data_1vl3_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 1vl3 _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.066 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . 0.402 ' OE2' ' NH2' ' B' ' 9' ' ' ARG 0.274 14.3 mp0 -59.24 -27.6 65.92 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 119.48 3.141 . . . . 0.0 119.48 . . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.8 p -25.72 -64.68 0.06 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 113.42 -1.718 . . . . 0.0 115.187 153.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -56.08 -43.36 77.94 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 123.139 1.447 . . . . 0.0 114.258 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.3 mt -65.42 -47.31 76.67 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 112.567 -2.106 . . . . 0.0 114.25 -179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -78.31 -10.87 59.85 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 112.926 -1.943 . . . . 0.0 115.135 173.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.0 m -73.97 -42.74 60.02 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 114.139 1.162 . . . . 0.0 114.139 155.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -54.24 -51.32 64.89 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 123.0 1.381 . . . . 0.0 111.885 168.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.275 17.3 tppt? 61.99 -69.04 0.06 Allowed 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 111.867 -2.424 . . . . 0.0 114.201 172.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -123.5 40.24 3.77 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.472 1.109 . . . . 0.0 113.323 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 O-C-N 121.362 -0.836 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.131 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' GLU . . . . . . . . . . . . 0.255 20.7 mt-10 -58.88 -38.01 77.84 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 125.974 2.046 . . . . 0.0 115.967 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 16.5 m -25.46 -53.81 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 113.676 -1.602 . . . . 0.0 114.604 159.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.67 -20.98 52.91 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 116.641 2.089 . . . . 0.0 116.641 -178.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 36.9 mt -106.06 -38.0 6.44 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 116.144 1.905 . . . . 0.0 116.144 173.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . 0.386 56.2 m80 -57.31 -29.92 64.32 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.973 166.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 15.7 t -38.7 -23.92 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 158.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -100.28 -6.75 25.47 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -176.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? 13.05 -48.9 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.8 1 N-CA-C 122.904 4.409 . . . . 0.0 122.904 169.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . 0.402 ' NH2' ' OE2' ' A' ' 1' ' ' GLU . 3.4 mpt_? 58.4 -56.66 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 -169.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.335 0 O-C-N 121.949 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' DEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.066 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLU . . . . . 0.402 ' OE2' ' NH2' ' B' ' 9' ' ' ARG 0.274 14.3 mp0 -59.24 -27.6 65.92 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 119.48 3.141 . . . . 0.0 119.48 . . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.8 p -25.72 -64.68 0.06 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 113.42 -1.718 . . . . 0.0 115.187 153.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -56.08 -43.36 77.94 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 123.139 1.447 . . . . 0.0 114.258 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.697 HD13 HMC2 ' B' ' 19' ' ' DEU . 14.3 mt -65.42 -47.31 76.67 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 112.567 -2.106 . . . . 0.0 114.25 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -78.31 -10.87 59.85 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 112.926 -1.943 . . . . 0.0 115.135 173.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.0 m -73.97 -42.74 60.02 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 114.139 1.162 . . . . 0.0 114.139 155.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -54.24 -51.32 64.89 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 123.0 1.381 . . . . 0.0 111.885 168.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.275 17.3 tppt? 61.99 -69.04 0.06 Allowed 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 111.867 -2.424 . . . . 0.0 114.201 172.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -123.5 40.24 3.77 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.472 1.109 . . . . 0.0 113.323 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 O-C-N 121.362 -0.836 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.131 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' GLU . . . . . . . . . . . . 0.255 20.7 mt-10 -58.88 -38.01 77.84 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 125.974 2.046 . . . . 0.0 115.967 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 16.5 m -25.46 -53.81 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 113.676 -1.602 . . . . 0.0 114.604 159.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.67 -20.98 52.91 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 116.641 2.089 . . . . 0.0 116.641 -178.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.619 ' HB3' HMC3 ' B' ' 19' ' ' DEU . 36.9 mt -106.06 -38.0 6.44 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 116.144 1.905 . . . . 0.0 116.144 173.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . 0.386 56.2 m80 -57.31 -29.92 64.32 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.973 166.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 15.7 t -38.7 -23.92 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 158.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -100.28 -6.75 25.47 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -176.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? 13.05 -48.9 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.8 1 N-CA-C 122.904 4.409 . . . . 0.0 122.904 169.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.402 ' NH2' ' OE2' ' A' ' 1' ' ' GLU . 3.4 mpt_? 58.4 -56.66 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 -169.247 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.335 0 O-C-N 121.949 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 19' ' ' DEU . . . . . 0.697 HMC2 HD13 ' A' ' 4' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.066 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . 0.402 ' OE2' ' NH2' ' B' ' 9' ' ' ARG 0.274 14.3 mp0 -59.24 -27.6 65.92 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 119.48 3.141 . . . . 0.0 119.48 . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.8 p -25.72 -64.68 0.06 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 113.42 -1.718 . . . . 0.0 115.187 153.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -56.08 -43.36 77.94 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 123.139 1.447 . . . . 0.0 114.258 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.697 HD13 HMC2 ' B' ' 19' ' ' DEU . 14.3 mt -65.42 -47.31 76.67 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 112.567 -2.106 . . . . 0.0 114.25 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -78.31 -10.87 59.85 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 112.926 -1.943 . . . . 0.0 115.135 173.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.0 m -73.97 -42.74 60.02 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 114.139 1.162 . . . . 0.0 114.139 155.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -54.24 -51.32 64.89 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 123.0 1.381 . . . . 0.0 111.885 168.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.275 17.3 tppt? 61.99 -69.04 0.06 Allowed 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 111.867 -2.424 . . . . 0.0 114.201 172.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -123.5 40.24 3.77 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.472 1.109 . . . . 0.0 113.323 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 O-C-N 121.362 -0.836 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.131 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' GLU . . . . . . . . . . . . 0.255 20.7 mt-10 -58.88 -38.01 77.84 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 125.974 2.046 . . . . 0.0 115.967 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 16.5 m -25.46 -53.81 0.05 OUTLIER 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 113.676 -1.602 . . . . 0.0 114.604 159.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.67 -20.98 52.91 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 116.641 2.089 . . . . 0.0 116.641 -178.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.619 ' HB3' HMC3 ' B' ' 19' ' ' DEU . 36.9 mt -106.06 -38.0 6.44 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 116.144 1.905 . . . . 0.0 116.144 173.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . 0.386 56.2 m80 -57.31 -29.92 64.32 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.973 166.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 15.7 t -38.7 -23.92 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 158.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -100.28 -6.75 25.47 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -176.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 7.3 tppt? 13.05 -48.9 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.8 1 N-CA-C 122.904 4.409 . . . . 0.0 122.904 169.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.402 ' NH2' ' OE2' ' A' ' 1' ' ' GLU . 3.4 mpt_? 58.4 -56.66 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.62 1.711 . . . . 0.0 115.62 -169.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.335 0 O-C-N 121.949 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' DEU . . . . . 0.697 HMC2 HD13 ' A' ' 4' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_