 14' ' ' ARG . 9.8 tptt -44.87 -56.64 4.36 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.552 -0.859 . . . . 0.0 109.188 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -88.58 -43.47 11.36 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.176 -0.952 . . . . 0.0 109.396 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.47 ' CG ' ' O ' ' A' ' 18' ' ' ASN . 7.4 t-20 52.0 56.35 7.91 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.28 -0.887 . . . . 0.0 109.599 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.354 0 O-C-N 119.893 -1.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.575 ' HG3' ' HN2' ' A' ' 3' ' ' CGU . 17.0 pt-20 -74.46 -34.01 63.05 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.26 -1.141 . . . . 0.0 109.582 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CGU . . . . . 0.575 ' HN2' ' HG3' ' A' ' 2' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.779 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -58.15 -54.83 42.59 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.227 -0.92 . . . . 0.0 109.288 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.424 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 1.6 tp60 -46.78 -43.14 18.02 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.407 -0.808 . . . . 0.0 109.977 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -123.08 38.72 4.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.214 -0.929 . . . . 0.0 109.517 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.54 ' O ' ' C ' ' A' ' 10' ' ' HYP . 0.1 OUTLIER -63.85 149.21 47.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.263 -0.898 . . . . 0.0 110.277 -179.324 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . 0.68 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CGU . . . . . 0.68 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 12' ' ' LEU . 7.6 mt -55.45 -39.95 70.98 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 177.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.497 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.0 tt -65.6 -35.11 74.44 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 CA-C-O 121.45 0.643 . . . . 0.0 109.962 178.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.563 ' C ' ' N ' ' A' ' 16' ' ' LYS . 10.5 ttp180 -86.26 -60.47 1.99 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CGU . . . . . 0.601 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.563 ' N ' ' C ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -49.38 -40.83 37.37 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.419 -0.912 . . . . 0.0 109.278 179.154 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.1 m -83.57 -58.26 2.89 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.306 -0.871 . . . . 0.0 109.621 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -72.13 -140.14 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.28 -0.887 . . . . 0.0 109.487 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.339 0 O-C-N 119.856 -1.778 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -79.29 -29.67 42.57 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.166 -1.196 . . . . 0.0 109.439 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.696 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -70.04 -60.33 2.36 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.224 -0.922 . . . . 0.0 109.332 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.478 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 48.9 mt-30 -45.57 -42.41 11.04 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.318 -0.864 . . . . 0.0 109.657 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -112.95 38.1 2.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.319 -0.863 . . . . 0.0 109.402 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.72 ' HB2' HD12 ' A' ' 12' ' ' LEU . 0.7 OUTLIER -67.51 141.69 56.82 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.193 -0.942 . . . . 0.0 109.75 -179.651 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . 0.705 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CGU . . . . . 0.705 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.72 HD12 ' HB2' ' A' ' 9' ' ' GLN . 33.3 mt -59.16 -31.34 68.9 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.514 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 5.4 tt -71.9 -36.38 57.73 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 CA-C-O 121.411 0.624 . . . . 0.0 109.962 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.561 ' C ' ' H ' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -91.66 -59.07 2.22 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -179.722 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CGU . . . . . 0.542 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.561 ' H ' ' C ' ' A' ' 14' ' ' ARG . 19.9 tptt -44.18 -56.65 3.94 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.399 -0.92 . . . . 0.0 109.024 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 55.4 m -88.75 -37.27 15.59 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.254 -0.904 . . . . 0.0 109.412 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -167.87 -47.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.283 -0.886 . . . . 0.0 109.363 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.363 0 O-C-N 119.87 -1.769 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.65 -19.33 64.4 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.316 -1.108 . . . . 0.0 109.634 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CGU . . . . . 0.571 OE22 ' O ' ' A' ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.668 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -75.9 -60.89 2.13 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.303 -0.873 . . . . 0.0 109.561 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.453 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 1.5 tp-100 -49.75 -24.03 2.12 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.31 -0.869 . . . . 0.0 109.775 -179.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.406 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -120.4 38.26 4.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.187 -0.946 . . . . 0.0 109.534 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.712 ' HB2' HD12 ' A' ' 12' ' ' LEU . 5.1 mt-30 -61.12 144.14 54.12 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.326 -0.859 . . . . 0.0 109.402 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . 0.686 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CGU . . . . . 0.686 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.712 HD12 ' HB2' ' A' ' 9' ' ' GLN . 20.0 mt -58.97 -32.67 69.87 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 178.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.496 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 6.1 tt -71.02 -35.54 59.7 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 CA-C-O 121.364 0.602 . . . . 0.0 110.004 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.506 ' C ' ' H ' ' A' ' 16' ' ' LYS . 34.4 ttt85 -88.29 -58.64 2.49 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CGU . . . . . 0.534 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.506 ' H ' ' C ' ' A' ' 14' ' ' ARG . 27.3 tptt -44.9 -54.61 6.27 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.571 -0.852 . . . . 0.0 109.381 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.27 -52.83 6.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.341 -0.85 . . . . 0.0 109.662 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.8 m-20 -59.77 127.53 32.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.221 -0.925 . . . . 0.0 109.379 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.348 0 O-C-N 119.916 -1.74 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -20.46 65.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.28 -1.13 . . . . 0.0 109.576 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.675 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.7 OUTLIER -71.34 -58.83 3.16 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.237 -0.915 . . . . 0.0 109.195 179.813 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.438 ' N ' ' HG ' ' A' ' 5' ' ' LEU . 33.3 mt-30 -62.15 -26.31 68.25 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.438 -0.789 . . . . 0.0 109.676 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.411 ' H ' ' C ' ' A' ' 6' ' ' GLN . 40.3 m-80 -123.72 38.18 4.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.118 -0.989 . . . . 0.0 109.533 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.564 ' O ' ' C ' ' A' ' 10' ' ' HYP . 6.7 pt20 -72.26 147.26 46.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.12 -0.988 . . . . 0.0 110.17 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . 0.676 ' O ' ' CB ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CGU . . . . . 0.676 ' CB ' ' O ' ' A' ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.568 ' N ' OE12 ' A' ' 11' ' ' CGU . 21.7 mt -59.74 -31.85 70.01 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 178.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.46 ' CG2' ' N ' ' A' ' 14' ' ' ARG . 4.2 tt -75.96 -34.33 27.06 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.717 179.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.481 ' C ' ' N ' ' A' ' 16' ' ' LYS . 1.0 OUTLIER -85.4 -59.05 2.43 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CGU . . . . . 0.542 ' N ' ' O ' ' A' ' 11' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.481 ' N ' ' C ' ' A' ' 14' ' ' ARG . 23.4 tptt -46.57 -56.83 5.44 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.159 179.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.78 -32.48 17.85 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.339 -0.85 . . . . 0.0 109.387 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 68.49 -137.93 0.09 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.203 -0.936 . . . . 0.0 109.492 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.334 0 O-C-N 119.886 -1.759 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_