data_2mzx_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 2mzx _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 ' 186' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 . . . . . 0 N--CA 1.499 2.007 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.535 ' CD1' ' C ' ' A' ' 187' ' ' TYR . 1.4 p90 -134.19 -14.89 2.29 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 118.077 -1.449 . . . . 0.0 111.818 179.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' GLN . . . . . 0.647 ' NE2' ' CZ ' ' A' ' 189' ' ' PHE . 0.0 OUTLIER -44.85 -21.99 0.07 Allowed 'General case' 0 C--N 1.298 -1.669 0 O-C-N 121.213 -0.929 . . . . 0.0 111.072 178.101 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' PHE . . . . . 0.647 ' CZ ' ' NE2' ' A' ' 188' ' ' GLN . 3.7 m-85 -62.75 -28.59 70.08 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.177 -0.952 . . . . 0.0 109.441 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' TRP . . . . . 0.65 ' CZ3' ' CB ' ' A' ' 194' ' ' GLN . 3.7 t90 -86.67 -33.71 20.0 Favored 'General case' 0 C--N 1.293 -1.875 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.468 ' HE2' ' HA ' ' A' ' 191' ' ' LYS . 2.3 mmpt? -68.13 -57.24 6.39 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 122.091 0.948 . . . . 0.0 111.123 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.541 ' ND2' ' O ' ' A' ' 189' ' ' PHE . 0.1 OUTLIER -62.19 -9.76 8.63 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.505 -178.305 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . 0.545 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.1 OUTLIER -110.08 -39.63 4.97 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.188 -1.57 . . . . 0.0 110.531 -179.463 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.65 ' CB ' ' CZ3' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -44.18 -25.4 0.22 Allowed 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 119.766 -0.774 . . . . 0.0 109.994 -178.988 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' THR . . . . . 0.509 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 3.2 m . . . . . 0 N--CA 1.488 1.475 0 O-C-N 121.219 -0.925 . . . . 0.0 109.9 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' GLN . . . . . 0.547 ' O ' ' CZ ' ' A' ' 189' ' ' PHE . 45.2 mt-30 . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 121.051 0.453 . . . . 0.0 110.476 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.631 ' HA ' ' CZ ' ' A' ' 189' ' ' PHE . 0.1 OUTLIER -142.33 -28.88 0.59 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.165 -0.959 . . . . 0.0 111.324 -178.75 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' GLN . . . . . 0.517 ' O ' ' ND2' ' A' ' 192' ' ' ASN . 0.0 OUTLIER -45.28 -19.19 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.247 -0.908 . . . . 0.0 112.724 -178.57 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' PHE . . . . . 0.631 ' CZ ' ' HA ' ' A' ' 187' ' ' TYR . 1.8 p90 -62.85 -37.46 86.91 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 120.211 -1.556 . . . . 0.0 109.42 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' TRP . . . . . 0.568 ' HA ' ' CD1' ' A' ' 193' ' ' PHE . 7.2 p-90 -88.98 -23.71 22.57 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.15 -0.969 . . . . 0.0 110.337 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.59 ' CD ' ' N ' ' A' ' 192' ' ' ASN . 0.0 OUTLIER -73.53 -46.04 50.06 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.772 -1.205 . . . . 0.0 111.441 -178.321 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.59 ' N ' ' CD ' ' A' ' 191' ' ' LYS . 0.1 OUTLIER -70.26 -5.16 25.66 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 121.154 -0.966 . . . . 0.0 111.615 -178.924 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . 0.568 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.1 OUTLIER -119.28 -34.56 3.81 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 120.225 -1.547 . . . . 0.0 110.269 -179.674 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.533 ' N ' ' CD1' ' A' ' 193' ' ' PHE . 1.2 pp0? -42.59 -26.48 0.12 Allowed 'General case' 0 C--N 1.292 -1.894 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.619 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' THR . . . . . 0.474 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 38.1 m . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.339 -0.85 . . . . 0.0 109.682 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' GLN . . . . . 0.564 ' C ' ' CE2' ' A' ' 189' ' ' PHE . 11.0 pt20 . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 120.684 0.278 . . . . 0.0 111.269 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.578 ' CG ' ' N ' ' A' ' 188' ' ' GLN . 23.1 p90 -155.74 -44.94 0.08 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.743 -1.223 . . . . 0.0 112.24 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' GLN . . . . . 0.578 ' N ' ' CG ' ' A' ' 187' ' ' TYR . 0.0 OUTLIER -63.44 -13.02 35.95 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.04 -1.038 . . . . 0.0 112.758 -178.303 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' PHE . . . . . 0.564 ' CE2' ' C ' ' A' ' 186' ' ' GLN . 0.2 OUTLIER -55.27 -23.82 24.98 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.282 -1.511 . . . . 0.0 109.238 -179.016 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' TRP . . . . . 0.595 ' CE3' ' O ' ' A' ' 190' ' ' TRP . 8.7 t90 -89.2 -33.49 17.0 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-O 121.934 0.873 . . . . 0.0 108.842 178.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.43 ' HB2' ' HA ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -73.76 -54.83 7.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.565 -0.709 . . . . 0.0 110.875 -178.685 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.543 ' ND2' ' O ' ' A' ' 189' ' ' PHE . 0.0 OUTLIER -52.9 -13.49 0.44 Allowed 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.512 -0.742 . . . . 0.0 111.307 -179.68 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . 0.592 ' CD2' ' O ' ' A' ' 190' ' ' TRP . 0.2 OUTLIER -110.34 -31.97 7.11 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 120.41 -1.432 . . . . 0.0 110.941 -179.346 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.541 ' CB ' ' CZ3' ' A' ' 190' ' ' TRP . 6.1 pt20 -40.77 -26.93 0.05 OUTLIER 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.272 -178.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' THR . . . . . 0.463 ' N ' ' O ' ' A' ' 193' ' ' PHE . 10.4 t . . . . . 0 N--CA 1.489 1.514 0 O-C-N 121.021 -1.049 . . . . 0.0 110.014 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' GLN . . . . . 0.568 ' C ' ' CE2' ' A' ' 189' ' ' PHE . 1.6 pt20 . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.746 0.308 . . . . 0.0 110.864 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.584 ' HA ' ' CZ ' ' A' ' 189' ' ' PHE . 0.6 OUTLIER -158.68 -39.0 0.06 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.719 -1.238 . . . . 0.0 112.03 -179.737 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' GLN . . . . . 0.526 ' HA ' ' HB3' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -53.7 -15.3 1.16 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.183 -0.948 . . . . 0.0 112.569 -178.076 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' PHE . . . . . 0.584 ' CZ ' ' HA ' ' A' ' 187' ' ' TYR . 0.5 OUTLIER -56.24 -40.0 73.43 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.309 -1.494 . . . . 0.0 110.514 -178.377 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' TRP . . . . . 0.681 ' HA ' ' CE2' ' A' ' 193' ' ' PHE . 20.7 p-90 -89.72 -21.8 22.51 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 120.706 -1.246 . . . . 0.0 110.648 179.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.627 ' HA ' ' CE3' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -78.17 -42.34 31.87 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.238 -0.914 . . . . 0.0 111.554 -177.878 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.523 ' HA ' ' CE ' ' A' ' 191' ' ' LYS . 0.2 OUTLIER -63.72 -7.65 8.18 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.299 -1.36 . . . . 0.0 110.851 -179.264 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . 0.681 ' CE2' ' HA ' ' A' ' 190' ' ' TRP . 0.8 OUTLIER -131.52 -33.04 1.47 Allowed 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.101 -1.624 . . . . 0.0 111.813 179.58 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.629 ' N ' ' CD1' ' A' ' 193' ' ' PHE . 10.8 mm-40 -43.72 -37.37 2.64 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.522 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' THR . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.484 -0.76 . . . . 0.0 109.519 179.071 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' GLN . . . . . 0.503 ' O ' ' CE2' ' A' ' 189' ' ' PHE . 28.7 mt-30 . . . . . 0 N--CA 1.494 1.774 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.604 ' CD1' ' N ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -120.62 -17.84 7.93 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.471 -1.393 . . . . 0.0 111.759 -179.378 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' GLN . . . . . 0.638 ' NE2' ' CZ ' ' A' ' 189' ' ' PHE . 0.0 OUTLIER -53.62 -16.43 1.59 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.925 -1.109 . . . . 0.0 110.882 179.873 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' PHE . . . . . 0.638 ' CZ ' ' NE2' ' A' ' 188' ' ' GLN . 4.5 m-85 -58.27 -22.56 53.06 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.318 -0.864 . . . . 0.0 109.083 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' TRP . . . . . 0.623 ' CD2' ' HG3' ' A' ' 194' ' ' GLN . 5.2 t90 -86.13 -29.76 23.05 Favored 'General case' 0 C--N 1.293 -1.878 0 CA-C-O 121.559 0.695 . . . . 0.0 109.314 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.505 ' HE2' ' HA ' ' A' ' 188' ' ' GLN . 0.3 OUTLIER -80.93 -56.56 4.03 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.913 -178.503 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.445 ' ND2' ' HA ' ' A' ' 189' ' ' PHE . 0.1 OUTLIER -55.85 -11.75 1.12 Allowed 'General case' 0 C--N 1.294 -1.838 0 O-C-N 121.91 -0.494 . . . . 0.0 111.088 -179.287 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . 0.586 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.4 OUTLIER -110.86 -43.44 3.79 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 117.594 -1.642 . . . . 0.0 110.89 -179.147 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.623 ' HG3' ' CD2' ' A' ' 190' ' ' TRP . 1.8 mm-40 -43.97 -56.82 3.7 Favored 'General case' 0 C--N 1.289 -2.057 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.609 -179.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 C--N 1.302 -1.497 0 C-N-CA 119.631 -0.828 . . . . 0.0 109.106 179.066 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' GLN . . . . . 0.578 ' HB3' ' CE1' ' A' ' 187' ' ' TYR . 5.1 tt0 . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 121.272 0.558 . . . . 0.0 110.447 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.634 ' CD1' ' N ' ' A' ' 187' ' ' TYR . 0.1 OUTLIER -142.06 -37.32 0.4 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.969 -1.082 . . . . 0.0 110.214 -179.785 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' GLN . . . . . 0.526 ' OE1' ' N ' ' A' ' 189' ' ' PHE . 0.0 OUTLIER -45.4 -16.37 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -179.144 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' PHE . . . . . 0.597 ' CZ ' ' HA ' ' A' ' 187' ' ' TYR . 1.2 p90 -65.95 -24.52 66.82 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 120.236 -1.54 . . . . 0.0 108.64 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' TRP . . . . . 0.601 ' O ' ' CE3' ' A' ' 190' ' ' TRP . 9.2 t90 -87.71 -32.55 19.12 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.493 ' HA ' ' HG2' ' A' ' 194' ' ' GLN . 0.9 OUTLIER -76.79 -54.2 6.94 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.721 0.772 . . . . 0.0 110.826 -178.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.514 ' ND2' ' O ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -56.6 -10.46 0.99 Allowed 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.543 -0.723 . . . . 0.0 111.303 -179.599 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . 0.588 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.5 OUTLIER -113.38 -35.33 5.33 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.29 -1.507 . . . . 0.0 110.524 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.569 ' HB3' ' CZ3' ' A' ' 190' ' ' TRP . 1.1 pp0? -41.63 -25.43 0.05 Allowed 'General case' 0 C--N 1.288 -2.099 0 C-N-CA 120.225 -0.59 . . . . 0.0 110.167 -179.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' THR . . . . . 0.525 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 15.0 t . . . . . 0 N--CA 1.491 1.589 0 O-C-N 121.015 -1.053 . . . . 0.0 109.174 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' GLN . . . . . 0.582 ' HB2' ' CZ ' ' A' ' 187' ' ' TYR . 31.5 mt-30 . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.582 ' CZ ' ' HB2' ' A' ' 186' ' ' GLN . 0.7 OUTLIER -140.0 -45.89 0.43 Allowed 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.323 -1.486 . . . . 0.0 113.44 -178.433 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' GLN . . . . . 0.529 ' O ' ' ND2' ' A' ' 192' ' ' ASN . 0.0 OUTLIER -43.35 -22.95 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.712 -1.242 . . . . 0.0 112.488 -176.571 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' PHE . . . . . 0.534 ' O ' ' ND2' ' A' ' 192' ' ' ASN . 11.7 m-85 -51.11 -38.42 51.76 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.252 -1.53 . . . . 0.0 109.832 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' TRP . . . . . 0.624 ' O ' ' CE3' ' A' ' 190' ' ' TRP . 9.1 t90 -88.72 -27.93 20.87 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 121.286 -0.884 . . . . 0.0 109.617 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.572 ' HE2' ' CE3' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -70.66 -55.94 7.58 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.056 -1.027 . . . . 0.0 110.733 -179.139 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.534 ' ND2' ' O ' ' A' ' 189' ' ' PHE . 0.1 OUTLIER -60.22 -10.75 4.93 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.89 -0.506 . . . . 0.0 112.339 -179.274 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . 0.481 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.1 OUTLIER -106.8 -37.91 6.24 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.053 -1.655 . . . . 0.0 109.939 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.584 ' HB3' ' CZ3' ' A' ' 190' ' ' TRP . 1.9 pp0? -42.73 -26.19 0.12 Allowed 'General case' 0 C--N 1.29 -1.994 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.792 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' THR . . . . . 0.502 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 2.2 m . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.255 -0.903 . . . . 0.0 109.134 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 . . . . . 0 N--CA 1.495 1.825 0 CA-C-O 120.995 0.426 . . . . 0.0 111.317 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.599 ' CG ' ' N ' ' A' ' 188' ' ' GLN . 0.1 OUTLIER -87.17 -49.08 7.53 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.851 -1.155 . . . . 0.0 111.786 -179.049 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' GLN . . . . . 0.599 ' N ' ' CG ' ' A' ' 187' ' ' TYR . 0.0 OUTLIER -66.54 -33.51 75.85 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.844 -1.16 . . . . 0.0 113.459 -177.274 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' PHE . . . . . 0.587 ' CD1' ' N ' ' A' ' 189' ' ' PHE . 5.5 m-30 -52.12 -36.0 49.8 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.357 -1.464 . . . . 0.0 110.406 -179.047 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' TRP . . . . . 0.617 ' O ' ' CE3' ' A' ' 190' ' ' TRP . 8.1 t90 -84.41 -32.9 23.87 Favored 'General case' 0 C--N 1.293 -1.889 0 C-N-CA 119.609 -0.836 . . . . 0.0 109.586 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.555 ' HE3' ' N ' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -77.53 -54.63 6.19 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.809 -178.286 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.566 ' ND2' ' O ' ' A' ' 188' ' ' GLN . 0.1 OUTLIER -56.14 -10.36 0.83 Allowed 'General case' 0 C--N 1.295 -1.781 0 O-C-N 121.592 -0.693 . . . . 0.0 111.362 -179.884 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . 0.563 ' CD2' ' HA ' ' A' ' 190' ' ' TRP . 0.2 OUTLIER -112.96 -39.95 4.1 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.207 -1.558 . . . . 0.0 111.439 -179.448 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.496 ' HG3' ' N ' ' A' ' 195' ' ' THR . 0.0 OUTLIER -42.46 -27.36 0.15 Allowed 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.436 -178.754 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' THR . . . . . 0.496 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 6.2 m . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.052 -1.03 . . . . 0.0 109.811 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' GLN . . . . . 0.574 ' CG ' ' O ' ' A' ' 186' ' ' GLN . 4.9 tt0 . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.257 0.551 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.596 ' CD1' ' N ' ' A' ' 188' ' ' GLN . 0.2 OUTLIER -104.78 -30.69 9.73 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.456 -1.403 . . . . 0.0 112.395 -178.881 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' GLN . . . . . 0.596 ' N ' ' CD1' ' A' ' 187' ' ' TYR . 0.0 OUTLIER -45.59 -22.86 0.18 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.802 -1.186 . . . . 0.0 111.736 -179.13 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' PHE . . . . . 0.563 ' O ' ' ND2' ' A' ' 192' ' ' ASN . 7.3 m-85 -55.27 -41.51 72.34 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.18 -0.95 . . . . 0.0 111.022 -178.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' TRP . . . . . 0.614 ' HA ' ' CD2' ' A' ' 193' ' ' PHE . 9.6 p-90 -89.19 -24.25 22.2 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 120.833 -1.167 . . . . 0.0 110.217 179.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.544 ' HA ' ' CE3' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -73.83 -54.41 8.07 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.46 -0.775 . . . . 0.0 110.719 -178.657 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.563 ' ND2' ' O ' ' A' ' 189' ' ' PHE . 0.1 OUTLIER -56.94 -10.45 1.1 Allowed 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.491 -0.756 . . . . 0.0 111.416 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . 0.624 ' CD1' ' C ' ' A' ' 193' ' ' PHE . 0.1 OUTLIER -116.51 -33.85 4.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.237 -1.539 . . . . 0.0 110.855 179.917 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.479 ' HB3' ' O ' ' A' ' 190' ' ' TRP . 1.0 OUTLIER -41.04 -27.35 0.06 Allowed 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.787 -178.988 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 193' ' ' PHE . 15.8 m . . . . . 0 N--CA 1.489 1.511 0 O-C-N 121.218 -0.926 . . . . 0.0 109.274 178.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.499 0 CA-C-O 120.394 0.14 . . . . 0.0 111.353 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.505 ' CG ' ' N ' ' A' ' 188' ' ' GLN . 6.5 p90 -150.11 -39.52 0.14 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.467 -1.396 . . . . 0.0 112.652 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' GLN . . . . . 0.578 ' OE1' ' CD1' ' A' ' 189' ' ' PHE . 0.0 OUTLIER -44.84 -20.55 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.826 -1.171 . . . . 0.0 111.657 -178.129 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' PHE . . . . . 0.62 ' O ' ' CZ ' ' A' ' 193' ' ' PHE . 63.8 m-85 -44.29 -60.93 1.69 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.624 -1.297 . . . . 0.0 110.711 -178.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' TRP . . . . . 0.625 ' CE3' ' N ' ' A' ' 191' ' ' LYS . 17.7 p-90 -91.27 -15.18 29.58 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 121.304 -0.872 . . . . 0.0 111.684 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.625 ' N ' ' CE3' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -66.75 -49.75 64.95 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.746 -1.221 . . . . 0.0 112.209 -176.903 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.632 ' ND2' ' CE2' ' A' ' 193' ' ' PHE . 0.0 OUTLIER -49.61 -14.94 0.13 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.785 -1.197 . . . . 0.0 111.84 -178.189 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . 0.632 ' CE2' ' ND2' ' A' ' 192' ' ' ASN . 11.6 p90 -144.77 -13.79 0.56 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 119.85 -1.781 . . . . 0.0 113.213 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.528 ' HB2' ' O ' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -42.71 -44.89 4.52 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.869 -1.145 . . . . 0.0 110.521 -178.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' THR . . . . . . . . . . . . . 3.4 m . . . . . 0 C--N 1.299 -1.611 0 O-C-N 121.4 -0.812 . . . . 0.0 110.746 -179.613 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' GLN . . . . . 0.561 ' C ' ' CE2' ' A' ' 189' ' ' PHE . 1.9 pt20 . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' TYR . . . . . 0.639 ' CD1' ' N ' ' A' ' 188' ' ' GLN . 2.2 p90 -157.67 -47.87 0.07 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.218 -1.551 . . . . 0.0 112.637 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' GLN . . . . . 0.639 ' N ' ' CD1' ' A' ' 187' ' ' TYR . 0.0 OUTLIER -49.16 -14.71 0.09 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 120.987 -1.071 . . . . 0.0 112.9 -178.416 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' PHE . . . . . 0.561 ' CE2' ' C ' ' A' ' 186' ' ' GLN . 1.0 OUTLIER -62.1 -29.43 70.32 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 120.207 -1.558 . . . . 0.0 109.606 -178.478 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' TRP . . . . . 0.648 ' CZ3' ' CB ' ' A' ' 194' ' ' GLN . 10.5 t90 -88.49 -30.9 19.02 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 121.342 -0.849 . . . . 0.0 109.432 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' LYS . . . . . 0.479 ' HD2' ' CD1' ' A' ' 187' ' ' TYR . 0.0 OUTLIER -74.07 -54.39 7.93 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.55 -0.86 . . . . 0.0 110.532 -179.079 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.537 ' ND2' ' O ' ' A' ' 189' ' ' PHE . 0.0 OUTLIER -56.94 -10.64 1.14 Allowed 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.598 -0.689 . . . . 0.0 111.618 -179.399 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . 0.605 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.3 OUTLIER -120.93 -23.09 5.98 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.201 -1.562 . . . . 0.0 111.356 -179.425 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 194' ' ' GLN . . . . . 0.648 ' CB ' ' CZ3' ' A' ' 190' ' ' TRP . 10.4 pt20 -40.15 -30.88 0.11 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -179.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 193' ' ' PHE . 31.4 m . . . . . 0 C--N 1.303 -1.451 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 186' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 . . . . . 0 N--CA 1.499 2.007 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.535 ' CD1' ' C ' ' A' ' 187' ' ' TYR . 1.4 p90 -134.19 -14.89 2.29 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 118.077 -1.449 . . . . 0.0 111.818 179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 188' ' ' GLN . . . . . 0.544 ' HG2' ' N ' ' A' ' 189' ' ' PHE . 3.7 pm0 -44.85 -21.99 0.07 Allowed 'General case' 0 C--N 1.298 -1.669 0 O-C-N 121.213 -0.929 . . . . 0.0 111.072 178.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 189' ' ' PHE . . . . . 0.544 ' N ' ' HG2' ' A' ' 188' ' ' GLN . 3.7 m-85 -62.75 -28.59 70.08 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.177 -0.952 . . . . 0.0 109.441 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 190' ' ' TRP . . . . . 0.65 ' CZ3' ' CB ' ' A' ' 194' ' ' GLN . 3.7 t90 -86.67 -33.71 20.0 Favored 'General case' 0 C--N 1.293 -1.875 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.465 ' N ' ' HE3' ' A' ' 191' ' ' LYS . 2.3 mmpt? -68.13 -57.24 6.39 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 122.091 0.948 . . . . 0.0 111.123 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 13.1 p-10 -62.19 -9.76 8.63 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.505 -178.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 193' ' ' PHE . . . . . 0.596 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.1 OUTLIER -110.08 -39.63 4.97 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.188 -1.57 . . . . 0.0 110.531 -179.463 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.65 ' CB ' ' CZ3' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -44.18 -25.4 0.22 Allowed 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 119.766 -0.774 . . . . 0.0 109.994 -178.988 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 195' ' ' THR . . . . . 0.497 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 3.2 m . . . . . 0 N--CA 1.488 1.475 0 O-C-N 121.219 -0.925 . . . . 0.0 109.9 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 186' ' ' GLN . . . . . 0.547 ' O ' ' CZ ' ' A' ' 189' ' ' PHE . 45.2 mt-30 . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 121.051 0.453 . . . . 0.0 110.476 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.672 ' HA ' ' CZ ' ' A' ' 189' ' ' PHE . 0.1 OUTLIER -142.33 -28.88 0.59 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.165 -0.959 . . . . 0.0 111.324 -178.75 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 188' ' ' GLN . . . . . 0.553 ' HA ' ' HB3' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -45.28 -19.19 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.247 -0.908 . . . . 0.0 112.724 -178.57 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 189' ' ' PHE . . . . . 0.672 ' CZ ' ' HA ' ' A' ' 187' ' ' TYR . 1.8 p90 -62.85 -37.46 86.91 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 120.211 -1.556 . . . . 0.0 109.42 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 190' ' ' TRP . . . . . 0.623 ' HA ' ' CD1' ' A' ' 193' ' ' PHE . 7.2 p-90 -88.98 -23.71 22.57 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.15 -0.969 . . . . 0.0 110.337 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.59 ' CD ' ' N ' ' A' ' 192' ' ' ASN . 0.0 OUTLIER -73.53 -46.04 50.06 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.772 -1.205 . . . . 0.0 111.441 -178.321 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.59 ' N ' ' CD ' ' A' ' 191' ' ' LYS . 18.8 p30 -70.26 -5.16 25.66 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 121.154 -0.966 . . . . 0.0 111.615 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 193' ' ' PHE . . . . . 0.623 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.1 OUTLIER -119.28 -34.56 3.81 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 120.225 -1.547 . . . . 0.0 110.269 -179.674 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.533 ' N ' ' CD1' ' A' ' 193' ' ' PHE . 1.2 pp0? -42.59 -26.48 0.12 Allowed 'General case' 0 C--N 1.292 -1.894 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.619 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 195' ' ' THR . . . . . 0.461 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 38.1 m . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.339 -0.85 . . . . 0.0 109.682 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 186' ' ' GLN . . . . . 0.564 ' C ' ' CE2' ' A' ' 189' ' ' PHE . 11.0 pt20 . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 120.684 0.278 . . . . 0.0 111.269 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.578 ' CG ' ' N ' ' A' ' 188' ' ' GLN . 23.1 p90 -155.74 -44.94 0.08 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.743 -1.223 . . . . 0.0 112.24 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 188' ' ' GLN . . . . . 0.578 ' N ' ' CG ' ' A' ' 187' ' ' TYR . 2.3 pm0 -63.44 -13.02 35.95 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.04 -1.038 . . . . 0.0 112.758 -178.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 189' ' ' PHE . . . . . 0.564 ' CE2' ' C ' ' A' ' 186' ' ' GLN . 0.2 OUTLIER -55.27 -23.82 24.98 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.282 -1.511 . . . . 0.0 109.238 -179.016 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 190' ' ' TRP . . . . . 0.595 ' O ' ' CE3' ' A' ' 190' ' ' TRP . 8.7 t90 -89.2 -33.49 17.0 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-O 121.934 0.873 . . . . 0.0 108.842 178.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.497 ' HB2' ' HA ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -73.76 -54.83 7.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.565 -0.709 . . . . 0.0 110.875 -178.685 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -52.9 -13.49 0.44 Allowed 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.512 -0.742 . . . . 0.0 111.307 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 193' ' ' PHE . . . . . 0.592 ' CD2' ' O ' ' A' ' 190' ' ' TRP . 0.2 OUTLIER -110.34 -31.97 7.11 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 120.41 -1.432 . . . . 0.0 110.941 -179.346 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.541 ' CB ' ' CZ3' ' A' ' 190' ' ' TRP . 6.1 pt20 -40.77 -26.93 0.05 OUTLIER 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.272 -178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 195' ' ' THR . . . . . 0.463 ' N ' ' O ' ' A' ' 193' ' ' PHE . 10.4 t . . . . . 0 N--CA 1.489 1.514 0 O-C-N 121.021 -1.049 . . . . 0.0 110.014 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' GLN . . . . . 0.568 ' C ' ' CE2' ' A' ' 189' ' ' PHE . 1.6 pt20 . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.746 0.308 . . . . 0.0 110.864 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.602 ' HA ' ' CZ ' ' A' ' 189' ' ' PHE . 0.6 OUTLIER -158.68 -39.0 0.06 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.719 -1.238 . . . . 0.0 112.03 -179.737 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 188' ' ' GLN . . . . . 0.663 ' NE2' ' N ' ' A' ' 189' ' ' PHE . 0.6 OUTLIER -53.7 -15.3 1.16 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.183 -0.948 . . . . 0.0 112.569 -178.076 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 189' ' ' PHE . . . . . 0.663 ' N ' ' NE2' ' A' ' 188' ' ' GLN . 0.5 OUTLIER -56.24 -40.0 73.43 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.309 -1.494 . . . . 0.0 110.514 -178.377 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 190' ' ' TRP . . . . . 0.703 ' HA ' ' CE2' ' A' ' 193' ' ' PHE . 20.7 p-90 -89.72 -21.8 22.51 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 120.706 -1.246 . . . . 0.0 110.648 179.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.612 ' HB3' ' HA ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -78.17 -42.34 31.87 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.238 -0.914 . . . . 0.0 111.554 -177.878 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.486 ' HB3' ' HE2' ' A' ' 191' ' ' LYS . 3.6 p30 -63.72 -7.65 8.18 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.299 -1.36 . . . . 0.0 110.851 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 193' ' ' PHE . . . . . 0.703 ' CE2' ' HA ' ' A' ' 190' ' ' TRP . 0.8 OUTLIER -131.52 -33.04 1.47 Allowed 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.101 -1.624 . . . . 0.0 111.813 179.58 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.629 ' N ' ' CD1' ' A' ' 193' ' ' PHE . 10.8 mm-40 -43.72 -37.37 2.64 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.522 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 195' ' ' THR . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.484 -0.76 . . . . 0.0 109.519 179.071 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 186' ' ' GLN . . . . . 0.515 ' HA ' ' CZ ' ' A' ' 189' ' ' PHE . 28.7 mt-30 . . . . . 0 N--CA 1.494 1.774 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.604 ' CD1' ' N ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -120.62 -17.84 7.93 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.471 -1.393 . . . . 0.0 111.759 -179.378 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 188' ' ' GLN . . . . . 0.604 ' N ' ' CD1' ' A' ' 187' ' ' TYR . 2.0 pm0 -53.62 -16.43 1.59 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.925 -1.109 . . . . 0.0 110.882 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 189' ' ' PHE . . . . . 0.515 ' CZ ' ' HA ' ' A' ' 186' ' ' GLN . 4.5 m-85 -58.27 -22.56 53.06 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.318 -0.864 . . . . 0.0 109.083 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 190' ' ' TRP . . . . . 0.649 ' HA ' ' CD1' ' A' ' 193' ' ' PHE . 5.2 t90 -86.13 -29.76 23.05 Favored 'General case' 0 C--N 1.293 -1.878 0 CA-C-O 121.559 0.695 . . . . 0.0 109.314 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.504 ' HD2' ' OH ' ' A' ' 187' ' ' TYR . 0.3 OUTLIER -80.93 -56.56 4.03 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.913 -178.503 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -55.85 -11.75 1.12 Allowed 'General case' 0 C--N 1.294 -1.838 0 O-C-N 121.91 -0.494 . . . . 0.0 111.088 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 193' ' ' PHE . . . . . 0.649 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.4 OUTLIER -110.86 -43.44 3.79 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 117.594 -1.642 . . . . 0.0 110.89 -179.147 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.642 ' HG3' ' CD2' ' A' ' 190' ' ' TRP . 1.8 mm-40 -43.97 -56.82 3.7 Favored 'General case' 0 C--N 1.289 -2.057 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.609 -179.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 195' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 C--N 1.302 -1.497 0 C-N-CA 119.631 -0.828 . . . . 0.0 109.106 179.066 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 186' ' ' GLN . . . . . 0.575 ' HB3' ' CE1' ' A' ' 187' ' ' TYR . 5.1 tt0 . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 121.272 0.558 . . . . 0.0 110.447 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.634 ' N ' ' CD1' ' A' ' 187' ' ' TYR . 0.1 OUTLIER -142.06 -37.32 0.4 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.969 -1.082 . . . . 0.0 110.214 -179.785 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 188' ' ' GLN . . . . . 0.676 ' NE2' ' N ' ' A' ' 189' ' ' PHE . 0.7 OUTLIER -45.4 -16.37 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -179.144 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 189' ' ' PHE . . . . . 0.676 ' N ' ' NE2' ' A' ' 188' ' ' GLN . 1.2 p90 -65.95 -24.52 66.82 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 120.236 -1.54 . . . . 0.0 108.64 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 190' ' ' TRP . . . . . 0.64 ' HA ' ' CD1' ' A' ' 193' ' ' PHE . 9.2 t90 -87.71 -32.55 19.12 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.565 ' HA ' ' HG2' ' A' ' 194' ' ' GLN . 0.9 OUTLIER -76.79 -54.2 6.94 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.721 0.772 . . . . 0.0 110.826 -178.879 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -56.6 -10.46 0.99 Allowed 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.543 -0.723 . . . . 0.0 111.303 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 193' ' ' PHE . . . . . 0.64 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.5 OUTLIER -113.38 -35.33 5.33 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.29 -1.507 . . . . 0.0 110.524 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.588 ' HB3' ' CZ3' ' A' ' 190' ' ' TRP . 1.1 pp0? -41.63 -25.43 0.05 Allowed 'General case' 0 C--N 1.288 -2.099 0 C-N-CA 120.225 -0.59 . . . . 0.0 110.167 -179.202 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 195' ' ' THR . . . . . 0.524 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 15.0 t . . . . . 0 N--CA 1.491 1.589 0 O-C-N 121.015 -1.053 . . . . 0.0 109.174 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 186' ' ' GLN . . . . . 0.597 ' HB2' ' CZ ' ' A' ' 187' ' ' TYR . 31.5 mt-30 . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.597 ' CZ ' ' HB2' ' A' ' 186' ' ' GLN . 0.7 OUTLIER -140.0 -45.89 0.43 Allowed 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.323 -1.486 . . . . 0.0 113.44 -178.433 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 188' ' ' GLN . . . . . 0.53 ' HA ' ' CG ' ' A' ' 191' ' ' LYS . 2.0 pm0 -43.35 -22.95 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.712 -1.242 . . . . 0.0 112.488 -176.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 189' ' ' PHE . . . . . 0.451 ' N ' ' HG2' ' A' ' 188' ' ' GLN . 11.7 m-85 -51.11 -38.42 51.76 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.252 -1.53 . . . . 0.0 109.832 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 190' ' ' TRP . . . . . 0.624 ' O ' ' CE3' ' A' ' 190' ' ' TRP . 9.1 t90 -88.72 -27.93 20.87 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 121.286 -0.884 . . . . 0.0 109.617 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.574 ' HE2' ' CE3' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -70.66 -55.94 7.58 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.056 -1.027 . . . . 0.0 110.733 -179.139 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -60.22 -10.75 4.93 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.89 -0.506 . . . . 0.0 112.339 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 193' ' ' PHE . . . . . 0.54 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.1 OUTLIER -106.8 -37.91 6.24 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.053 -1.655 . . . . 0.0 109.939 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.604 ' HB3' ' CZ3' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -42.73 -26.19 0.12 Allowed 'General case' 0 C--N 1.29 -1.994 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.792 -179.682 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 195' ' ' THR . . . . . 0.489 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 2.2 m . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.255 -0.903 . . . . 0.0 109.134 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 186' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 . . . . . 0 N--CA 1.495 1.825 0 CA-C-O 120.995 0.426 . . . . 0.0 111.317 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.599 ' CG ' ' N ' ' A' ' 188' ' ' GLN . 0.1 OUTLIER -87.17 -49.08 7.53 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.851 -1.155 . . . . 0.0 111.786 -179.049 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 188' ' ' GLN . . . . . 0.599 ' N ' ' CG ' ' A' ' 187' ' ' TYR . 0.2 OUTLIER -66.54 -33.51 75.85 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.844 -1.16 . . . . 0.0 113.459 -177.274 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 189' ' ' PHE . . . . . 0.599 ' CD1' ' HG2' ' A' ' 188' ' ' GLN . 5.5 m-30 -52.12 -36.0 49.8 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.357 -1.464 . . . . 0.0 110.406 -179.047 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 190' ' ' TRP . . . . . 0.621 ' HA ' ' CD2' ' A' ' 193' ' ' PHE . 8.1 t90 -84.41 -32.9 23.87 Favored 'General case' 0 C--N 1.293 -1.889 0 C-N-CA 119.609 -0.836 . . . . 0.0 109.586 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.586 ' N ' ' HE3' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -77.53 -54.63 6.19 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.809 -178.286 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.416 ' OD1' ' O ' ' A' ' 188' ' ' GLN . 10.3 p-10 -56.14 -10.36 0.83 Allowed 'General case' 0 C--N 1.295 -1.781 0 O-C-N 121.592 -0.693 . . . . 0.0 111.362 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 193' ' ' PHE . . . . . 0.621 ' CD2' ' HA ' ' A' ' 190' ' ' TRP . 0.2 OUTLIER -112.96 -39.95 4.1 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.207 -1.558 . . . . 0.0 111.439 -179.448 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.486 ' HG3' ' N ' ' A' ' 195' ' ' THR . 0.0 OUTLIER -42.46 -27.36 0.15 Allowed 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.436 -178.754 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 195' ' ' THR . . . . . 0.486 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 6.2 m . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.052 -1.03 . . . . 0.0 109.811 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 186' ' ' GLN . . . . . 0.618 ' HA ' ' CE2' ' A' ' 189' ' ' PHE . 4.9 tt0 . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.257 0.551 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.596 ' CD1' ' N ' ' A' ' 188' ' ' GLN . 0.2 OUTLIER -104.78 -30.69 9.73 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.456 -1.403 . . . . 0.0 112.395 -178.881 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 188' ' ' GLN . . . . . 0.596 ' N ' ' CD1' ' A' ' 187' ' ' TYR . 2.9 pm0 -45.59 -22.86 0.18 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.802 -1.186 . . . . 0.0 111.736 -179.13 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 189' ' ' PHE . . . . . 0.618 ' CE2' ' HA ' ' A' ' 186' ' ' GLN . 7.3 m-85 -55.27 -41.51 72.34 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.18 -0.95 . . . . 0.0 111.022 -178.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 190' ' ' TRP . . . . . 0.664 ' HA ' ' CD2' ' A' ' 193' ' ' PHE . 9.6 p-90 -89.19 -24.25 22.2 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 120.833 -1.167 . . . . 0.0 110.217 179.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.568 ' HB3' ' HA ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -73.83 -54.41 8.07 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.46 -0.775 . . . . 0.0 110.719 -178.657 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.542 ' CA ' ' HE2' ' A' ' 191' ' ' LYS . 16.0 p-10 -56.94 -10.45 1.1 Allowed 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.491 -0.756 . . . . 0.0 111.416 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 193' ' ' PHE . . . . . 0.664 ' CD2' ' HA ' ' A' ' 190' ' ' TRP . 0.1 OUTLIER -116.51 -33.85 4.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.237 -1.539 . . . . 0.0 110.855 179.917 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.472 ' HB3' ' O ' ' A' ' 190' ' ' TRP . 1.0 OUTLIER -41.04 -27.35 0.06 Allowed 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.787 -178.988 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 195' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 193' ' ' PHE . 15.8 m . . . . . 0 N--CA 1.489 1.511 0 O-C-N 121.218 -0.926 . . . . 0.0 109.274 178.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.499 0 CA-C-O 120.394 0.14 . . . . 0.0 111.353 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.505 ' CG ' ' N ' ' A' ' 188' ' ' GLN . 6.5 p90 -150.11 -39.52 0.14 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.467 -1.396 . . . . 0.0 112.652 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 188' ' ' GLN . . . . . 0.726 ' NE2' ' CD1' ' A' ' 189' ' ' PHE . 2.3 pm0 -44.84 -20.55 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.826 -1.171 . . . . 0.0 111.657 -178.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 189' ' ' PHE . . . . . 0.726 ' CD1' ' NE2' ' A' ' 188' ' ' GLN . 63.8 m-85 -44.29 -60.93 1.69 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.624 -1.297 . . . . 0.0 110.711 -178.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 190' ' ' TRP . . . . . 0.625 ' CE3' ' N ' ' A' ' 191' ' ' LYS . 17.7 p-90 -91.27 -15.18 29.58 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 121.304 -0.872 . . . . 0.0 111.684 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.629 ' HB3' ' HA ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -66.75 -49.75 64.95 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.746 -1.221 . . . . 0.0 112.209 -176.903 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.567 ' N ' ' CD ' ' A' ' 191' ' ' LYS . 0.2 OUTLIER -49.61 -14.94 0.13 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.785 -1.197 . . . . 0.0 111.84 -178.189 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 193' ' ' PHE . . . . . 0.62 ' CZ ' ' O ' ' A' ' 189' ' ' PHE . 11.6 p90 -144.77 -13.79 0.56 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 119.85 -1.781 . . . . 0.0 113.213 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -42.71 -44.89 4.52 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.869 -1.145 . . . . 0.0 110.521 -178.979 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 195' ' ' THR . . . . . . . . . . . . . 3.4 m . . . . . 0 C--N 1.299 -1.611 0 O-C-N 121.4 -0.812 . . . . 0.0 110.746 -179.613 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 186' ' ' GLN . . . . . 0.561 ' C ' ' CE2' ' A' ' 189' ' ' PHE . 1.9 pt20 . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 187' ' ' TYR . . . . . 0.639 ' CD1' ' N ' ' A' ' 188' ' ' GLN . 2.2 p90 -157.67 -47.87 0.07 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.218 -1.551 . . . . 0.0 112.637 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 188' ' ' GLN . . . . . 0.639 ' N ' ' CD1' ' A' ' 187' ' ' TYR . 0.2 OUTLIER -49.16 -14.71 0.09 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 120.987 -1.071 . . . . 0.0 112.9 -178.416 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 189' ' ' PHE . . . . . 0.612 ' N ' ' NE2' ' A' ' 188' ' ' GLN . 1.0 OUTLIER -62.1 -29.43 70.32 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 120.207 -1.558 . . . . 0.0 109.606 -178.478 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 190' ' ' TRP . . . . . 0.66 ' HA ' ' CD1' ' A' ' 193' ' ' PHE . 10.5 t90 -88.49 -30.9 19.02 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 121.342 -0.849 . . . . 0.0 109.432 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 191' ' ' LYS . . . . . 0.511 ' HB2' ' HA ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -74.07 -54.39 7.93 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.55 -0.86 . . . . 0.0 110.532 -179.079 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -56.94 -10.64 1.14 Allowed 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.598 -0.689 . . . . 0.0 111.618 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 193' ' ' PHE . . . . . 0.66 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.3 OUTLIER -120.93 -23.09 5.98 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.201 -1.562 . . . . 0.0 111.356 -179.425 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 194' ' ' GLN . . . . . 0.648 ' CB ' ' CZ3' ' A' ' 190' ' ' TRP . 14.0 pt20 -40.15 -30.88 0.11 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -179.28 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 195' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 193' ' ' PHE . 31.4 m . . . . . 0 C--N 1.303 -1.451 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' GLN . . . . . 0.401 ' CA ' HE22 ' A' ' 188' ' ' GLN . 10.0 mt-30 . . . . . 0 N--CA 1.499 2.007 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.535 ' CD1' ' C ' ' A' ' 187' ' ' TYR . 1.4 p90 -134.19 -14.89 2.29 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 118.077 -1.449 . . . . 0.0 111.818 179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' GLN . . . . . 0.647 ' NE2' ' CZ ' ' A' ' 189' ' ' PHE . 0.0 OUTLIER -44.85 -21.99 0.07 Allowed 'General case' 0 C--N 1.298 -1.669 0 O-C-N 121.213 -0.929 . . . . 0.0 111.072 178.101 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' PHE . . . . . 0.647 ' CZ ' ' NE2' ' A' ' 188' ' ' GLN . 3.7 m-85 -62.75 -28.59 70.08 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.177 -0.952 . . . . 0.0 109.441 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' TRP . . . . . 0.65 ' CZ3' ' CB ' ' A' ' 194' ' ' GLN . 3.7 t90 -86.67 -33.71 20.0 Favored 'General case' 0 C--N 1.293 -1.875 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.465 ' N ' ' HE3' ' A' ' 191' ' ' LYS . 2.3 mmpt? -68.13 -57.24 6.39 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 122.091 0.948 . . . . 0.0 111.123 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.541 ' ND2' ' O ' ' A' ' 189' ' ' PHE . 0.1 OUTLIER -62.19 -9.76 8.63 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.505 -178.305 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . 0.596 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.1 OUTLIER -110.08 -39.63 4.97 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.188 -1.57 . . . . 0.0 110.531 -179.463 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.65 ' CB ' ' CZ3' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -44.18 -25.4 0.22 Allowed 'General case' 0 C--N 1.287 -2.134 0 C-N-CA 119.766 -0.774 . . . . 0.0 109.994 -178.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' THR . . . . . 0.497 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 3.2 m . . . . . 0 N--CA 1.488 1.475 0 O-C-N 121.219 -0.925 . . . . 0.0 109.9 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' GLN . . . . . 0.547 ' O ' ' CZ ' ' A' ' 189' ' ' PHE . 45.2 mt-30 . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 121.051 0.453 . . . . 0.0 110.476 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.672 ' HA ' ' CZ ' ' A' ' 189' ' ' PHE . 0.1 OUTLIER -142.33 -28.88 0.59 Allowed 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.165 -0.959 . . . . 0.0 111.324 -178.75 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' GLN . . . . . 0.553 ' HA ' ' HB3' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -45.28 -19.19 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.247 -0.908 . . . . 0.0 112.724 -178.57 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' PHE . . . . . 0.672 ' CZ ' ' HA ' ' A' ' 187' ' ' TYR . 1.8 p90 -62.85 -37.46 86.91 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 120.211 -1.556 . . . . 0.0 109.42 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' TRP . . . . . 0.623 ' HA ' ' CD1' ' A' ' 193' ' ' PHE . 7.2 p-90 -88.98 -23.71 22.57 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.15 -0.969 . . . . 0.0 110.337 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.59 ' CD ' ' N ' ' A' ' 192' ' ' ASN . 0.0 OUTLIER -73.53 -46.04 50.06 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.772 -1.205 . . . . 0.0 111.441 -178.321 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.59 ' N ' ' CD ' ' A' ' 191' ' ' LYS . 0.1 OUTLIER -70.26 -5.16 25.66 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 121.154 -0.966 . . . . 0.0 111.615 -178.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . 0.623 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.1 OUTLIER -119.28 -34.56 3.81 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 120.225 -1.547 . . . . 0.0 110.269 -179.674 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.533 ' N ' ' CD1' ' A' ' 193' ' ' PHE . 1.2 pp0? -42.59 -26.48 0.12 Allowed 'General case' 0 C--N 1.292 -1.894 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.619 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' THR . . . . . 0.461 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 38.1 m . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.339 -0.85 . . . . 0.0 109.682 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' GLN . . . . . 0.564 ' C ' ' CE2' ' A' ' 189' ' ' PHE . 11.0 pt20 . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 120.684 0.278 . . . . 0.0 111.269 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.578 ' CG ' ' N ' ' A' ' 188' ' ' GLN . 23.1 p90 -155.74 -44.94 0.08 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.743 -1.223 . . . . 0.0 112.24 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' GLN . . . . . 0.578 ' N ' ' CG ' ' A' ' 187' ' ' TYR . 0.0 OUTLIER -63.44 -13.02 35.95 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.04 -1.038 . . . . 0.0 112.758 -178.303 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' PHE . . . . . 0.564 ' CE2' ' C ' ' A' ' 186' ' ' GLN . 0.2 OUTLIER -55.27 -23.82 24.98 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.282 -1.511 . . . . 0.0 109.238 -179.016 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' TRP . . . . . 0.595 ' O ' ' CE3' ' A' ' 190' ' ' TRP . 8.7 t90 -89.2 -33.49 17.0 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-O 121.934 0.873 . . . . 0.0 108.842 178.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.497 ' HB2' ' HA ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -73.76 -54.83 7.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.565 -0.709 . . . . 0.0 110.875 -178.685 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.543 ' ND2' ' O ' ' A' ' 189' ' ' PHE . 0.0 OUTLIER -52.9 -13.49 0.44 Allowed 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.512 -0.742 . . . . 0.0 111.307 -179.68 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . 0.592 ' CD2' ' O ' ' A' ' 190' ' ' TRP . 0.2 OUTLIER -110.34 -31.97 7.11 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 120.41 -1.432 . . . . 0.0 110.941 -179.346 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.541 ' CB ' ' CZ3' ' A' ' 190' ' ' TRP . 6.1 pt20 -40.77 -26.93 0.05 OUTLIER 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.272 -178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' THR . . . . . 0.463 ' N ' ' O ' ' A' ' 193' ' ' PHE . 10.4 t . . . . . 0 N--CA 1.489 1.514 0 O-C-N 121.021 -1.049 . . . . 0.0 110.014 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' GLN . . . . . 0.568 ' C ' ' CE2' ' A' ' 189' ' ' PHE . 1.6 pt20 . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.746 0.308 . . . . 0.0 110.864 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.602 ' HA ' ' CZ ' ' A' ' 189' ' ' PHE . 0.6 OUTLIER -158.68 -39.0 0.06 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.719 -1.238 . . . . 0.0 112.03 -179.737 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' GLN . . . . . 0.612 ' HA ' ' HB3' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -53.7 -15.3 1.16 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.183 -0.948 . . . . 0.0 112.569 -178.076 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' PHE . . . . . 0.602 ' CZ ' ' HA ' ' A' ' 187' ' ' TYR . 0.5 OUTLIER -56.24 -40.0 73.43 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.309 -1.494 . . . . 0.0 110.514 -178.377 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' TRP . . . . . 0.703 ' HA ' ' CE2' ' A' ' 193' ' ' PHE . 20.7 p-90 -89.72 -21.8 22.51 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 120.706 -1.246 . . . . 0.0 110.648 179.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.612 ' HB3' ' HA ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -78.17 -42.34 31.87 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.238 -0.914 . . . . 0.0 111.554 -177.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.486 ' HB3' ' HE2' ' A' ' 191' ' ' LYS . 0.2 OUTLIER -63.72 -7.65 8.18 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.299 -1.36 . . . . 0.0 110.851 -179.264 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . 0.703 ' CE2' ' HA ' ' A' ' 190' ' ' TRP . 0.8 OUTLIER -131.52 -33.04 1.47 Allowed 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.101 -1.624 . . . . 0.0 111.813 179.58 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.629 ' N ' ' CD1' ' A' ' 193' ' ' PHE . 10.8 mm-40 -43.72 -37.37 2.64 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.522 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' THR . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.484 -0.76 . . . . 0.0 109.519 179.071 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' GLN . . . . . 0.515 ' HA ' ' CZ ' ' A' ' 189' ' ' PHE . 28.7 mt-30 . . . . . 0 N--CA 1.494 1.774 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.604 ' CD1' ' N ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -120.62 -17.84 7.93 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.471 -1.393 . . . . 0.0 111.759 -179.378 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' GLN . . . . . 0.638 ' NE2' ' CZ ' ' A' ' 189' ' ' PHE . 0.0 OUTLIER -53.62 -16.43 1.59 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.925 -1.109 . . . . 0.0 110.882 179.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' PHE . . . . . 0.638 ' CZ ' ' NE2' ' A' ' 188' ' ' GLN . 4.5 m-85 -58.27 -22.56 53.06 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.318 -0.864 . . . . 0.0 109.083 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' TRP . . . . . 0.649 ' HA ' ' CD1' ' A' ' 193' ' ' PHE . 5.2 t90 -86.13 -29.76 23.05 Favored 'General case' 0 C--N 1.293 -1.878 0 CA-C-O 121.559 0.695 . . . . 0.0 109.314 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.504 ' HD2' ' OH ' ' A' ' 187' ' ' TYR . 0.3 OUTLIER -80.93 -56.56 4.03 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.913 -178.503 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.486 ' ND2' ' HA ' ' A' ' 189' ' ' PHE . 0.1 OUTLIER -55.85 -11.75 1.12 Allowed 'General case' 0 C--N 1.294 -1.838 0 O-C-N 121.91 -0.494 . . . . 0.0 111.088 -179.287 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . 0.649 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.4 OUTLIER -110.86 -43.44 3.79 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 117.594 -1.642 . . . . 0.0 110.89 -179.147 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.642 ' HG3' ' CD2' ' A' ' 190' ' ' TRP . 1.8 mm-40 -43.97 -56.82 3.7 Favored 'General case' 0 C--N 1.289 -2.057 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.609 -179.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 C--N 1.302 -1.497 0 C-N-CA 119.631 -0.828 . . . . 0.0 109.106 179.066 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' GLN . . . . . 0.575 ' HB3' ' CE1' ' A' ' 187' ' ' TYR . 5.1 tt0 . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 121.272 0.558 . . . . 0.0 110.447 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.634 ' N ' ' CD1' ' A' ' 187' ' ' TYR . 0.1 OUTLIER -142.06 -37.32 0.4 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.969 -1.082 . . . . 0.0 110.214 -179.785 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' GLN . . . . . 0.526 ' OE1' ' N ' ' A' ' 189' ' ' PHE . 0.0 OUTLIER -45.4 -16.37 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -179.144 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' PHE . . . . . 0.618 ' CZ ' ' HA ' ' A' ' 187' ' ' TYR . 1.2 p90 -65.95 -24.52 66.82 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 120.236 -1.54 . . . . 0.0 108.64 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' TRP . . . . . 0.64 ' HA ' ' CD1' ' A' ' 193' ' ' PHE . 9.2 t90 -87.71 -32.55 19.12 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.565 ' HA ' ' HG2' ' A' ' 194' ' ' GLN . 0.9 OUTLIER -76.79 -54.2 6.94 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.721 0.772 . . . . 0.0 110.826 -178.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.514 ' ND2' ' O ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -56.6 -10.46 0.99 Allowed 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.543 -0.723 . . . . 0.0 111.303 -179.599 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . 0.64 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.5 OUTLIER -113.38 -35.33 5.33 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.29 -1.507 . . . . 0.0 110.524 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.588 ' HB3' ' CZ3' ' A' ' 190' ' ' TRP . 1.1 pp0? -41.63 -25.43 0.05 Allowed 'General case' 0 C--N 1.288 -2.099 0 C-N-CA 120.225 -0.59 . . . . 0.0 110.167 -179.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' THR . . . . . 0.524 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 15.0 t . . . . . 0 N--CA 1.491 1.589 0 O-C-N 121.015 -1.053 . . . . 0.0 109.174 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' GLN . . . . . 0.597 ' HB2' ' CZ ' ' A' ' 187' ' ' TYR . 31.5 mt-30 . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.597 ' CZ ' ' HB2' ' A' ' 186' ' ' GLN . 0.7 OUTLIER -140.0 -45.89 0.43 Allowed 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.323 -1.486 . . . . 0.0 113.44 -178.433 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' GLN . . . . . 0.53 ' HA ' ' CG ' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -43.35 -22.95 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 O-C-N 120.712 -1.242 . . . . 0.0 112.488 -176.571 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' PHE . . . . . 0.534 ' O ' ' ND2' ' A' ' 192' ' ' ASN . 11.7 m-85 -51.11 -38.42 51.76 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 120.252 -1.53 . . . . 0.0 109.832 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' TRP . . . . . 0.624 ' O ' ' CE3' ' A' ' 190' ' ' TRP . 9.1 t90 -88.72 -27.93 20.87 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 121.286 -0.884 . . . . 0.0 109.617 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.574 ' HE2' ' CE3' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -70.66 -55.94 7.58 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.056 -1.027 . . . . 0.0 110.733 -179.139 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.56 ' N ' HD22 ' A' ' 192' ' ' ASN . 0.1 OUTLIER -60.22 -10.75 4.93 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.89 -0.506 . . . . 0.0 112.339 -179.274 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . 0.54 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.1 OUTLIER -106.8 -37.91 6.24 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.053 -1.655 . . . . 0.0 109.939 -179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.604 ' HB3' ' CZ3' ' A' ' 190' ' ' TRP . 1.9 pp0? -42.73 -26.19 0.12 Allowed 'General case' 0 C--N 1.29 -1.994 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.792 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' THR . . . . . 0.492 ' OG1' ' NE2' ' A' ' 194' ' ' GLN . 2.2 m . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.255 -0.903 . . . . 0.0 109.134 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 . . . . . 0 N--CA 1.495 1.825 0 CA-C-O 120.995 0.426 . . . . 0.0 111.317 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.599 ' CG ' ' N ' ' A' ' 188' ' ' GLN . 0.1 OUTLIER -87.17 -49.08 7.53 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.851 -1.155 . . . . 0.0 111.786 -179.049 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' GLN . . . . . 0.599 ' N ' ' CG ' ' A' ' 187' ' ' TYR . 0.0 OUTLIER -66.54 -33.51 75.85 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.844 -1.16 . . . . 0.0 113.459 -177.274 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' PHE . . . . . 0.599 ' CD1' ' HG2' ' A' ' 188' ' ' GLN . 5.5 m-30 -52.12 -36.0 49.8 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.357 -1.464 . . . . 0.0 110.406 -179.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' TRP . . . . . 0.621 ' HA ' ' CD2' ' A' ' 193' ' ' PHE . 8.1 t90 -84.41 -32.9 23.87 Favored 'General case' 0 C--N 1.293 -1.889 0 C-N-CA 119.609 -0.836 . . . . 0.0 109.586 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.586 ' N ' ' HE3' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -77.53 -54.63 6.19 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.809 -178.286 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.566 ' ND2' ' O ' ' A' ' 188' ' ' GLN . 0.1 OUTLIER -56.14 -10.36 0.83 Allowed 'General case' 0 C--N 1.295 -1.781 0 O-C-N 121.592 -0.693 . . . . 0.0 111.362 -179.884 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . 0.621 ' CD2' ' HA ' ' A' ' 190' ' ' TRP . 0.2 OUTLIER -112.96 -39.95 4.1 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.207 -1.558 . . . . 0.0 111.439 -179.448 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.486 ' HG3' ' N ' ' A' ' 195' ' ' THR . 0.0 OUTLIER -42.46 -27.36 0.15 Allowed 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.436 -178.754 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' THR . . . . . 0.486 ' N ' ' HG3' ' A' ' 194' ' ' GLN . 6.2 m . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.052 -1.03 . . . . 0.0 109.811 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' GLN . . . . . 0.618 ' HA ' ' CE2' ' A' ' 189' ' ' PHE . 4.9 tt0 . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.257 0.551 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.596 ' CD1' ' N ' ' A' ' 188' ' ' GLN . 0.2 OUTLIER -104.78 -30.69 9.73 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.456 -1.403 . . . . 0.0 112.395 -178.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' GLN . . . . . 0.596 ' N ' ' CD1' ' A' ' 187' ' ' TYR . 0.0 OUTLIER -45.59 -22.86 0.18 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.802 -1.186 . . . . 0.0 111.736 -179.13 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' PHE . . . . . 0.618 ' CE2' ' HA ' ' A' ' 186' ' ' GLN . 7.3 m-85 -55.27 -41.51 72.34 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.18 -0.95 . . . . 0.0 111.022 -178.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' TRP . . . . . 0.664 ' HA ' ' CD2' ' A' ' 193' ' ' PHE . 9.6 p-90 -89.19 -24.25 22.2 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 120.833 -1.167 . . . . 0.0 110.217 179.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.568 ' HB3' ' HA ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -73.83 -54.41 8.07 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.46 -0.775 . . . . 0.0 110.719 -178.657 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.563 ' ND2' ' O ' ' A' ' 189' ' ' PHE . 0.1 OUTLIER -56.94 -10.45 1.1 Allowed 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.491 -0.756 . . . . 0.0 111.416 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . 0.664 ' CD2' ' HA ' ' A' ' 190' ' ' TRP . 0.1 OUTLIER -116.51 -33.85 4.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.237 -1.539 . . . . 0.0 110.855 179.917 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.472 ' HB3' ' O ' ' A' ' 190' ' ' TRP . 1.0 OUTLIER -41.04 -27.35 0.06 Allowed 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.787 -178.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 193' ' ' PHE . 15.8 m . . . . . 0 N--CA 1.489 1.511 0 O-C-N 121.218 -0.926 . . . . 0.0 109.274 178.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.499 0 CA-C-O 120.394 0.14 . . . . 0.0 111.353 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.505 ' CG ' ' N ' ' A' ' 188' ' ' GLN . 6.5 p90 -150.11 -39.52 0.14 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.467 -1.396 . . . . 0.0 112.652 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' GLN . . . . . 0.629 ' HA ' ' HB3' ' A' ' 191' ' ' LYS . 0.0 OUTLIER -44.84 -20.55 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.826 -1.171 . . . . 0.0 111.657 -178.129 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' PHE . . . . . 0.62 ' O ' ' CZ ' ' A' ' 193' ' ' PHE . 63.8 m-85 -44.29 -60.93 1.69 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.624 -1.297 . . . . 0.0 110.711 -178.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' TRP . . . . . 0.625 ' CE3' ' N ' ' A' ' 191' ' ' LYS . 17.7 p-90 -91.27 -15.18 29.58 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 121.304 -0.872 . . . . 0.0 111.684 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.629 ' HB3' ' HA ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -66.75 -49.75 64.95 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.746 -1.221 . . . . 0.0 112.209 -176.903 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.632 ' ND2' ' CE2' ' A' ' 193' ' ' PHE . 0.0 OUTLIER -49.61 -14.94 0.13 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.785 -1.197 . . . . 0.0 111.84 -178.189 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . 0.632 ' CE2' ' ND2' ' A' ' 192' ' ' ASN . 11.6 p90 -144.77 -13.79 0.56 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 119.85 -1.781 . . . . 0.0 113.213 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.521 ' HB2' ' O ' ' A' ' 190' ' ' TRP . 0.0 OUTLIER -42.71 -44.89 4.52 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.869 -1.145 . . . . 0.0 110.521 -178.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' THR . . . . . . . . . . . . . 3.4 m . . . . . 0 C--N 1.299 -1.611 0 O-C-N 121.4 -0.812 . . . . 0.0 110.746 -179.613 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' GLN . . . . . 0.561 ' C ' ' CE2' ' A' ' 189' ' ' PHE . 1.9 pt20 . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' TYR . . . . . 0.639 ' CD1' ' N ' ' A' ' 188' ' ' GLN . 2.2 p90 -157.67 -47.87 0.07 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.218 -1.551 . . . . 0.0 112.637 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' GLN . . . . . 0.639 ' N ' ' CD1' ' A' ' 187' ' ' TYR . 0.0 OUTLIER -49.16 -14.71 0.09 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 120.987 -1.071 . . . . 0.0 112.9 -178.416 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' PHE . . . . . 0.567 ' CZ ' ' HA ' ' A' ' 187' ' ' TYR . 1.0 OUTLIER -62.1 -29.43 70.32 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 120.207 -1.558 . . . . 0.0 109.606 -178.478 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' TRP . . . . . 0.66 ' HA ' ' CD1' ' A' ' 193' ' ' PHE . 10.5 t90 -88.49 -30.9 19.02 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 121.342 -0.849 . . . . 0.0 109.432 179.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' LYS . . . . . 0.511 ' HB2' ' HA ' ' A' ' 188' ' ' GLN . 0.0 OUTLIER -74.07 -54.39 7.93 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.55 -0.86 . . . . 0.0 110.532 -179.079 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.537 ' ND2' ' O ' ' A' ' 189' ' ' PHE . 0.0 OUTLIER -56.94 -10.64 1.14 Allowed 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.598 -0.689 . . . . 0.0 111.618 -179.399 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . 0.66 ' CD1' ' HA ' ' A' ' 190' ' ' TRP . 0.3 OUTLIER -120.93 -23.09 5.98 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.201 -1.562 . . . . 0.0 111.356 -179.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 194' ' ' GLN . . . . . 0.648 ' CB ' ' CZ3' ' A' ' 190' ' ' TRP . 10.4 pt20 -40.15 -30.88 0.11 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 -179.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 193' ' ' PHE . 31.4 m . . . . . 0 C--N 1.303 -1.451 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.598 . . . . . . . . 1 1 . 1 stop_ save_