data_1nbk_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 1nbk _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 ' 1' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.248 0 C5'-C4'-C3' 110.631 -3.246 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.436 1.865 0 C5'-C4'-C3' 110.541 -3.306 . 0.011 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.498 ' O6 ' ' N4 ' ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.171 0 C5'-C4'-C3' 110.547 -3.302 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.477 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.437 1.956 0 C5'-C4'-C3' 110.667 -3.222 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ' G' . . . . . 0.587 " O2'" " O5'" ' A' ' 6' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.43 -1.95 0 C5'-C4'-C3' 110.492 -3.339 . 0.2 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ' C' . . . . . 0.702 ' C5 ' ' HD2' ' A' ' 35' ' ' GND . . . . . . . . 0 P--O5' 1.613 1.958 0 C5'-C4'-C3' 110.316 -3.456 . 0.171 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ' U' . . . . . 0.597 ' C5 ' ' NE ' ' A' ' 35' ' ' GND . . . . . . . . 0 O4'--C4' 1.431 -1.852 0 C5'-C4'-C3' 110.349 -3.434 OUTLIER-DELTA 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.494 -2.862 0 C5'-C4'-C3' 110.269 -3.487 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ' G' . . . . . 0.666 ' N7 ' ' NH2' ' A' ' 35' ' ' GND . . . . . . . . 0 O4'--C1' 1.437 1.883 0 C5'-C4'-C3' 110.395 -3.403 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ' A' . . . . . 0.464 ' N7 ' ' O2 ' ' A' ' 7' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.073 0 C5'-C4'-C3' 111.304 -2.797 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ' U' . . . . . 0.845 " H2'" " O4'" ' A' ' 12' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.019 0 C5'-C4'-C3' 110.682 -3.212 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ' C' . . . . . 0.845 " O4'" " H2'" ' A' ' 11' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.758 0 C5'-C4'-C3' 110.674 -3.217 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ' C' . . . . . 0.754 ' C4 ' ' C4 ' ' A' ' 12' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.081 0 C5'-C4'-C3' 110.841 -3.106 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.696 ' N4 ' ' N4 ' ' A' ' 13' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.428 -2.07 0 C1'-O4'-C4' 106.754 -3.162 . 0.239 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ' G' . . . . . 0.729 " H4'" ' OP1' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.148 0 C5'-C4'-C3' 111.199 -2.867 OUTLIER-EPSILON 0.354 1c . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.729 ' OP1' " H4'" ' A' ' 15' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.339 0 C5'-C4'-C3' 110.87 -3.086 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.712 ' N7 ' ' C5 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.613 1.965 0 C5'-C4'-C3' 110.741 -3.173 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.712 ' C5 ' ' N7 ' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.913 1 O4'-C1'-N19 112.303 4.103 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ' A' . . . . . 0.856 " O5'" ' H8 ' ' A' ' 19' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.121 0 C5'-C4'-C3' 110.684 -3.211 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ' C' . . . . . 0.854 " O2'" " H5'" ' A' ' 21' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.011 0 C5'-C4'-C3' 110.768 -3.155 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ' G' . . . . . 0.854 " H5'" " O2'" ' A' ' 20' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.43 -1.899 0 C5'-C4'-C3' 110.608 -3.262 . 0.116 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ' G' . . . . . 0.63 ' N7 ' ' CD ' ' A' ' 36' ' ' GND . . . . . . . . 0 O4'--C1' 1.439 2.061 0 C5'-C4'-C3' 110.412 -3.392 . 0.145 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ' U' . . . . . 0.562 ' C6 ' ' NH1' ' A' ' 36' ' ' GND . . . . . . . . 0 O4'--C4' 1.432 -1.791 0 C1'-O4'-C4' 106.441 -3.51 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.431 -1.864 0 C1'-O4'-C4' 106.194 -3.784 OUTLIER-DELTA 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.517 ' N7 ' ' NH2' ' A' ' 36' ' ' GND . . . . . . . . 0 O4'--C1' 1.437 1.894 0 C5'-C4'-C3' 110.616 -3.256 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ' A' . . . . . 0.994 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.08 0 C5'-C4'-C3' 111.031 -2.979 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.994 " H5'" " O2'" ' A' ' 26' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.89 0 C5'-C4'-C3' 110.651 -3.233 . 0.239 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ' C' . . . . . 0.676 ' C4 ' ' N7 ' ' A' ' 29' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.17 0 C5'-C4'-C3' 110.866 -3.089 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ' G' . . . . . 0.676 ' N7 ' ' C4 ' ' A' ' 28' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.983 0 C5'-C4'-C3' 110.664 -3.224 . 0.032 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.61 ' C4 ' ' C6 ' ' A' ' 29' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.038 0 C5'-C4'-C3' 110.793 -3.138 . 0.036 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.577 " O2'" " O5'" ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.43 -1.922 0 C5'-C4'-C3' 110.633 -3.245 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.577 " O5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.131 0 C5'-C4'-C3' 110.675 -3.217 . 0.086 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.437 1.926 0 C5'-C4'-C3' 110.688 -3.208 . 0.263 1c . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -2.017 0 C5'-C4'-C3' 110.607 -3.262 . 0.111 1m . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GND . . . . . 0.702 ' HD2' ' C5 ' ' A' ' 6' ' ' ' C' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GND . . . . . 0.63 ' CD ' ' N7 ' ' A' ' 22' ' ' ' G' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.248 0 C5'-C4'-C3' 110.631 -3.246 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.436 1.865 0 C5'-C4'-C3' 110.541 -3.306 . 0.011 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.498 ' O6 ' ' N4 ' ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.171 0 C5'-C4'-C3' 110.547 -3.302 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.476 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.437 1.956 0 C5'-C4'-C3' 110.667 -3.222 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ' G' . . . . . 0.56 " O2'" " O5'" ' A' ' 6' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.43 -1.95 0 C5'-C4'-C3' 110.492 -3.339 . 0.2 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ' C' . . . . . 0.741 ' C5 ' ' HD2' ' A' ' 35' ' ' GND . . . . . . . . 0 P--O5' 1.613 1.958 0 C5'-C4'-C3' 110.316 -3.456 . 0.171 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ' U' . . . . . 0.615 ' C4 ' ' HG2' ' A' ' 35' ' ' GND . . . . . . . . 0 O4'--C4' 1.431 -1.852 0 C5'-C4'-C3' 110.349 -3.434 OUTLIER-DELTA 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.494 -2.862 0 C5'-C4'-C3' 110.269 -3.487 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ' G' . . . . . 0.666 ' N7 ' ' NH2' ' A' ' 35' ' ' GND . . . . . . . . 0 O4'--C1' 1.437 1.883 0 C5'-C4'-C3' 110.395 -3.403 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ' A' . . . . . 0.464 ' N7 ' ' O2 ' ' A' ' 7' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.073 0 C5'-C4'-C3' 111.304 -2.797 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ' U' . . . . . 0.892 " H2'" " O4'" ' A' ' 12' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.019 0 C5'-C4'-C3' 110.682 -3.212 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ' C' . . . . . 0.892 " O4'" " H2'" ' A' ' 11' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.758 0 C5'-C4'-C3' 110.674 -3.217 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ' C' . . . . . 0.754 ' C4 ' ' C4 ' ' A' ' 12' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.081 0 C5'-C4'-C3' 110.841 -3.106 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.696 ' N4 ' ' N4 ' ' A' ' 13' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.428 -2.07 0 C1'-O4'-C4' 106.754 -3.162 . 0.239 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ' G' . . . . . 0.696 " H4'" ' OP1' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.148 0 C5'-C4'-C3' 111.199 -2.867 OUTLIER-EPSILON 0.354 1c . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.696 ' OP1' " H4'" ' A' ' 15' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.339 0 C5'-C4'-C3' 110.87 -3.086 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.712 ' N7 ' ' C5 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.613 1.965 0 C5'-C4'-C3' 110.741 -3.173 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.712 ' C5 ' ' N7 ' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.913 1 O4'-C1'-N19 112.303 4.103 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ' A' . . . . . 0.846 " O5'" ' H8 ' ' A' ' 19' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.121 0 C5'-C4'-C3' 110.684 -3.211 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ' C' . . . . . 0.842 " O2'" " H5'" ' A' ' 21' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.011 0 C5'-C4'-C3' 110.768 -3.155 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ' G' . . . . . 0.842 " H5'" " O2'" ' A' ' 20' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.43 -1.899 0 C5'-C4'-C3' 110.608 -3.262 . 0.116 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ' G' . . . . . 0.63 ' N7 ' ' CD ' ' A' ' 36' ' ' GND . . . . . . . . 0 O4'--C1' 1.439 2.061 0 C5'-C4'-C3' 110.412 -3.392 . 0.145 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ' U' . . . . . 0.519 ' C6 ' ' NH1' ' A' ' 36' ' ' GND . . . . . . . . 0 O4'--C4' 1.432 -1.791 0 C1'-O4'-C4' 106.441 -3.51 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.431 -1.864 0 C1'-O4'-C4' 106.194 -3.784 OUTLIER-DELTA 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.517 ' N7 ' ' NH2' ' A' ' 36' ' ' GND . . . . . . . . 0 O4'--C1' 1.437 1.894 0 C5'-C4'-C3' 110.616 -3.256 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ' A' . . . . . 0.989 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.08 0 C5'-C4'-C3' 111.031 -2.979 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.989 " H5'" " O2'" ' A' ' 26' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.89 0 C5'-C4'-C3' 110.651 -3.233 . 0.239 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ' C' . . . . . 0.676 ' C4 ' ' N7 ' ' A' ' 29' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.17 0 C5'-C4'-C3' 110.866 -3.089 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ' G' . . . . . 0.676 ' N7 ' ' C4 ' ' A' ' 28' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.983 0 C5'-C4'-C3' 110.664 -3.224 . 0.032 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.61 ' C4 ' ' C6 ' ' A' ' 29' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.038 0 C5'-C4'-C3' 110.793 -3.138 . 0.036 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.577 " O2'" " O5'" ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.43 -1.922 0 C5'-C4'-C3' 110.633 -3.245 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.577 " O5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.131 0 C5'-C4'-C3' 110.675 -3.217 . 0.086 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.437 1.926 0 C5'-C4'-C3' 110.688 -3.208 . 0.263 1c . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -2.017 0 C5'-C4'-C3' 110.607 -3.262 . 0.111 1m . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GND . . . . . 0.741 ' HD2' ' C5 ' ' A' ' 6' ' ' ' C' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GND . . . . . 0.63 ' CD ' ' N7 ' ' A' ' 22' ' ' ' G' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.426 -2.248 0 C5'-C4'-C3' 110.631 -3.246 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.436 1.865 0 C5'-C4'-C3' 110.541 -3.306 . 0.011 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.498 ' O6 ' ' N4 ' ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.427 -2.171 0 C5'-C4'-C3' 110.547 -3.302 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.476 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.437 1.956 0 C5'-C4'-C3' 110.667 -3.222 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ' G' . . . . . 0.56 " O2'" " O5'" ' A' ' 6' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.43 -1.95 0 C5'-C4'-C3' 110.492 -3.339 . 0.2 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ' C' . . . . . 0.741 ' C5 ' ' HD2' ' A' ' 35' ' ' GND . . . . . . . . 0 P--O5' 1.613 1.958 0 C5'-C4'-C3' 110.316 -3.456 . 0.171 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ' U' . . . . . 0.615 ' C4 ' ' HG2' ' A' ' 35' ' ' GND . . . . . . . . 0 O4'--C4' 1.431 -1.852 0 C5'-C4'-C3' 110.349 -3.434 OUTLIER-DELTA 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ' U' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.494 -2.862 0 C5'-C4'-C3' 110.269 -3.487 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ' G' . . . . . 0.666 ' N7 ' ' NH2' ' A' ' 35' ' ' GND . . . . . . . . 0 O4'--C1' 1.437 1.883 0 C5'-C4'-C3' 110.395 -3.403 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ' A' . . . . . 0.464 ' N7 ' ' O2 ' ' A' ' 7' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.073 0 C5'-C4'-C3' 111.304 -2.797 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ' U' . . . . . 0.892 " H2'" " O4'" ' A' ' 12' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.019 0 C5'-C4'-C3' 110.682 -3.212 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ' C' . . . . . 0.892 " O4'" " H2'" ' A' ' 11' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.758 0 C5'-C4'-C3' 110.674 -3.217 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ' C' . . . . . 0.754 ' C4 ' ' C4 ' ' A' ' 12' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.081 0 C5'-C4'-C3' 110.841 -3.106 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.696 ' N4 ' ' N4 ' ' A' ' 13' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.428 -2.07 0 C1'-O4'-C4' 106.754 -3.162 . 0.239 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ' G' . . . . . 0.696 " H4'" ' OP1' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.148 0 C5'-C4'-C3' 111.199 -2.867 OUTLIER-EPSILON 0.354 1c . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.696 ' OP1' " H4'" ' A' ' 15' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.339 0 C5'-C4'-C3' 110.87 -3.086 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.712 ' N7 ' ' C5 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.613 1.965 0 C5'-C4'-C3' 110.741 -3.173 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.712 ' C5 ' ' N7 ' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.913 1 O4'-C1'-N19 112.303 4.103 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ' A' . . . . . 0.846 " O5'" ' H8 ' ' A' ' 19' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.121 0 C5'-C4'-C3' 110.684 -3.211 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ' C' . . . . . 0.842 " O2'" " H5'" ' A' ' 21' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.011 0 C5'-C4'-C3' 110.768 -3.155 . 0.0 OUTLIER zeta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ' G' . . . . . 0.842 " H5'" " O2'" ' A' ' 20' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.43 -1.899 0 C5'-C4'-C3' 110.608 -3.262 . 0.116 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ' G' . . . . . 0.63 ' N7 ' ' CD ' ' A' ' 36' ' ' GND . . . . . . . . 0 O4'--C1' 1.439 2.061 0 C5'-C4'-C3' 110.412 -3.392 . 0.145 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ' U' . . . . . 0.519 ' C6 ' ' NH1' ' A' ' 36' ' ' GND . . . . . . . . 0 O4'--C4' 1.432 -1.791 0 C1'-O4'-C4' 106.441 -3.51 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.431 -1.864 0 C1'-O4'-C4' 106.194 -3.784 OUTLIER-DELTA 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.517 ' N7 ' ' NH2' ' A' ' 36' ' ' GND . . . . . . . . 0 O4'--C1' 1.437 1.894 0 C5'-C4'-C3' 110.616 -3.256 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ' A' . . . . . 0.989 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.08 0 C5'-C4'-C3' 111.031 -2.979 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.989 " H5'" " O2'" ' A' ' 26' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.89 0 C5'-C4'-C3' 110.651 -3.233 . 0.239 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ' C' . . . . . 0.676 ' C4 ' ' N7 ' ' A' ' 29' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.17 0 C5'-C4'-C3' 110.866 -3.089 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ' G' . . . . . 0.676 ' N7 ' ' C4 ' ' A' ' 28' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.983 0 C5'-C4'-C3' 110.664 -3.224 . 0.032 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.61 ' C4 ' ' C6 ' ' A' ' 29' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -2.038 0 C5'-C4'-C3' 110.793 -3.138 . 0.036 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.577 " O2'" " O5'" ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.43 -1.922 0 C5'-C4'-C3' 110.633 -3.245 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.577 " O5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.131 0 C5'-C4'-C3' 110.675 -3.217 . 0.086 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.437 1.926 0 C5'-C4'-C3' 110.688 -3.208 . 0.263 1c . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.429 -2.017 0 C5'-C4'-C3' 110.607 -3.262 . 0.111 1m . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GND . . . . . 0.741 ' HD2' ' C5 ' ' A' ' 6' ' ' ' C' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GND . . . . . 0.63 ' CD ' ' N7 ' ' A' ' 22' ' ' ' G' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_