data_8BNA
# 
_entry.id   8BNA 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.279 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
PDB   8BNA         
RCSB  GDL006       
WWPDB D_1000179962 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.entry_id                        8BNA 
_pdbx_database_status.recvd_initial_deposition_date   1986-08-29 
_pdbx_database_status.deposit_site                    BNL 
_pdbx_database_status.process_site                    BNL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.SG_entry                        ? 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
'Pjura, P.E.'     1 
'Grzeskowiak, K.' 2 
'Dickerson, R.E.' 3 
# 
loop_
_citation.id 
_citation.title 
_citation.journal_abbrev 
_citation.journal_volume 
_citation.page_first 
_citation.page_last 
_citation.year 
_citation.journal_id_ASTM 
_citation.country 
_citation.journal_id_ISSN 
_citation.journal_id_CSD 
_citation.book_publisher 
_citation.pdbx_database_id_PubMed 
_citation.pdbx_database_id_DOI 
primary 'Binding of Hoechst 33258 to the minor groove of B-DNA.'                       J.Mol.Biol.            197 257  271  1987 
JMOBAK UK 0022-2836 0070 ? 2445998 '10.1016/0022-2836(87)90123-9' 
1       'Isohelical Analysis of DNA Groove-Binding Drugs'                              J.Med.Chem.            29  727  733  1986 
JMCMAR US 0022-2623 0151 ? ?       ?                              
2       'Binding of an Antitumor Drug to DNA. Netropsin and C-G-C-G-A-A-T-T-BrC-G-C-G' J.Mol.Biol.            183 553  563  1985 
JMOBAK UK 0022-2836 0070 ? ?       ?                              
3       'Drugs and Minor Groove Binding in B-DNA Netropsin and Hoechst 33258'          'To be Published'      ?   ?    ?    ?    ? 
?  ?         0353 ? ?       ?                              
4       'The Molecular Origin of DNA-Drug Specificity in Netropsin and Distamycin'     Proc.Natl.Acad.Sci.USA 82  1376 1380 1985 
PNASA6 US 0027-8424 0040 ? ?       ?                              
5       'Crystal Structure Analysis of a Complete Turn of B-DNA'                       Nature                 287 755  758  1980 
NATUAS UK 0028-0836 0006 ? ?       ?                              
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
primary 'Pjura, P.E.'     1  
primary 'Grzeskowiak, K.' 2  
primary 'Dickerson, R.E.' 3  
1       'Goodsell, D.'    4  
1       'Dickerson, R.E.' 5  
2       'Kopka, M.L.'     6  
2       'Yoon, C.'        7  
2       'Goodsell, D.S.'  8  
2       'Pjura, P.'       9  
2       'Dickerson, R.E.' 10 
3       'Kopka, M.L.'     11 
3       'Pjura, P.E.'     12 
3       'Goodsell, D.S.'  13 
3       'Dickerson, R.E.' 14 
4       'Kopka, M.L.'     15 
4       'Yoon, C.'        16 
4       'Goodsell, D.S.'  17 
4       'Pjura, P.'       18 
4       'Dickerson, R.E.' 19 
5       'Wing, R.'        20 
5       'Drew, H.R.'      21 
5       'Takano, T.'      22 
5       'Broka, C.'       23 
5       'Tanaka, S.'      24 
5       'Itakura, K.'     25 
5       'Dickerson, R.E.' 26 
# 
_cell.entry_id           8BNA 
_cell.length_a           25.040 
_cell.length_b           40.330 
_cell.length_c           65.850 
_cell.angle_alpha        90.00 
_cell.angle_beta         90.00 
_cell.angle_gamma        90.00 
_cell.Z_PDB              8 
_cell.pdbx_unique_axis   ? 
_cell.length_a_esd       ? 
_cell.length_b_esd       ? 
_cell.length_c_esd       ? 
_cell.angle_alpha_esd    ? 
_cell.angle_beta_esd     ? 
_cell.angle_gamma_esd    ? 
# 
_symmetry.entry_id                         8BNA 
_symmetry.space_group_name_H-M             'P 21 21 21' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                19 
_symmetry.space_group_name_Hall            ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer     syn 
;DNA (5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*CP*GP*CP*G)-3')
;
3663.392 2   ? ? ? ? 
2 non-polymer syn "2'-(4-HYDROXYPHENYL)-5-(4-METHYL-1-PIPERAZINYL)-2,5'-BI-BENZIMIDAZOLE" 424.498  1   ? ? ? ? 
3 non-polymer syn 'MAGNESIUM ION'                                                         24.305   1   ? ? ? ? 
4 water       nat water                                                                   18.015   174 ? ? ? ? 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           polydeoxyribonucleotide 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   no 
_entity_poly.pdbx_seq_one_letter_code       '(DC)(DG)(DC)(DG)(DA)(DA)(DT)(DT)(DC)(DG)(DC)(DG)' 
_entity_poly.pdbx_seq_one_letter_code_can   CGCGAATTCGCG 
_entity_poly.pdbx_strand_id                 A,B 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1  DC n 
1 2  DG n 
1 3  DC n 
1 4  DG n 
1 5  DA n 
1 6  DA n 
1 7  DT n 
1 8  DT n 
1 9  DC n 
1 10 DG n 
1 11 DC n 
1 12 DG n 
# 
_struct_ref.id                         1 
_struct_ref.entity_id                  1 
_struct_ref.db_name                    PDB 
_struct_ref.db_code                    8BNA 
_struct_ref.pdbx_db_accession          8BNA 
_struct_ref.pdbx_align_begin           ? 
_struct_ref.pdbx_seq_one_letter_code   ? 
_struct_ref.pdbx_db_isoform            ? 
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 8BNA A 1 ? 12 ? 8BNA 1  ? 12 ? 1  12 
2 1 8BNA B 1 ? 12 ? 8BNA 13 ? 24 ? 13 24 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
DA  'DNA linking' y "2'-DEOXYADENOSINE-5'-MONOPHOSPHATE"                                    ?               'C10 H14 N5 O6 P' 
331.222 
DC  'DNA linking' y "2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE"                                     ?               'C9 H14 N3 O7 P'  
307.197 
DG  'DNA linking' y "2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE"                                    ?               'C10 H14 N5 O7 P' 
347.221 
DT  'DNA linking' y "THYMIDINE-5'-MONOPHOSPHATE"                                            ?               'C10 H15 N2 O8 P' 
322.208 
HOH non-polymer   . WATER                                                                   ?               'H2 O'            
18.015  
HT  non-polymer   . "2'-(4-HYDROXYPHENYL)-5-(4-METHYL-1-PIPERAZINYL)-2,5'-BI-BENZIMIDAZOLE" 'HOECHST 33258' 'C25 H24 N6 O'    
424.498 
MG  non-polymer   . 'MAGNESIUM ION'                                                         ?               'Mg 2'            
24.305  
# 
_exptl.entry_id          8BNA 
_exptl.method            'X-RAY DIFFRACTION' 
_exptl.crystals_number   ? 
# 
_exptl_crystal.id                    1 
_exptl_crystal.density_meas          ? 
_exptl_crystal.density_percent_sol   45.79 
_exptl_crystal.density_Matthews      2.27 
_exptl_crystal.description           ? 
_exptl_crystal.F_000                 ? 
_exptl_crystal.preparation           ? 
# 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.method          'VAPOR DIFFUSION' 
_exptl_crystal_grow.temp            277.00 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pdbx_details    'VAPOR DIFFUSION, temperature 277.00K' 
_exptl_crystal_grow.pdbx_pH_range   ? 
# 
loop_
_exptl_crystal_grow_comp.crystal_id 
_exptl_crystal_grow_comp.id 
_exptl_crystal_grow_comp.sol_id 
_exptl_crystal_grow_comp.name 
_exptl_crystal_grow_comp.volume 
_exptl_crystal_grow_comp.conc 
_exptl_crystal_grow_comp.details 
1 1 1 WATER              ? ? ? 
1 2 1 MPD                ? ? ? 
1 3 1 'MG ACETATE'       ? ? ? 
1 4 1 'SPERMINE ACETATE' ? ? ? 
1 5 2 WATER              ? ? ? 
1 6 2 MPD                ? ? ? 
# 
_diffrn.id                     1 
_diffrn.crystal_id             1 
_diffrn.ambient_temp           ? 
_diffrn.ambient_temp_details   ? 
# 
_diffrn_detector.diffrn_id              1 
_diffrn_detector.detector               DIFFRACTOMETER 
_diffrn_detector.type                   'SYNTEX P1' 
_diffrn_detector.pdbx_collection_date   ? 
_diffrn_detector.details                ? 
# 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_scattering_type             x-ray 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   ? 
_diffrn_radiation.pdbx_diffrn_protocol             ? 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   . 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.diffrn_id                   1 
_diffrn_source.source                      ? 
_diffrn_source.type                        ? 
_diffrn_source.pdbx_synchrotron_site       ? 
_diffrn_source.pdbx_synchrotron_beamline   ? 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_wavelength_list        ? 
# 
_reflns.entry_id                     8BNA 
_reflns.observed_criterion_sigma_I   2.000 
_reflns.observed_criterion_sigma_F   ? 
_reflns.d_resolution_low             ? 
_reflns.d_resolution_high            2.200 
_reflns.number_obs                   3487 
_reflns.number_all                   ? 
_reflns.percent_possible_obs         ? 
_reflns.pdbx_Rmerge_I_obs            ? 
_reflns.pdbx_Rsym_value              ? 
_reflns.pdbx_netI_over_sigmaI        ? 
_reflns.B_iso_Wilson_estimate        ? 
_reflns.pdbx_redundancy              ? 
_reflns.pdbx_ordinal                 1 
_reflns.pdbx_diffrn_id               1 
_reflns.R_free_details               ? 
_reflns.pdbx_chi_squared             ? 
_reflns.pdbx_scaling_rejects         ? 
# 
_refine.entry_id                                 8BNA 
_refine.ls_number_reflns_obs                     3594 
_refine.ls_number_reflns_all                     ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          0.000 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.ls_d_res_low                             8.000 
_refine.ls_d_res_high                            2.200 
_refine.ls_percent_reflns_obs                    ? 
_refine.ls_R_factor_obs                          0.1910000 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_R_work                       ? 
_refine.ls_R_factor_R_free                       ? 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_percent_reflns_R_free                 ? 
_refine.ls_number_reflns_R_free                  ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_restraints                     ? 
_refine.occupancy_min                            ? 
_refine.occupancy_max                            ? 
_refine.B_iso_mean                               ? 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.solvent_model_details                    ? 
_refine.solvent_model_param_ksol                 ? 
_refine.solvent_model_param_bsol                 ? 
_refine.pdbx_ls_cross_valid_method               ? 
_refine.details                                  ? 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_method_to_determine_struct          ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.overall_SU_ML                            ? 
_refine.overall_SU_B                             ? 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.pdbx_diffrn_id                           1 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.pdbx_solvent_vdw_probe_radii             ? 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             ? 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.pdbx_number_atoms_protein        0 
_refine_hist.pdbx_number_atoms_nucleic_acid   486 
_refine_hist.pdbx_number_atoms_ligand         33 
_refine_hist.number_atoms_solvent             174 
_refine_hist.number_atoms_total               693 
_refine_hist.d_res_high                       2.200 
_refine_hist.d_res_low                        8.000 
# 
_struct.entry_id                  8BNA 
_struct.title                     'BINDING OF HOECHST 33258 TO THE MINOR GROOVE OF B-DNA' 
_struct.pdbx_descriptor           
;5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*CP*GP*CP*G)-3', HOECHST 33258
;
_struct.pdbx_model_details        ? 
_struct.pdbx_CASP_flag            ? 
_struct.pdbx_model_type_details   ? 
# 
_struct_keywords.entry_id        8BNA 
_struct_keywords.pdbx_keywords   DNA 
_struct_keywords.text            'B-DNA, DOUBLE HELIX, COMPLEXED WITH DRUG, DNA' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 1 ? 
C N N 2 ? 
D N N 3 ? 
E N N 4 ? 
F N N 4 ? 
# 
_struct_biol.id        1 
_struct_biol.details   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
metalc1  metalc ? ? D MG .  MG ? ? ? 1_555 E HOH .  O  ? ? A MG 27 A HOH 187 1_555 ? ? ? ? ? ? ?            2.074 ? 
hydrog1  hydrog ? ? A DC 1  N3 ? ? ? 1_555 B DG  12 N1 ? ? A DC 1  B DG  24  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog2  hydrog ? ? A DC 1  N4 ? ? ? 1_555 B DG  12 O6 ? ? A DC 1  B DG  24  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog3  hydrog ? ? A DC 1  O2 ? ? ? 1_555 B DG  12 N2 ? ? A DC 1  B DG  24  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog4  hydrog ? ? A DG 2  N1 ? ? ? 1_555 B DC  11 N3 ? ? A DG 2  B DC  23  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog5  hydrog ? ? A DG 2  N2 ? ? ? 1_555 B DC  11 O2 ? ? A DG 2  B DC  23  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog6  hydrog ? ? A DG 2  O6 ? ? ? 1_555 B DC  11 N4 ? ? A DG 2  B DC  23  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog7  hydrog ? ? A DC 3  N3 ? ? ? 1_555 B DG  10 N1 ? ? A DC 3  B DG  22  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog8  hydrog ? ? A DC 3  N4 ? ? ? 1_555 B DG  10 O6 ? ? A DC 3  B DG  22  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog9  hydrog ? ? A DC 3  O2 ? ? ? 1_555 B DG  10 N2 ? ? A DC 3  B DG  22  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog10 hydrog ? ? A DG 4  N1 ? ? ? 1_555 B DC  9  N3 ? ? A DG 4  B DC  21  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog11 hydrog ? ? A DG 4  N2 ? ? ? 1_555 B DC  9  O2 ? ? A DG 4  B DC  21  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog12 hydrog ? ? A DG 4  O6 ? ? ? 1_555 B DC  9  N4 ? ? A DG 4  B DC  21  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog13 hydrog ? ? A DA 5  N1 ? ? ? 1_555 B DT  8  N3 ? ? A DA 5  B DT  20  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog14 hydrog ? ? A DA 5  N6 ? ? ? 1_555 B DT  8  O4 ? ? A DA 5  B DT  20  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog15 hydrog ? ? A DA 6  N1 ? ? ? 1_555 B DT  7  N3 ? ? A DA 6  B DT  19  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog16 hydrog ? ? A DA 6  N6 ? ? ? 1_555 B DT  7  O4 ? ? A DA 6  B DT  19  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog17 hydrog ? ? A DT 7  N3 ? ? ? 1_555 B DA  6  N1 ? ? A DT 7  B DA  18  1_555 ? ? ? ? ? ? 'DT-DA PAIR' ?     ? 
hydrog18 hydrog ? ? A DT 8  N3 ? ? ? 1_555 B DA  5  N1 ? ? A DT 8  B DA  17  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog19 hydrog ? ? A DT 8  O4 ? ? ? 1_555 B DA  5  N6 ? ? A DT 8  B DA  17  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog20 hydrog ? ? A DC 9  N3 ? ? ? 1_555 B DG  4  N1 ? ? A DC 9  B DG  16  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog21 hydrog ? ? A DC 9  N4 ? ? ? 1_555 B DG  4  O6 ? ? A DC 9  B DG  16  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog22 hydrog ? ? A DC 9  O2 ? ? ? 1_555 B DG  4  N2 ? ? A DC 9  B DG  16  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog23 hydrog ? ? A DG 10 N1 ? ? ? 1_555 B DC  3  N3 ? ? A DG 10 B DC  15  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog24 hydrog ? ? A DG 10 N2 ? ? ? 1_555 B DC  3  O2 ? ? A DG 10 B DC  15  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog25 hydrog ? ? A DG 10 O6 ? ? ? 1_555 B DC  3  N4 ? ? A DG 10 B DC  15  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog26 hydrog ? ? A DC 11 N3 ? ? ? 1_555 B DG  2  N1 ? ? A DC 11 B DG  14  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog27 hydrog ? ? A DC 11 N4 ? ? ? 1_555 B DG  2  O6 ? ? A DC 11 B DG  14  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog28 hydrog ? ? A DC 11 O2 ? ? ? 1_555 B DG  2  N2 ? ? A DC 11 B DG  14  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog29 hydrog ? ? A DG 12 N1 ? ? ? 1_555 B DC  1  N3 ? ? A DG 12 B DC  13  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog30 hydrog ? ? A DG 12 N2 ? ? ? 1_555 B DC  1  O2 ? ? A DG 12 B DC  13  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
hydrog31 hydrog ? ? A DG 12 O6 ? ? ? 1_555 B DC  1  N4 ? ? A DG 12 B DC  13  1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
metalc ? ? 
hydrog ? ? 
# 
loop_
_struct_site.id 
_struct_site.pdbx_evidence_code 
_struct_site.pdbx_auth_asym_id 
_struct_site.pdbx_auth_comp_id 
_struct_site.pdbx_auth_seq_id 
_struct_site.pdbx_auth_ins_code 
_struct_site.pdbx_num_residues 
_struct_site.details 
AC1 Software ? ? ? ? 21 'BINDING SITE FOR RESIDUE HT A 25' 
AC2 Software ? ? ? ? 2  'BINDING SITE FOR RESIDUE MG A 27' 
1   ?        ? ? ? ? ?  ?                                  
# 
loop_
_struct_site_gen.id 
_struct_site_gen.site_id 
_struct_site_gen.pdbx_num_res 
_struct_site_gen.label_comp_id 
_struct_site_gen.label_asym_id 
_struct_site_gen.label_seq_id 
_struct_site_gen.pdbx_auth_ins_code 
_struct_site_gen.auth_comp_id 
_struct_site_gen.auth_asym_id 
_struct_site_gen.auth_seq_id 
_struct_site_gen.label_atom_id 
_struct_site_gen.label_alt_id 
_struct_site_gen.symmetry 
_struct_site_gen.details 
1  AC1 21 DA  A 6  ? DA  A 6   . ? 1_555 ? 
2  AC1 21 DT  A 7  ? DT  A 7   . ? 1_555 ? 
3  AC1 21 DT  A 8  ? DT  A 8   . ? 1_555 ? 
4  AC1 21 DC  A 9  ? DC  A 9   . ? 1_555 ? 
5  AC1 21 DG  A 10 ? DG  A 10  . ? 1_555 ? 
6  AC1 21 DC  A 11 ? DC  A 11  . ? 1_555 ? 
7  AC1 21 HOH E .  ? HOH A 29  . ? 1_555 ? 
8  AC1 21 HOH E .  ? HOH A 56  . ? 1_555 ? 
9  AC1 21 HOH E .  ? HOH A 66  . ? 1_555 ? 
10 AC1 21 HOH E .  ? HOH A 72  . ? 1_555 ? 
11 AC1 21 HOH E .  ? HOH A 73  . ? 1_555 ? 
12 AC1 21 HOH E .  ? HOH A 107 . ? 1_555 ? 
13 AC1 21 DG  B 4  ? DG  B 16  . ? 1_555 ? 
14 AC1 21 DA  B 5  ? DA  B 17  . ? 1_555 ? 
15 AC1 21 DA  B 6  ? DA  B 18  . ? 1_555 ? 
16 AC1 21 DT  B 7  ? DT  B 19  . ? 1_555 ? 
17 AC1 21 DT  B 8  ? DT  B 20  . ? 1_555 ? 
18 AC1 21 DC  B 9  ? DC  B 21  . ? 1_555 ? 
19 AC1 21 DG  B 12 ? DG  B 24  . ? 2_664 ? 
20 AC1 21 HOH F .  ? HOH B 111 . ? 4_565 ? 
21 AC1 21 HOH F .  ? HOH B 141 . ? 4_465 ? 
22 AC2 2  HOH E .  ? HOH A 58  . ? 1_555 ? 
23 AC2 2  HOH E .  ? HOH A 187 . ? 1_555 ? 
# 
_database_PDB_matrix.entry_id          8BNA 
_database_PDB_matrix.origx[1][1]       1.000000 
_database_PDB_matrix.origx[1][2]       0.000000 
_database_PDB_matrix.origx[1][3]       0.000000 
_database_PDB_matrix.origx[2][1]       0.000000 
_database_PDB_matrix.origx[2][2]       1.000000 
_database_PDB_matrix.origx[2][3]       0.000000 
_database_PDB_matrix.origx[3][1]       0.000000 
_database_PDB_matrix.origx[3][2]       0.000000 
_database_PDB_matrix.origx[3][3]       1.000000 
_database_PDB_matrix.origx_vector[1]   0.00000 
_database_PDB_matrix.origx_vector[2]   0.00000 
_database_PDB_matrix.origx_vector[3]   0.00000 
# 
_atom_sites.entry_id                    8BNA 
_atom_sites.fract_transf_matrix[1][1]   0.039936 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.024795 
_atom_sites.fract_transf_matrix[2][3]   0.000000 
_atom_sites.fract_transf_matrix[3][1]   0.000000 
_atom_sites.fract_transf_matrix[3][2]   0.000000 
_atom_sites.fract_transf_matrix[3][3]   0.015186 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
# 
loop_
_atom_type.symbol 
C  
MG 
N  
O  
P  
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1   O  "O5'" . DC  A 1 1  ? 18.738 33.884 25.909  1.00 7.50  ? 1   DC  A "O5'" 1 
ATOM   2   C  "C5'" . DC  A 1 1  ? 18.965 33.827 24.477  1.00 40.95 ? 1   DC  A "C5'" 1 
ATOM   3   C  "C4'" . DC  A 1 1  ? 20.140 32.912 24.204  1.00 3.53  ? 1   DC  A "C4'" 1 
ATOM   4   O  "O4'" . DC  A 1 1  ? 19.873 31.636 24.814  1.00 22.04 ? 1   DC  A "O4'" 1 
ATOM   5   C  "C3'" . DC  A 1 1  ? 20.484 32.600 22.752  1.00 43.61 ? 1   DC  A "C3'" 1 
ATOM   6   O  "O3'" . DC  A 1 1  ? 21.884 32.271 22.590  1.00 30.06 ? 1   DC  A "O3'" 1 
ATOM   7   C  "C2'" . DC  A 1 1  ? 19.536 31.431 22.495  1.00 22.56 ? 1   DC  A "C2'" 1 
ATOM   8   C  "C1'" . DC  A 1 1  ? 19.689 30.646 23.787  1.00 5.38  ? 1   DC  A "C1'" 1 
ATOM   9   N  N1    . DC  A 1 1  ? 18.461 29.864 24.116  1.00 5.36  ? 1   DC  A N1    1 
ATOM   10  C  C2    . DC  A 1 1  ? 18.578 28.670 24.775  1.00 4.55  ? 1   DC  A C2    1 
ATOM   11  O  O2    . DC  A 1 1  ? 19.704 28.260 25.052  1.00 2.03  ? 1   DC  A O2    1 
ATOM   12  N  N3    . DC  A 1 1  ? 17.482 27.966 25.088  1.00 10.00 ? 1   DC  A N3    1 
ATOM   13  C  C4    . DC  A 1 1  ? 16.268 28.419 24.756  1.00 28.97 ? 1   DC  A C4    1 
ATOM   14  N  N4    . DC  A 1 1  ? 15.158 27.685 25.060  1.00 40.26 ? 1   DC  A N4    1 
ATOM   15  C  C5    . DC  A 1 1  ? 16.108 29.623 24.073  1.00 44.46 ? 1   DC  A C5    1 
ATOM   16  C  C6    . DC  A 1 1  ? 17.247 30.358 23.753  1.00 30.16 ? 1   DC  A C6    1 
ATOM   17  P  P     . DG  A 1 2  ? 22.464 31.583 21.259  1.00 32.77 ? 2   DG  A P     1 
ATOM   18  O  OP1   . DG  A 1 2  ? 23.848 32.082 21.039  1.00 26.05 ? 2   DG  A OP1   1 
ATOM   19  O  OP2   . DG  A 1 2  ? 21.535 31.734 20.115  1.00 38.71 ? 2   DG  A OP2   1 
ATOM   20  O  "O5'" . DG  A 1 2  ? 22.524 30.038 21.669  1.00 43.22 ? 2   DG  A "O5'" 1 
ATOM   21  C  "C5'" . DG  A 1 2  ? 23.671 29.505 22.368  1.00 28.62 ? 2   DG  A "C5'" 1 
ATOM   22  C  "C4'" . DG  A 1 2  ? 23.823 28.047 21.993  1.00 38.73 ? 2   DG  A "C4'" 1 
ATOM   23  O  "O4'" . DG  A 1 2  ? 22.643 27.325 22.393  1.00 15.42 ? 2   DG  A "O4'" 1 
ATOM   24  C  "C3'" . DG  A 1 2  ? 24.015 27.757 20.512  1.00 30.23 ? 2   DG  A "C3'" 1 
ATOM   25  O  "O3'" . DG  A 1 2  ? 24.932 26.686 20.267  1.00 9.44  ? 2   DG  A "O3'" 1 
ATOM   26  C  "C2'" . DG  A 1 2  ? 22.602 27.440 20.051  1.00 10.00 ? 2   DG  A "C2'" 1 
ATOM   27  C  "C1'" . DG  A 1 2  ? 22.079 26.679 21.248  1.00 10.00 ? 2   DG  A "C1'" 1 
ATOM   28  N  N9    . DG  A 1 2  ? 20.613 26.831 21.337  1.00 10.00 ? 2   DG  A N9    1 
ATOM   29  C  C8    . DG  A 1 2  ? 19.834 27.888 20.956  1.00 7.41  ? 2   DG  A C8    1 
ATOM   30  N  N7    . DG  A 1 2  ? 18.526 27.668 21.170  1.00 7.84  ? 2   DG  A N7    1 
ATOM   31  C  C5    . DG  A 1 2  ? 18.488 26.427 21.697  1.00 10.00 ? 2   DG  A C5    1 
ATOM   32  C  C6    . DG  A 1 2  ? 17.363 25.658 22.111  1.00 10.00 ? 2   DG  A C6    1 
ATOM   33  O  O6    . DG  A 1 2  ? 16.175 25.946 22.060  1.00 12.04 ? 2   DG  A O6    1 
ATOM   34  N  N1    . DG  A 1 2  ? 17.742 24.451 22.638  1.00 10.00 ? 2   DG  A N1    1 
ATOM   35  C  C2    . DG  A 1 2  ? 19.017 23.986 22.750  1.00 11.05 ? 2   DG  A C2    1 
ATOM   36  N  N2    . DG  A 1 2  ? 19.188 22.758 23.310  1.00 6.92  ? 2   DG  A N2    1 
ATOM   37  N  N3    . DG  A 1 2  ? 20.069 24.698 22.334  1.00 4.24  ? 2   DG  A N3    1 
ATOM   38  C  C4    . DG  A 1 2  ? 19.731 25.897 21.827  1.00 0.10  ? 2   DG  A C4    1 
ATOM   39  P  P     . DC  A 1 3  ? 25.406 26.377 18.770  1.00 41.71 ? 3   DC  A P     1 
ATOM   40  O  OP1   . DC  A 1 3  ? 26.878 26.501 18.731  1.00 2.69  ? 3   DC  A OP1   1 
ATOM   41  O  OP2   . DC  A 1 3  ? 24.632 27.196 17.806  1.00 23.05 ? 3   DC  A OP2   1 
ATOM   42  O  "O5'" . DC  A 1 3  ? 24.997 24.844 18.572  1.00 40.54 ? 3   DC  A "O5'" 1 
ATOM   43  C  "C5'" . DC  A 1 3  ? 25.170 23.902 19.652  1.00 43.92 ? 3   DC  A "C5'" 1 
ATOM   44  C  "C4'" . DC  A 1 3  ? 23.968 22.995 19.644  1.00 31.33 ? 3   DC  A "C4'" 1 
ATOM   45  O  "O4'" . DC  A 1 3  ? 22.807 23.809 19.766  1.00 40.28 ? 3   DC  A "O4'" 1 
ATOM   46  C  "C3'" . DC  A 1 3  ? 23.705 22.256 18.350  1.00 10.00 ? 3   DC  A "C3'" 1 
ATOM   47  O  "O3'" . DC  A 1 3  ? 24.534 21.107 18.186  1.00 28.90 ? 3   DC  A "O3'" 1 
ATOM   48  C  "C2'" . DC  A 1 3  ? 22.226 21.922 18.456  1.00 4.46  ? 3   DC  A "C2'" 1 
ATOM   49  C  "C1'" . DC  A 1 3  ? 21.705 22.974 19.415  1.00 7.03  ? 3   DC  A "C1'" 1 
ATOM   50  N  N1    . DC  A 1 3  ? 20.611 23.794 18.839  1.00 3.95  ? 3   DC  A N1    1 
ATOM   51  C  C2    . DC  A 1 3  ? 19.342 23.451 19.180  1.00 29.61 ? 3   DC  A C2    1 
ATOM   52  O  O2    . DC  A 1 3  ? 19.188 22.482 19.918  1.00 12.57 ? 3   DC  A O2    1 
ATOM   53  N  N3    . DC  A 1 3  ? 18.312 24.179 18.748  1.00 2.12  ? 3   DC  A N3    1 
ATOM   54  C  C4    . DC  A 1 3  ? 18.515 25.241 17.969  1.00 10.00 ? 3   DC  A C4    1 
ATOM   55  N  N4    . DC  A 1 3  ? 17.456 25.998 17.573  1.00 16.89 ? 3   DC  A N4    1 
ATOM   56  C  C5    . DC  A 1 3  ? 19.795 25.610 17.573  1.00 10.00 ? 3   DC  A C5    1 
ATOM   57  C  C6    . DC  A 1 3  ? 20.871 24.855 18.029  1.00 10.00 ? 3   DC  A C6    1 
ATOM   58  P  P     . DG  A 1 4  ? 24.401 20.193 16.878  1.00 2.64  ? 4   DG  A P     1 
ATOM   59  O  OP1   . DG  A 1 4  ? 25.600 19.336 16.760  1.00 21.46 ? 4   DG  A OP1   1 
ATOM   60  O  OP2   . DG  A 1 4  ? 24.048 20.972 15.672  1.00 3.91  ? 4   DG  A OP2   1 
ATOM   61  O  "O5'" . DG  A 1 4  ? 23.146 19.282 17.214  1.00 31.84 ? 4   DG  A "O5'" 1 
ATOM   62  C  "C5'" . DG  A 1 4  ? 23.274 18.151 18.077  1.00 41.53 ? 4   DG  A "C5'" 1 
ATOM   63  C  "C4'" . DG  A 1 4  ? 21.959 17.466 17.914  1.00 7.52  ? 4   DG  A "C4'" 1 
ATOM   64  O  "O4'" . DG  A 1 4  ? 20.940 18.474 17.834  1.00 43.00 ? 4   DG  A "O4'" 1 
ATOM   65  C  "C3'" . DG  A 1 4  ? 21.789 16.630 16.661  1.00 26.79 ? 4   DG  A "C3'" 1 
ATOM   66  O  "O3'" . DG  A 1 4  ? 20.898 15.547 16.912  1.00 23.54 ? 4   DG  A "O3'" 1 
ATOM   67  C  "C2'" . DG  A 1 4  ? 21.222 17.646 15.673  1.00 10.00 ? 4   DG  A "C2'" 1 
ATOM   68  C  "C1'" . DG  A 1 4  ? 20.229 18.305 16.599  1.00 8.15  ? 4   DG  A "C1'" 1 
ATOM   69  N  N9    . DG  A 1 4  ? 19.757 19.638 16.157  1.00 10.00 ? 4   DG  A N9    1 
ATOM   70  C  C8    . DG  A 1 4  ? 20.369 20.637 15.445  1.00 10.00 ? 4   DG  A C8    1 
ATOM   71  N  N7    . DG  A 1 4  ? 19.575 21.717 15.288  1.00 3.85  ? 4   DG  A N7    1 
ATOM   72  C  C5    . DG  A 1 4  ? 18.434 21.371 15.925  1.00 27.11 ? 4   DG  A C5    1 
ATOM   73  C  C6    . DG  A 1 4  ? 17.211 22.095 16.096  1.00 41.70 ? 4   DG  A C6    1 
ATOM   74  O  O6    . DG  A 1 4  ? 16.920 23.222 15.701  1.00 39.98 ? 4   DG  A O6    1 
ATOM   75  N  N1    . DG  A 1 4  ? 16.273 21.350 16.781  1.00 39.37 ? 4   DG  A N1    1 
ATOM   76  C  C2    . DG  A 1 4  ? 16.433 20.085 17.276  1.00 12.02 ? 4   DG  A C2    1 
ATOM   77  N  N2    . DG  A 1 4  ? 15.388 19.506 17.936  1.00 10.00 ? 4   DG  A N2    1 
ATOM   78  N  N3    . DG  A 1 4  ? 17.580 19.425 17.136  1.00 32.53 ? 4   DG  A N3    1 
ATOM   79  C  C4    . DG  A 1 4  ? 18.516 20.119 16.455  1.00 7.88  ? 4   DG  A C4    1 
ATOM   80  P  P     . DA  A 1 5  ? 20.684 14.388 15.844  1.00 35.13 ? 5   DA  A P     1 
ATOM   81  O  OP1   . DA  A 1 5  ? 21.443 13.211 16.301  1.00 47.16 ? 5   DA  A OP1   1 
ATOM   82  O  OP2   . DA  A 1 5  ? 21.008 14.837 14.474  1.00 3.07  ? 5   DA  A OP2   1 
ATOM   83  O  "O5'" . DA  A 1 5  ? 19.114 14.095 15.974  1.00 1.68  ? 5   DA  A "O5'" 1 
ATOM   84  C  "C5'" . DA  A 1 5  ? 18.358 14.538 17.126  1.00 18.28 ? 5   DA  A "C5'" 1 
ATOM   85  C  "C4'" . DA  A 1 5  ? 16.882 14.596 16.759  1.00 1.74  ? 5   DA  A "C4'" 1 
ATOM   86  O  "O4'" . DA  A 1 5  ? 16.526 15.929 16.317  1.00 10.00 ? 5   DA  A "O4'" 1 
ATOM   87  C  "C3'" . DA  A 1 5  ? 16.380 13.656 15.671  1.00 10.00 ? 5   DA  A "C3'" 1 
ATOM   88  O  "O3'" . DA  A 1 5  ? 15.030 13.225 15.933  1.00 10.21 ? 5   DA  A "O3'" 1 
ATOM   89  C  "C2'" . DA  A 1 5  ? 16.516 14.552 14.435  1.00 10.00 ? 5   DA  A "C2'" 1 
ATOM   90  C  "C1'" . DA  A 1 5  ? 16.000 15.867 14.984  1.00 10.00 ? 5   DA  A "C1'" 1 
ATOM   91  N  N9    . DA  A 1 5  ? 16.515 17.063 14.265  1.00 10.00 ? 5   DA  A N9    1 
ATOM   92  C  C8    . DA  A 1 5  ? 17.733 17.296 13.677  1.00 10.00 ? 5   DA  A C8    1 
ATOM   93  N  N7    . DA  A 1 5  ? 17.850 18.547 13.185  1.00 14.32 ? 5   DA  A N7    1 
ATOM   94  C  C5    . DA  A 1 5  ? 16.666 19.127 13.479  1.00 27.78 ? 5   DA  A C5    1 
ATOM   95  C  C6    . DA  A 1 5  ? 16.149 20.446 13.251  1.00 39.65 ? 5   DA  A C6    1 
ATOM   96  N  N6    . DA  A 1 5  ? 16.877 21.432 12.654  1.00 0.87  ? 5   DA  A N6    1 
ATOM   97  N  N1    . DA  A 1 5  ? 14.903 20.704 13.666  1.00 10.00 ? 5   DA  A N1    1 
ATOM   98  C  C2    . DA  A 1 5  ? 14.209 19.750 14.287  1.00 42.91 ? 5   DA  A C2    1 
ATOM   99  N  N3    . DA  A 1 5  ? 14.578 18.502 14.576  1.00 41.32 ? 5   DA  A N3    1 
ATOM   100 C  C4    . DA  A 1 5  ? 15.834 18.255 14.131  1.00 42.35 ? 5   DA  A C4    1 
ATOM   101 P  P     . DA  A 1 6  ? 14.170 12.384 14.871  1.00 15.38 ? 6   DA  A P     1 
ATOM   102 O  OP1   . DA  A 1 6  ? 13.313 11.435 15.600  1.00 21.05 ? 6   DA  A OP1   1 
ATOM   103 O  OP2   . DA  A 1 6  ? 15.071 11.785 13.843  1.00 13.30 ? 6   DA  A OP2   1 
ATOM   104 O  "O5'" . DA  A 1 6  ? 13.206 13.505 14.247  1.00 30.97 ? 6   DA  A "O5'" 1 
ATOM   105 C  "C5'" . DA  A 1 6  ? 11.934 13.783 14.891  1.00 32.81 ? 6   DA  A "C5'" 1 
ATOM   106 C  "C4'" . DA  A 1 6  ? 11.160 14.831 14.114  1.00 21.75 ? 6   DA  A "C4'" 1 
ATOM   107 O  "O4'" . DA  A 1 6  ? 12.075 15.883 13.758  1.00 10.00 ? 6   DA  A "O4'" 1 
ATOM   108 C  "C3'" . DA  A 1 6  ? 10.430 14.383 12.834  1.00 36.85 ? 6   DA  A "C3'" 1 
ATOM   109 O  "O3'" . DA  A 1 6  ? 9.037  14.775 12.793  1.00 38.74 ? 6   DA  A "O3'" 1 
ATOM   110 C  "C2'" . DA  A 1 6  ? 11.276 15.028 11.742  1.00 41.12 ? 6   DA  A "C2'" 1 
ATOM   111 C  "C1'" . DA  A 1 6  ? 11.746 16.298 12.429  1.00 13.89 ? 6   DA  A "C1'" 1 
ATOM   112 N  N9    . DA  A 1 6  ? 12.963 16.887 11.792  1.00 10.00 ? 6   DA  A N9    1 
ATOM   113 C  C8    . DA  A 1 6  ? 14.182 16.317 11.536  1.00 20.29 ? 6   DA  A C8    1 
ATOM   114 N  N7    . DA  A 1 6  ? 15.035 17.159 10.929  1.00 0.45  ? 6   DA  A N7    1 
ATOM   115 C  C5    . DA  A 1 6  ? 14.331 18.299 10.804  1.00 10.00 ? 6   DA  A C5    1 
ATOM   116 C  C6    . DA  A 1 6  ? 14.671 19.572 10.257  1.00 23.26 ? 6   DA  A C6    1 
ATOM   117 N  N6    . DA  A 1 6  ? 15.899 19.846 9.741   1.00 6.61  ? 6   DA  A N6    1 
ATOM   118 N  N1    . DA  A 1 6  ? 13.734 20.520 10.282  1.00 7.76  ? 6   DA  A N1    1 
ATOM   119 C  C2    . DA  A 1 6  ? 12.541 20.245 10.803  1.00 41.13 ? 6   DA  A C2    1 
ATOM   120 N  N3    . DA  A 1 6  ? 12.104 19.106 11.340  1.00 10.00 ? 6   DA  A N3    1 
ATOM   121 C  C4    . DA  A 1 6  ? 13.073 18.172 11.310  1.00 10.00 ? 6   DA  A C4    1 
ATOM   122 P  P     . DT  A 1 7  ? 8.032  14.202 11.670  1.00 10.00 ? 7   DT  A P     1 
ATOM   123 O  OP1   . DT  A 1 7  ? 6.698  14.007 12.244  1.00 8.80  ? 7   DT  A OP1   1 
ATOM   124 O  OP2   . DT  A 1 7  ? 8.640  13.049 10.995  1.00 4.36  ? 7   DT  A OP2   1 
ATOM   125 O  "O5'" . DT  A 1 7  ? 7.918  15.412 10.635  1.00 13.01 ? 7   DT  A "O5'" 1 
ATOM   126 C  "C5'" . DT  A 1 7  ? 7.765  16.765 11.118  1.00 6.04  ? 7   DT  A "C5'" 1 
ATOM   127 C  "C4'" . DT  A 1 7  ? 8.149  17.740 10.026  1.00 22.14 ? 7   DT  A "C4'" 1 
ATOM   128 O  "O4'" . DT  A 1 7  ? 9.583  17.827 9.872   1.00 8.78  ? 7   DT  A "O4'" 1 
ATOM   129 C  "C3'" . DT  A 1 7  ? 7.564  17.502 8.647   1.00 10.00 ? 7   DT  A "C3'" 1 
ATOM   130 O  "O3'" . DT  A 1 7  ? 6.725  18.576 8.205   1.00 2.14  ? 7   DT  A "O3'" 1 
ATOM   131 C  "C2'" . DT  A 1 7  ? 8.808  17.313 7.780   1.00 2.05  ? 7   DT  A "C2'" 1 
ATOM   132 C  "C1'" . DT  A 1 7  ? 9.824  18.167 8.506   1.00 10.00 ? 7   DT  A "C1'" 1 
ATOM   133 N  N1    . DT  A 1 7  ? 11.214 17.781 8.166   1.00 10.00 ? 7   DT  A N1    1 
ATOM   134 C  C2    . DT  A 1 7  ? 12.074 18.716 7.665   1.00 4.90  ? 7   DT  A C2    1 
ATOM   135 O  O2    . DT  A 1 7  ? 11.714 19.881 7.512   1.00 2.89  ? 7   DT  A O2    1 
ATOM   136 N  N3    . DT  A 1 7  ? 13.358 18.348 7.382   1.00 10.00 ? 7   DT  A N3    1 
ATOM   137 C  C4    . DT  A 1 7  ? 13.810 17.076 7.577   1.00 9.99  ? 7   DT  A C4    1 
ATOM   138 O  O4    . DT  A 1 7  ? 14.998 16.846 7.335   1.00 7.81  ? 7   DT  A O4    1 
ATOM   139 C  C5    . DT  A 1 7  ? 12.915 16.126 8.086   1.00 10.00 ? 7   DT  A C5    1 
ATOM   140 C  C7    . DT  A 1 7  ? 13.356 14.717 8.330   1.00 42.89 ? 7   DT  A C7    1 
ATOM   141 C  C6    . DT  A 1 7  ? 11.606 16.496 8.384   1.00 16.51 ? 7   DT  A C6    1 
ATOM   142 P  P     . DT  A 1 8  ? 5.643  18.304 7.058   1.00 4.08  ? 8   DT  A P     1 
ATOM   143 O  OP1   . DT  A 1 8  ? 4.535  17.509 7.625   1.00 0.73  ? 8   DT  A OP1   1 
ATOM   144 O  OP2   . DT  A 1 8  ? 6.344  17.733 5.887   1.00 14.25 ? 8   DT  A OP2   1 
ATOM   145 O  "O5'" . DT  A 1 8  ? 5.088  19.754 6.681   1.00 14.12 ? 8   DT  A "O5'" 1 
ATOM   146 C  "C5'" . DT  A 1 8  ? 5.936  20.914 6.773   1.00 45.71 ? 8   DT  A "C5'" 1 
ATOM   147 C  "C4'" . DT  A 1 8  ? 6.615  21.153 5.448   1.00 10.00 ? 8   DT  A "C4'" 1 
ATOM   148 O  "O4'" . DT  A 1 8  ? 7.956  20.666 5.529   1.00 1.87  ? 8   DT  A "O4'" 1 
ATOM   149 C  "C3'" . DT  A 1 8  ? 6.028  20.489 4.208   1.00 10.00 ? 8   DT  A "C3'" 1 
ATOM   150 O  "O3'" . DT  A 1 8  ? 5.038  21.289 3.500   1.00 40.72 ? 8   DT  A "O3'" 1 
ATOM   151 C  "C2'" . DT  A 1 8  ? 7.234  20.029 3.383   1.00 8.75  ? 8   DT  A "C2'" 1 
ATOM   152 C  "C1'" . DT  A 1 8  ? 8.427  20.563 4.178   1.00 5.07  ? 8   DT  A "C1'" 1 
ATOM   153 N  N1    . DT  A 1 8  ? 9.628  19.676 4.134   1.00 17.45 ? 8   DT  A N1    1 
ATOM   154 C  C2    . DT  A 1 8  ? 10.836 20.197 3.759   1.00 4.14  ? 8   DT  A C2    1 
ATOM   155 O  O2    . DT  A 1 8  ? 10.942 21.375 3.418   1.00 9.26  ? 8   DT  A O2    1 
ATOM   156 N  N3    . DT  A 1 8  ? 11.924 19.377 3.732   1.00 21.74 ? 8   DT  A N3    1 
ATOM   157 C  C4    . DT  A 1 8  ? 11.855 18.055 4.054   1.00 8.78  ? 8   DT  A C4    1 
ATOM   158 O  O4    . DT  A 1 8  ? 12.898 17.402 3.999   1.00 10.00 ? 8   DT  A O4    1 
ATOM   159 C  C5    . DT  A 1 8  ? 10.612 17.526 4.413   1.00 10.86 ? 8   DT  A C5    1 
ATOM   160 C  C7    . DT  A 1 8  ? 10.468 16.076 4.753   1.00 42.90 ? 8   DT  A C7    1 
ATOM   161 C  C6    . DT  A 1 8  ? 9.493  18.359 4.453   1.00 13.62 ? 8   DT  A C6    1 
ATOM   162 P  P     . DC  A 1 9  ? 5.377  22.399 2.389   1.00 2.31  ? 9   DC  A P     1 
ATOM   163 O  OP1   . DC  A 1 9  ? 4.497  23.579 2.618   1.00 10.00 ? 9   DC  A OP1   1 
ATOM   164 O  OP2   . DC  A 1 9  ? 5.316  21.828 1.033   1.00 31.26 ? 9   DC  A OP2   1 
ATOM   165 O  "O5'" . DC  A 1 9  ? 6.881  22.881 2.685   1.00 10.00 ? 9   DC  A "O5'" 1 
ATOM   166 C  "C5'" . DC  A 1 9  ? 7.260  24.250 2.381   1.00 41.33 ? 9   DC  A "C5'" 1 
ATOM   167 C  "C4'" . DC  A 1 9  ? 8.226  24.295 1.215   1.00 22.67 ? 9   DC  A "C4'" 1 
ATOM   168 O  "O4'" . DC  A 1 9  ? 9.189  23.238 1.339   1.00 30.86 ? 9   DC  A "O4'" 1 
ATOM   169 C  "C3'" . DC  A 1 9  ? 7.666  24.207 -0.209  1.00 0.36  ? 9   DC  A "C3'" 1 
ATOM   170 O  "O3'" . DC  A 1 9  ? 8.231  25.198 -1.100  1.00 6.32  ? 9   DC  A "O3'" 1 
ATOM   171 C  "C2'" . DC  A 1 9  ? 8.052  22.798 -0.612  1.00 43.55 ? 9   DC  A "C2'" 1 
ATOM   172 C  "C1'" . DC  A 1 9  ? 9.422  22.743 0.021   1.00 1.55  ? 9   DC  A "C1'" 1 
ATOM   173 N  N1    . DC  A 1 9  ? 9.904  21.364 0.148   1.00 12.07 ? 9   DC  A N1    1 
ATOM   174 C  C2    . DC  A 1 9  ? 11.236 21.126 0.016   1.00 10.00 ? 9   DC  A C2    1 
ATOM   175 O  O2    . DC  A 1 9  ? 11.981 22.081 -0.215  1.00 10.00 ? 9   DC  A O2    1 
ATOM   176 N  N3    . DC  A 1 9  ? 11.702 19.883 0.154   1.00 17.46 ? 9   DC  A N3    1 
ATOM   177 C  C4    . DC  A 1 9  ? 10.868 18.873 0.414   1.00 0.05  ? 9   DC  A C4    1 
ATOM   178 N  N4    . DC  A 1 9  ? 11.359 17.606 0.538   1.00 27.20 ? 9   DC  A N4    1 
ATOM   179 C  C5    . DC  A 1 9  ? 9.496  19.076 0.548   1.00 30.79 ? 9   DC  A C5    1 
ATOM   180 C  C6    . DC  A 1 9  ? 9.012  20.372 0.412   1.00 3.63  ? 9   DC  A C6    1 
ATOM   181 P  P     . DG  A 1 10 ? 7.360  25.727 -2.331  1.00 1.08  ? 10  DG  A P     1 
ATOM   182 O  OP1   . DG  A 1 10 ? 6.954  27.135 -2.049  1.00 39.51 ? 10  DG  A OP1   1 
ATOM   183 O  OP2   . DG  A 1 10 ? 6.269  24.776 -2.617  1.00 36.30 ? 10  DG  A OP2   1 
ATOM   184 O  "O5'" . DG  A 1 10 ? 8.385  25.741 -3.551  1.00 8.33  ? 10  DG  A "O5'" 1 
ATOM   185 C  "C5'" . DG  A 1 10 ? 9.589  26.511 -3.455  1.00 6.78  ? 10  DG  A "C5'" 1 
ATOM   186 C  "C4'" . DG  A 1 10 ? 10.649 25.779 -4.225  1.00 10.00 ? 10  DG  A "C4'" 1 
ATOM   187 O  "O4'" . DG  A 1 10 ? 10.796 24.460 -3.673  1.00 41.14 ? 10  DG  A "O4'" 1 
ATOM   188 C  "C3'" . DG  A 1 10 ? 10.363 25.571 -5.702  1.00 27.34 ? 10  DG  A "C3'" 1 
ATOM   189 O  "O3'" . DG  A 1 10 ? 11.532 25.735 -6.492  1.00 41.56 ? 10  DG  A "O3'" 1 
ATOM   190 C  "C2'" . DG  A 1 10 ? 9.830  24.148 -5.744  1.00 10.00 ? 10  DG  A "C2'" 1 
ATOM   191 C  "C1'" . DG  A 1 10 ? 10.785 23.529 -4.757  1.00 10.00 ? 10  DG  A "C1'" 1 
ATOM   192 N  N9    . DG  A 1 10 ? 10.317 22.218 -4.252  1.00 39.39 ? 10  DG  A N9    1 
ATOM   193 C  C8    . DG  A 1 10 ? 9.046  21.769 -3.998  1.00 32.30 ? 10  DG  A C8    1 
ATOM   194 N  N7    . DG  A 1 10 ? 9.023  20.503 -3.550  1.00 32.90 ? 10  DG  A N7    1 
ATOM   195 C  C5    . DG  A 1 10 ? 10.324 20.147 -3.529  1.00 24.28 ? 10  DG  A C5    1 
ATOM   196 C  C6    . DG  A 1 10 ? 10.930 18.912 -3.144  1.00 29.55 ? 10  DG  A C6    1 
ATOM   197 O  O6    . DG  A 1 10 ? 10.391 17.879 -2.743  1.00 8.52  ? 10  DG  A O6    1 
ATOM   198 N  N1    . DG  A 1 10 ? 12.300 18.966 -3.267  1.00 19.49 ? 10  DG  A N1    1 
ATOM   199 C  C2    . DG  A 1 10 ? 13.042 20.030 -3.700  1.00 10.00 ? 10  DG  A C2    1 
ATOM   200 N  N2    . DG  A 1 10 ? 14.393 19.877 -3.761  1.00 10.94 ? 10  DG  A N2    1 
ATOM   201 N  N3    . DG  A 1 10 ? 12.479 21.185 -4.059  1.00 10.00 ? 10  DG  A N3    1 
ATOM   202 C  C4    . DG  A 1 10 ? 11.133 21.168 -3.945  1.00 38.65 ? 10  DG  A C4    1 
ATOM   203 P  P     . DC  A 1 11 ? 11.584 26.868 -7.613  1.00 17.84 ? 11  DC  A P     1 
ATOM   204 O  OP1   . DC  A 1 11 ? 10.817 28.047 -7.164  1.00 36.45 ? 11  DC  A OP1   1 
ATOM   205 O  OP2   . DC  A 1 11 ? 11.176 26.280 -8.906  1.00 28.19 ? 11  DC  A OP2   1 
ATOM   206 O  "O5'" . DC  A 1 11 ? 13.149 27.217 -7.662  1.00 29.92 ? 11  DC  A "O5'" 1 
ATOM   207 C  "C5'" . DC  A 1 11 ? 13.993 26.977 -6.504  1.00 2.25  ? 11  DC  A "C5'" 1 
ATOM   208 C  "C4'" . DC  A 1 11 ? 15.014 25.875 -6.757  1.00 34.18 ? 11  DC  A "C4'" 1 
ATOM   209 O  "O4'" . DC  A 1 11 ? 14.469 24.581 -6.440  1.00 37.11 ? 11  DC  A "O4'" 1 
ATOM   210 C  "C3'" . DC  A 1 11 ? 15.659 25.736 -8.133  1.00 11.26 ? 11  DC  A "C3'" 1 
ATOM   211 O  "O3'" . DC  A 1 11 ? 17.052 25.378 -8.044  1.00 19.65 ? 11  DC  A "O3'" 1 
ATOM   212 C  "C2'" . DC  A 1 11 ? 14.815 24.622 -8.734  1.00 9.39  ? 11  DC  A "C2'" 1 
ATOM   213 C  "C1'" . DC  A 1 11 ? 14.766 23.698 -7.534  1.00 3.70  ? 11  DC  A "C1'" 1 
ATOM   214 N  N1    . DC  A 1 11 ? 13.662 22.722 -7.638  1.00 10.00 ? 11  DC  A N1    1 
ATOM   215 C  C2    . DC  A 1 11 ? 13.879 21.432 -7.257  1.00 10.00 ? 11  DC  A C2    1 
ATOM   216 O  O2    . DC  A 1 11 ? 14.994 21.127 -6.844  1.00 36.82 ? 11  DC  A O2    1 
ATOM   217 N  N3    . DC  A 1 11 ? 12.888 20.541 -7.329  1.00 10.00 ? 11  DC  A N3    1 
ATOM   218 C  C4    . DC  A 1 11 ? 11.679 20.905 -7.773  1.00 4.51  ? 11  DC  A C4    1 
ATOM   219 N  N4    . DC  A 1 11 ? 10.660 20.001 -7.810  1.00 7.13  ? 11  DC  A N4    1 
ATOM   220 C  C5    . DC  A 1 11 ? 11.426 22.208 -8.196  1.00 41.33 ? 11  DC  A C5    1 
ATOM   221 C  C6    . DC  A 1 11 ? 12.461 23.134 -8.123  1.00 30.76 ? 11  DC  A C6    1 
ATOM   222 P  P     . DG  A 1 12 ? 17.974 25.368 -9.355  1.00 36.93 ? 12  DG  A P     1 
ATOM   223 O  OP1   . DG  A 1 12 ? 19.295 25.958 -9.048  1.00 39.53 ? 12  DG  A OP1   1 
ATOM   224 O  OP2   . DG  A 1 12 ? 17.240 25.984 -10.484 1.00 39.84 ? 12  DG  A OP2   1 
ATOM   225 O  "O5'" . DG  A 1 12 ? 18.158 23.803 -9.647  1.00 41.75 ? 12  DG  A "O5'" 1 
ATOM   226 C  "C5'" . DG  A 1 12 ? 19.350 23.110 -9.209  1.00 24.96 ? 12  DG  A "C5'" 1 
ATOM   227 C  "C4'" . DG  A 1 12 ? 19.598 21.912 -10.101 1.00 21.34 ? 12  DG  A "C4'" 1 
ATOM   228 O  "O4'" . DG  A 1 12 ? 18.443 21.062 -10.040 1.00 6.41  ? 12  DG  A "O4'" 1 
ATOM   229 C  "C3'" . DG  A 1 12 ? 19.878 22.162 -11.587 1.00 30.29 ? 12  DG  A "C3'" 1 
ATOM   230 O  "O3'" . DG  A 1 12 ? 20.752 21.177 -12.179 1.00 3.04  ? 12  DG  A "O3'" 1 
ATOM   231 C  "C2'" . DG  A 1 12 ? 18.475 22.105 -12.160 1.00 10.00 ? 12  DG  A "C2'" 1 
ATOM   232 C  "C1'" . DG  A 1 12 ? 17.932 20.922 -11.371 1.00 36.30 ? 12  DG  A "C1'" 1 
ATOM   233 N  N9    . DG  A 1 12 ? 16.465 20.982 -11.288 1.00 10.00 ? 12  DG  A N9    1 
ATOM   234 C  C8    . DG  A 1 12 ? 15.635 22.006 -11.641 1.00 10.00 ? 12  DG  A C8    1 
ATOM   235 N  N7    . DG  A 1 12 ? 14.341 21.692 -11.491 1.00 8.58  ? 12  DG  A N7    1 
ATOM   236 C  C5    . DG  A 1 12 ? 14.371 20.423 -11.036 1.00 10.00 ? 12  DG  A C5    1 
ATOM   237 C  C6    . DG  A 1 12 ? 13.292 19.544 -10.721 1.00 4.22  ? 12  DG  A C6    1 
ATOM   238 O  O6    . DG  A 1 12 ? 12.083 19.755 -10.792 1.00 7.35  ? 12  DG  A O6    1 
ATOM   239 N  N1    . DG  A 1 12 ? 13.749 18.321 -10.294 1.00 1.62  ? 12  DG  A N1    1 
ATOM   240 C  C2    . DG  A 1 12 ? 15.051 17.932 -10.162 1.00 10.00 ? 12  DG  A C2    1 
ATOM   241 N  N2    . DG  A 1 12 ? 15.301 16.663 -9.716  1.00 10.00 ? 12  DG  A N2    1 
ATOM   242 N  N3    . DG  A 1 12 ? 16.055 18.757 -10.463 1.00 10.29 ? 12  DG  A N3    1 
ATOM   243 C  C4    . DG  A 1 12 ? 15.642 19.968 -10.889 1.00 10.00 ? 12  DG  A C4    1 
ATOM   244 O  "O5'" . DC  B 1 1  ? 7.508  11.189 -9.741  1.00 33.00 ? 13  DC  B "O5'" 1 
ATOM   245 C  "C5'" . DC  B 1 1  ? 8.601  11.039 -10.682 1.00 42.01 ? 13  DC  B "C5'" 1 
ATOM   246 C  "C4'" . DC  B 1 1  ? 9.926  10.864 -9.957  1.00 42.61 ? 13  DC  B "C4'" 1 
ATOM   247 O  "O4'" . DC  B 1 1  ? 10.786 11.978 -10.265 1.00 21.95 ? 13  DC  B "O4'" 1 
ATOM   248 C  "C3'" . DC  B 1 1  ? 9.941  10.766 -8.438  1.00 42.00 ? 13  DC  B "C3'" 1 
ATOM   249 O  "O3'" . DC  B 1 1  ? 11.095 10.042 -7.959  1.00 10.00 ? 13  DC  B "O3'" 1 
ATOM   250 C  "C2'" . DC  B 1 1  ? 9.972  12.252 -8.080  1.00 6.97  ? 13  DC  B "C2'" 1 
ATOM   251 C  "C1'" . DC  B 1 1  ? 10.982 12.779 -9.087  1.00 10.00 ? 13  DC  B "C1'" 1 
ATOM   252 N  N1    . DC  B 1 1  ? 10.657 14.186 -9.458  1.00 2.92  ? 13  DC  B N1    1 
ATOM   253 C  C2    . DC  B 1 1  ? 11.646 15.121 -9.553  1.00 13.93 ? 13  DC  B C2    1 
ATOM   254 O  O2    . DC  B 1 1  ? 12.806 14.782 -9.334  1.00 5.28  ? 13  DC  B O2    1 
ATOM   255 N  N3    . DC  B 1 1  ? 11.348 16.371 -9.909  1.00 5.30  ? 13  DC  B N3    1 
ATOM   256 C  C4    . DC  B 1 1  ? 10.090 16.721 -10.178 1.00 10.00 ? 13  DC  B C4    1 
ATOM   257 N  N4    . DC  B 1 1  ? 9.813  17.998 -10.568 1.00 29.86 ? 13  DC  B N4    1 
ATOM   258 C  C5    . DC  B 1 1  ? 9.049  15.804 -10.086 1.00 37.82 ? 13  DC  B C5    1 
ATOM   259 C  C6    . DC  B 1 1  ? 9.360  14.500 -9.713  1.00 9.02  ? 13  DC  B C6    1 
ATOM   260 P  P     . DG  B 1 2  ? 11.262 9.623  -6.421  1.00 14.57 ? 14  DG  B P     1 
ATOM   261 O  OP1   . DG  B 1 2  ? 11.163 8.155  -6.317  1.00 38.42 ? 14  DG  B OP1   1 
ATOM   262 O  OP2   . DG  B 1 2  ? 10.319 10.383 -5.568  1.00 41.53 ? 14  DG  B OP2   1 
ATOM   263 O  "O5'" . DG  B 1 2  ? 12.761 10.073 -6.090  1.00 41.32 ? 14  DG  B "O5'" 1 
ATOM   264 C  "C5'" . DG  B 1 2  ? 13.878 9.528  -6.839  1.00 40.67 ? 14  DG  B "C5'" 1 
ATOM   265 C  "C4'" . DG  B 1 2  ? 15.086 10.412 -6.618  1.00 35.81 ? 14  DG  B "C4'" 1 
ATOM   266 O  "O4'" . DG  B 1 2  ? 14.747 11.746 -7.039  1.00 15.63 ? 14  DG  B "O4'" 1 
ATOM   267 C  "C3'" . DG  B 1 2  ? 15.587 10.523 -5.180  1.00 42.63 ? 14  DG  B "C3'" 1 
ATOM   268 O  "O3'" . DG  B 1 2  ? 17.019 10.495 -5.065  1.00 13.62 ? 14  DG  B "O3'" 1 
ATOM   269 C  "C2'" . DG  B 1 2  ? 14.978 11.832 -4.706  1.00 22.11 ? 14  DG  B "C2'" 1 
ATOM   270 C  "C1'" . DG  B 1 2  ? 14.986 12.674 -5.968  1.00 10.00 ? 14  DG  B "C1'" 1 
ATOM   271 N  N9    . DG  B 1 2  ? 13.828 13.599 -5.932  1.00 10.00 ? 14  DG  B N9    1 
ATOM   272 C  C8    . DG  B 1 2  ? 12.533 13.301 -5.605  1.00 9.43  ? 14  DG  B C8    1 
ATOM   273 N  N7    . DG  B 1 2  ? 11.723 14.370 -5.640  1.00 16.48 ? 14  DG  B N7    1 
ATOM   274 C  C5    . DG  B 1 2  ? 12.536 15.384 -5.989  1.00 17.68 ? 14  DG  B C5    1 
ATOM   275 C  C6    . DG  B 1 2  ? 12.222 16.764 -6.175  1.00 5.53  ? 14  DG  B C6    1 
ATOM   276 O  O6    . DG  B 1 2  ? 11.138 17.330 -6.071  1.00 16.06 ? 14  DG  B O6    1 
ATOM   277 N  N1    . DG  B 1 2  ? 13.333 17.496 -6.506  1.00 37.75 ? 14  DG  B N1    1 
ATOM   278 C  C2    . DG  B 1 2  ? 14.602 17.027 -6.659  1.00 10.00 ? 14  DG  B C2    1 
ATOM   279 N  N2    . DG  B 1 2  ? 15.565 17.937 -6.983  1.00 10.00 ? 14  DG  B N2    1 
ATOM   280 N  N3    . DG  B 1 2  ? 14.899 15.730 -6.501  1.00 24.94 ? 14  DG  B N3    1 
ATOM   281 C  C4    . DG  B 1 2  ? 13.827 14.966 -6.169  1.00 36.94 ? 14  DG  B C4    1 
ATOM   282 P  P     . DC  B 1 3  ? 17.719 10.685 -3.638  1.00 31.02 ? 15  DC  B P     1 
ATOM   283 O  OP1   . DC  B 1 3  ? 19.037 10.016 -3.637  1.00 13.01 ? 15  DC  B OP1   1 
ATOM   284 O  OP2   . DC  B 1 3  ? 16.786 10.287 -2.558  1.00 8.32  ? 15  DC  B OP2   1 
ATOM   285 O  "O5'" . DC  B 1 3  ? 17.964 12.257 -3.581  1.00 1.48  ? 15  DC  B "O5'" 1 
ATOM   286 C  "C5'" . DC  B 1 3  ? 18.883 12.875 -4.510  1.00 6.69  ? 15  DC  B "C5'" 1 
ATOM   287 C  "C4'" . DC  B 1 3  ? 19.117 14.272 -4.004  1.00 43.72 ? 15  DC  B "C4'" 1 
ATOM   288 O  "O4'" . DC  B 1 3  ? 17.898 15.020 -4.172  1.00 3.35  ? 15  DC  B "O4'" 1 
ATOM   289 C  "C3'" . DC  B 1 3  ? 19.518 14.345 -2.538  1.00 10.00 ? 15  DC  B "C3'" 1 
ATOM   290 O  "O3'" . DC  B 1 3  ? 20.839 14.864 -2.353  1.00 30.15 ? 15  DC  B "O3'" 1 
ATOM   291 C  "C2'" . DC  B 1 3  ? 18.427 15.167 -1.858  1.00 8.77  ? 15  DC  B "C2'" 1 
ATOM   292 C  "C1'" . DC  B 1 3  ? 17.613 15.767 -2.990  1.00 12.40 ? 15  DC  B "C1'" 1 
ATOM   293 N  N1    . DC  B 1 3  ? 16.155 15.649 -2.737  1.00 0.50  ? 15  DC  B N1    1 
ATOM   294 C  C2    . DC  B 1 3  ? 15.348 16.652 -3.178  1.00 0.11  ? 15  DC  B C2    1 
ATOM   295 O  O2    . DC  B 1 3  ? 15.864 17.589 -3.787  1.00 3.57  ? 15  DC  B O2    1 
ATOM   296 N  N3    . DC  B 1 3  ? 14.033 16.602 -2.946  1.00 10.00 ? 15  DC  B N3    1 
ATOM   297 C  C4    . DC  B 1 3  ? 13.494 15.571 -2.295  1.00 10.00 ? 15  DC  B C4    1 
ATOM   298 N  N4    . DC  B 1 3  ? 12.154 15.549 -2.061  1.00 10.00 ? 15  DC  B N4    1 
ATOM   299 C  C5    . DC  B 1 3  ? 14.280 14.516 -1.837  1.00 1.47  ? 15  DC  B C5    1 
ATOM   300 C  C6    . DC  B 1 3  ? 15.654 14.570 -2.071  1.00 32.27 ? 15  DC  B C6    1 
ATOM   301 P  P     . DG  B 1 4  ? 21.604 14.717 -0.953  1.00 16.13 ? 16  DG  B P     1 
ATOM   302 O  OP1   . DG  B 1 4  ? 22.754 13.802 -1.130  1.00 16.56 ? 16  DG  B OP1   1 
ATOM   303 O  OP2   . DG  B 1 4  ? 20.652 14.375 0.137   1.00 6.00  ? 16  DG  B OP2   1 
ATOM   304 O  "O5'" . DG  B 1 4  ? 22.129 16.212 -0.733  1.00 26.53 ? 16  DG  B "O5'" 1 
ATOM   305 C  "C5'" . DG  B 1 4  ? 22.126 17.134 -1.849  1.00 36.46 ? 16  DG  B "C5'" 1 
ATOM   306 C  "C4'" . DG  B 1 4  ? 21.646 18.488 -1.390  1.00 16.74 ? 16  DG  B "C4'" 1 
ATOM   307 O  "O4'" . DG  B 1 4  ? 20.206 18.521 -1.379  1.00 10.00 ? 16  DG  B "O4'" 1 
ATOM   308 C  "C3'" . DG  B 1 4  ? 22.133 18.957 -0.027  1.00 39.18 ? 16  DG  B "C3'" 1 
ATOM   309 O  "O3'" . DG  B 1 4  ? 22.748 20.264 -0.090  1.00 33.54 ? 16  DG  B "O3'" 1 
ATOM   310 C  "C2'" . DG  B 1 4  ? 20.872 18.869 0.843   1.00 0.75  ? 16  DG  B "C2'" 1 
ATOM   311 C  "C1'" . DG  B 1 4  ? 19.746 19.110 -0.151  1.00 3.24  ? 16  DG  B "C1'" 1 
ATOM   312 N  N9    . DG  B 1 4  ? 18.514 18.387 0.259   1.00 10.00 ? 16  DG  B N9    1 
ATOM   313 C  C8    . DG  B 1 4  ? 18.415 17.172 0.884   1.00 10.00 ? 16  DG  B C8    1 
ATOM   314 N  N7    . DG  B 1 4  ? 17.145 16.773 1.068   1.00 16.88 ? 16  DG  B N7    1 
ATOM   315 C  C5    . DG  B 1 4  ? 16.413 17.780 0.548   1.00 8.85  ? 16  DG  B C5    1 
ATOM   316 C  C6    . DG  B 1 4  ? 14.993 17.924 0.479   1.00 10.00 ? 16  DG  B C6    1 
ATOM   317 O  O6    . DG  B 1 4  ? 14.123 17.162 0.882   1.00 16.65 ? 16  DG  B O6    1 
ATOM   318 N  N1    . DG  B 1 4  ? 14.632 19.114 -0.102  1.00 10.00 ? 16  DG  B N1    1 
ATOM   319 C  C2    . DG  B 1 4  ? 15.473 20.075 -0.584  1.00 41.04 ? 16  DG  B C2    1 
ATOM   320 N  N2    . DG  B 1 4  ? 14.902 21.191 -1.120  1.00 10.00 ? 16  DG  B N2    1 
ATOM   321 N  N3    . DG  B 1 4  ? 16.807 19.951 -0.511  1.00 16.88 ? 16  DG  B N3    1 
ATOM   322 C  C4    . DG  B 1 4  ? 17.210 18.786 0.058   1.00 2.06  ? 16  DG  B C4    1 
ATOM   323 P  P     . DA  B 1 5  ? 22.832 21.231 1.184   1.00 19.00 ? 17  DA  B P     1 
ATOM   324 O  OP1   . DA  B 1 5  ? 23.918 22.220 0.998   1.00 16.42 ? 17  DA  B OP1   1 
ATOM   325 O  OP2   . DA  B 1 5  ? 22.924 20.438 2.430   1.00 23.48 ? 17  DA  B OP2   1 
ATOM   326 O  "O5'" . DA  B 1 5  ? 21.431 22.018 1.117   1.00 22.71 ? 17  DA  B "O5'" 1 
ATOM   327 C  "C5'" . DA  B 1 5  ? 21.033 22.720 -0.095  1.00 21.34 ? 17  DA  B "C5'" 1 
ATOM   328 C  "C4'" . DA  B 1 5  ? 20.043 23.846 0.167   1.00 5.62  ? 17  DA  B "C4'" 1 
ATOM   329 O  "O4'" . DA  B 1 5  ? 18.691 23.383 0.366   1.00 3.30  ? 17  DA  B "O4'" 1 
ATOM   330 C  "C3'" . DA  B 1 5  ? 20.289 24.800 1.313   1.00 37.90 ? 17  DA  B "C3'" 1 
ATOM   331 O  "O3'" . DA  B 1 5  ? 19.652 26.061 1.083   1.00 40.55 ? 17  DA  B "O3'" 1 
ATOM   332 C  "C2'" . DA  B 1 5  ? 19.628 24.023 2.439   1.00 18.16 ? 17  DA  B "C2'" 1 
ATOM   333 C  "C1'" . DA  B 1 5  ? 18.354 23.544 1.758   1.00 19.47 ? 17  DA  B "C1'" 1 
ATOM   334 N  N9    . DA  B 1 5  ? 17.934 22.240 2.341   1.00 1.00  ? 17  DA  B N9    1 
ATOM   335 C  C8    . DA  B 1 5  ? 18.709 21.298 2.970   1.00 10.00 ? 17  DA  B C8    1 
ATOM   336 N  N7    . DA  B 1 5  ? 17.996 20.265 3.446   1.00 4.04  ? 17  DA  B N7    1 
ATOM   337 C  C5    . DA  B 1 5  ? 16.726 20.566 3.111   1.00 29.48 ? 17  DA  B C5    1 
ATOM   338 C  C6    . DA  B 1 5  ? 15.485 19.896 3.359   1.00 12.85 ? 17  DA  B C6    1 
ATOM   339 N  N6    . DA  B 1 5  ? 15.398 18.726 4.054   1.00 14.58 ? 17  DA  B N6    1 
ATOM   340 N  N1    . DA  B 1 5  ? 14.374 20.481 2.910   1.00 10.88 ? 17  DA  B N1    1 
ATOM   341 C  C2    . DA  B 1 5  ? 14.457 21.641 2.252   1.00 42.94 ? 17  DA  B C2    1 
ATOM   342 N  N3    . DA  B 1 5  ? 15.542 22.360 1.955   1.00 32.73 ? 17  DA  B N3    1 
ATOM   343 C  C4    . DA  B 1 5  ? 16.653 21.755 2.428   1.00 2.49  ? 17  DA  B C4    1 
ATOM   344 P  P     . DA  B 1 6  ? 19.828 27.274 2.108   1.00 27.97 ? 18  DA  B P     1 
ATOM   345 O  OP1   . DA  B 1 6  ? 20.517 28.370 1.389   1.00 41.74 ? 18  DA  B OP1   1 
ATOM   346 O  OP2   . DA  B 1 6  ? 20.495 26.809 3.349   1.00 10.96 ? 18  DA  B OP2   1 
ATOM   347 O  "O5'" . DA  B 1 6  ? 18.308 27.679 2.440   1.00 2.30  ? 18  DA  B "O5'" 1 
ATOM   348 C  "C5'" . DA  B 1 6  ? 17.226 27.078 1.684   1.00 33.05 ? 18  DA  B "C5'" 1 
ATOM   349 C  "C4'" . DA  B 1 6  ? 15.939 27.109 2.476   1.00 10.00 ? 18  DA  B "C4'" 1 
ATOM   350 O  "O4'" . DA  B 1 6  ? 15.599 25.786 2.929   1.00 10.00 ? 18  DA  B "O4'" 1 
ATOM   351 C  "C3'" . DA  B 1 6  ? 15.914 28.010 3.700   1.00 42.90 ? 18  DA  B "C3'" 1 
ATOM   352 O  "O3'" . DA  B 1 6  ? 14.641 28.647 3.894   1.00 25.57 ? 18  DA  B "O3'" 1 
ATOM   353 C  "C2'" . DA  B 1 6  ? 16.264 27.031 4.806   1.00 5.94  ? 18  DA  B "C2'" 1 
ATOM   354 C  "C1'" . DA  B 1 6  ? 15.472 25.815 4.365   1.00 11.06 ? 18  DA  B "C1'" 1 
ATOM   355 N  N9    . DA  B 1 6  ? 16.037 24.568 4.954   1.00 10.00 ? 18  DA  B N9    1 
ATOM   356 C  C8    . DA  B 1 6  ? 17.344 24.228 5.211   1.00 2.79  ? 18  DA  B C8    1 
ATOM   357 N  N7    . DA  B 1 6  ? 17.475 23.013 5.785   1.00 4.76  ? 18  DA  B N7    1 
ATOM   358 C  C5    . DA  B 1 6  ? 16.202 22.570 5.894   1.00 10.00 ? 18  DA  B C5    1 
ATOM   359 C  C6    . DA  B 1 6  ? 15.642 21.345 6.385   1.00 2.91  ? 18  DA  B C6    1 
ATOM   360 N  N6    . DA  B 1 6  ? 16.397 20.304 6.855   1.00 4.34  ? 18  DA  B N6    1 
ATOM   361 N  N1    . DA  B 1 6  ? 14.315 21.216 6.333   1.00 10.00 ? 18  DA  B N1    1 
ATOM   362 C  C2    . DA  B 1 6  ? 13.573 22.211 5.848   1.00 10.00 ? 18  DA  B C2    1 
ATOM   363 N  N3    . DA  B 1 6  ? 13.962 23.394 5.368   1.00 5.12  ? 18  DA  B N3    1 
ATOM   364 C  C4    . DA  B 1 6  ? 15.304 23.498 5.413   1.00 0.21  ? 18  DA  B C4    1 
ATOM   365 P  P     . DT  B 1 7  ? 14.515 29.915 4.860   1.00 22.29 ? 19  DT  B P     1 
ATOM   366 O  OP1   . DT  B 1 7  ? 13.671 30.933 4.194   1.00 28.51 ? 19  DT  B OP1   1 
ATOM   367 O  OP2   . DT  B 1 7  ? 15.862 30.361 5.290   1.00 30.78 ? 19  DT  B OP2   1 
ATOM   368 O  "O5'" . DT  B 1 7  ? 13.716 29.321 6.113   1.00 25.38 ? 19  DT  B "O5'" 1 
ATOM   369 C  "C5'" . DT  B 1 7  ? 12.345 28.899 5.941   1.00 12.76 ? 19  DT  B "C5'" 1 
ATOM   370 C  "C4'" . DT  B 1 7  ? 12.012 27.753 6.874   1.00 3.98  ? 19  DT  B "C4'" 1 
ATOM   371 O  "O4'" . DT  B 1 7  ? 13.114 26.854 7.053   1.00 16.03 ? 19  DT  B "O4'" 1 
ATOM   372 C  "C3'" . DT  B 1 7  ? 11.553 28.100 8.279   1.00 10.00 ? 19  DT  B "C3'" 1 
ATOM   373 O  "O3'" . DT  B 1 7  ? 10.125 28.266 8.353   1.00 17.41 ? 19  DT  B "O3'" 1 
ATOM   374 C  "C2'" . DT  B 1 7  ? 12.071 26.923 9.122   1.00 2.55  ? 19  DT  B "C2'" 1 
ATOM   375 C  "C1'" . DT  B 1 7  ? 12.660 25.972 8.090   1.00 23.68 ? 19  DT  B "C1'" 1 
ATOM   376 N  N1    . DT  B 1 7  ? 13.816 25.179 8.588   1.00 22.86 ? 19  DT  B N1    1 
ATOM   377 C  C2    . DT  B 1 7  ? 13.638 23.915 9.081   1.00 45.23 ? 19  DT  B C2    1 
ATOM   378 O  O2    . DT  B 1 7  ? 12.511 23.424 9.187   1.00 6.07  ? 19  DT  B O2    1 
ATOM   379 N  N3    . DT  B 1 7  ? 14.743 23.185 9.419   1.00 10.00 ? 19  DT  B N3    1 
ATOM   380 C  C4    . DT  B 1 7  ? 16.008 23.681 9.303   1.00 29.53 ? 19  DT  B C4    1 
ATOM   381 O  O4    . DT  B 1 7  ? 16.952 22.944 9.587   1.00 8.16  ? 19  DT  B O4    1 
ATOM   382 C  C5    . DT  B 1 7  ? 16.168 24.990 8.850   1.00 2.22  ? 19  DT  B C5    1 
ATOM   383 C  C7    . DT  B 1 7  ? 17.540 25.581 8.723   1.00 0.98  ? 19  DT  B C7    1 
ATOM   384 C  C6    . DT  B 1 7  ? 15.054 25.730 8.473   1.00 10.08 ? 19  DT  B C6    1 
ATOM   385 P  P     . DT  B 1 8  ? 9.444  28.787 9.701   1.00 13.93 ? 20  DT  B P     1 
ATOM   386 O  OP1   . DT  B 1 8  ? 8.070  29.322 9.440   1.00 2.91  ? 20  DT  B OP1   1 
ATOM   387 O  OP2   . DT  B 1 8  ? 10.376 29.719 10.381  1.00 6.11  ? 20  DT  B OP2   1 
ATOM   388 O  "O5'" . DT  B 1 8  ? 9.291  27.455 10.555  1.00 36.76 ? 20  DT  B "O5'" 1 
ATOM   389 C  "C5'" . DT  B 1 8  ? 8.387  26.440 10.094  1.00 42.01 ? 20  DT  B "C5'" 1 
ATOM   390 C  "C4'" . DT  B 1 8  ? 8.273  25.425 11.184  1.00 32.28 ? 20  DT  B "C4'" 1 
ATOM   391 O  "O4'" . DT  B 1 8  ? 9.513  24.732 11.306  1.00 15.73 ? 20  DT  B "O4'" 1 
ATOM   392 C  "C3'" . DT  B 1 8  ? 7.912  25.931 12.566  1.00 10.00 ? 20  DT  B "C3'" 1 
ATOM   393 O  "O3'" . DT  B 1 8  ? 6.904  25.110 13.131  1.00 10.00 ? 20  DT  B "O3'" 1 
ATOM   394 C  "C2'" . DT  B 1 8  ? 9.246  25.872 13.309  1.00 12.62 ? 20  DT  B "C2'" 1 
ATOM   395 C  "C1'" . DT  B 1 8  ? 9.857  24.637 12.686  1.00 10.00 ? 20  DT  B "C1'" 1 
ATOM   396 N  N1    . DT  B 1 8  ? 11.329 24.606 12.702  1.00 10.00 ? 20  DT  B N1    1 
ATOM   397 C  C2    . DT  B 1 8  ? 11.944 23.399 12.819  1.00 3.13  ? 20  DT  B C2    1 
ATOM   398 O  O2    . DT  B 1 8  ? 11.283 22.375 13.014  1.00 3.26  ? 20  DT  B O2    1 
ATOM   399 N  N3    . DT  B 1 8  ? 13.303 23.342 12.686  1.00 31.46 ? 20  DT  B N3    1 
ATOM   400 C  C4    . DT  B 1 8  ? 14.063 24.453 12.461  1.00 34.04 ? 20  DT  B C4    1 
ATOM   401 O  O4    . DT  B 1 8  ? 15.278 24.303 12.311  1.00 0.33  ? 20  DT  B O4    1 
ATOM   402 C  C5    . DT  B 1 8  ? 13.419 25.690 12.379  1.00 10.00 ? 20  DT  B C5    1 
ATOM   403 C  C7    . DT  B 1 8  ? 14.219 26.931 12.130  1.00 1.51  ? 20  DT  B C7    1 
ATOM   404 C  C6    . DT  B 1 8  ? 12.030 25.750 12.488  1.00 10.00 ? 20  DT  B C6    1 
ATOM   405 P  P     . DC  B 1 9  ? 6.291  25.372 14.580  1.00 12.57 ? 21  DC  B P     1 
ATOM   406 O  OP1   . DC  B 1 9  ? 4.978  24.700 14.615  1.00 6.85  ? 21  DC  B OP1   1 
ATOM   407 O  OP2   . DC  B 1 9  ? 6.314  26.808 14.932  1.00 41.31 ? 21  DC  B OP2   1 
ATOM   408 O  "O5'" . DC  B 1 9  ? 7.283  24.529 15.510  1.00 19.00 ? 21  DC  B "O5'" 1 
ATOM   409 C  "C5'" . DC  B 1 9  ? 7.476  23.129 15.206  1.00 40.63 ? 21  DC  B "C5'" 1 
ATOM   410 C  "C4'" . DC  B 1 9  ? 8.345  22.478 16.244  1.00 39.63 ? 21  DC  B "C4'" 1 
ATOM   411 O  "O4'" . DC  B 1 9  ? 9.723  22.707 15.948  1.00 1.19  ? 21  DC  B "O4'" 1 
ATOM   412 C  "C3'" . DC  B 1 9  ? 8.101  22.887 17.679  1.00 7.86  ? 21  DC  B "C3'" 1 
ATOM   413 O  "O3'" . DC  B 1 9  ? 7.205  21.950 18.335  1.00 8.20  ? 21  DC  B "O3'" 1 
ATOM   414 C  "C2'" . DC  B 1 9  ? 9.530  22.978 18.265  1.00 30.35 ? 21  DC  B "C2'" 1 
ATOM   415 C  "C1'" . DC  B 1 9  ? 10.479 22.529 17.143  1.00 10.00 ? 21  DC  B "C1'" 1 
ATOM   416 N  N1    . DC  B 1 9  ? 11.683 23.391 16.906  1.00 10.00 ? 21  DC  B N1    1 
ATOM   417 C  C2    . DC  B 1 9  ? 12.942 22.850 16.926  1.00 6.72  ? 21  DC  B C2    1 
ATOM   418 O  O2    . DC  B 1 9  ? 13.089 21.677 17.274  1.00 10.00 ? 21  DC  B O2    1 
ATOM   419 N  N3    . DC  B 1 9  ? 13.987 23.584 16.529  1.00 8.91  ? 21  DC  B N3    1 
ATOM   420 C  C4    . DC  B 1 9  ? 13.821 24.843 16.118  1.00 3.09  ? 21  DC  B C4    1 
ATOM   421 N  N4    . DC  B 1 9  ? 14.895 25.555 15.680  1.00 10.00 ? 21  DC  B N4    1 
ATOM   422 C  C5    . DC  B 1 9  ? 12.563 25.441 16.094  1.00 10.00 ? 21  DC  B C5    1 
ATOM   423 C  C6    . DC  B 1 9  ? 11.471 24.673 16.496  1.00 17.36 ? 21  DC  B C6    1 
ATOM   424 P  P     . DG  B 1 10 ? 6.801  22.045 19.889  1.00 7.98  ? 22  DG  B P     1 
ATOM   425 O  OP1   . DG  B 1 10 ? 5.662  21.144 20.158  1.00 12.17 ? 22  DG  B OP1   1 
ATOM   426 O  OP2   . DG  B 1 10 ? 6.621  23.462 20.265  1.00 35.28 ? 22  DG  B OP2   1 
ATOM   427 O  "O5'" . DG  B 1 10 ? 8.095  21.460 20.628  1.00 37.54 ? 22  DG  B "O5'" 1 
ATOM   428 C  "C5'" . DG  B 1 10 ? 8.427  20.062 20.527  1.00 43.28 ? 22  DG  B "C5'" 1 
ATOM   429 C  "C4'" . DG  B 1 10 ? 9.713  19.816 21.286  1.00 13.64 ? 22  DG  B "C4'" 1 
ATOM   430 O  "O4'" . DG  B 1 10 ? 10.780 20.565 20.677  1.00 4.07  ? 22  DG  B "O4'" 1 
ATOM   431 C  "C3'" . DG  B 1 10 ? 9.728  20.179 22.763  1.00 10.00 ? 22  DG  B "C3'" 1 
ATOM   432 O  "O3'" . DG  B 1 10 ? 10.400 19.196 23.554  1.00 18.11 ? 22  DG  B "O3'" 1 
ATOM   433 C  "C2'" . DG  B 1 10 ? 10.447 21.523 22.771  1.00 10.00 ? 22  DG  B "C2'" 1 
ATOM   434 C  "C1'" . DG  B 1 10 ? 11.501 21.254 21.710  1.00 14.93 ? 22  DG  B "C1'" 1 
ATOM   435 N  N9    . DG  B 1 10 ? 12.051 22.515 21.141  1.00 15.76 ? 22  DG  B N9    1 
ATOM   436 C  C8    . DG  B 1 10 ? 11.423 23.716 20.934  1.00 1.10  ? 22  DG  B C8    1 
ATOM   437 N  N7    . DG  B 1 10 ? 12.235 24.643 20.394  1.00 10.23 ? 22  DG  B N7    1 
ATOM   438 C  C5    . DG  B 1 10 ? 13.416 24.000 20.266  1.00 24.00 ? 22  DG  B C5    1 
ATOM   439 C  C6    . DG  B 1 10 ? 14.666 24.475 19.755  1.00 11.05 ? 22  DG  B C6    1 
ATOM   440 O  O6    . DG  B 1 10 ? 14.948 25.585 19.316  1.00 10.00 ? 22  DG  B O6    1 
ATOM   441 N  N1    . DG  B 1 10 ? 15.634 23.498 19.787  1.00 10.00 ? 22  DG  B N1    1 
ATOM   442 C  C2    . DG  B 1 10 ? 15.487 22.224 20.244  1.00 10.00 ? 22  DG  B C2    1 
ATOM   443 N  N2    . DG  B 1 10 ? 16.570 21.405 20.184  1.00 10.00 ? 22  DG  B N2    1 
ATOM   444 N  N3    . DG  B 1 10 ? 14.326 21.784 20.734  1.00 7.39  ? 22  DG  B N3    1 
ATOM   445 C  C4    . DG  B 1 10 ? 13.341 22.712 20.709  1.00 10.00 ? 22  DG  B C4    1 
ATOM   446 P  P     . DC  B 1 11 ? 9.907  18.909 25.045  1.00 10.98 ? 23  DC  B P     1 
ATOM   447 O  OP1   . DC  B 1 11 ? 8.931  17.796 24.989  1.00 33.23 ? 23  DC  B OP1   1 
ATOM   448 O  OP2   . DC  B 1 11 ? 9.428  20.150 25.684  1.00 10.75 ? 23  DC  B OP2   1 
ATOM   449 O  "O5'" . DC  B 1 11 ? 11.233 18.404 25.778  1.00 42.23 ? 23  DC  B "O5'" 1 
ATOM   450 C  "C5'" . DC  B 1 11 ? 11.864 17.175 25.361  1.00 41.73 ? 23  DC  B "C5'" 1 
ATOM   451 C  "C4'" . DC  B 1 11 ? 13.343 17.443 25.298  1.00 41.02 ? 23  DC  B "C4'" 1 
ATOM   452 O  "O4'" . DC  B 1 11 ? 13.561 18.459 24.307  1.00 7.42  ? 23  DC  B "O4'" 1 
ATOM   453 C  "C3'" . DC  B 1 11 ? 13.937 18.038 26.561  1.00 34.08 ? 23  DC  B "C3'" 1 
ATOM   454 O  "O3'" . DC  B 1 11 ? 14.198 17.053 27.580  1.00 1.47  ? 23  DC  B "O3'" 1 
ATOM   455 C  "C2'" . DC  B 1 11 ? 15.200 18.682 26.012  1.00 5.91  ? 23  DC  B "C2'" 1 
ATOM   456 C  "C1'" . DC  B 1 11 ? 14.804 19.115 24.610  1.00 8.37  ? 23  DC  B "C1'" 1 
ATOM   457 N  N1    . DC  B 1 11 ? 14.624 20.587 24.475  1.00 0.85  ? 23  DC  B N1    1 
ATOM   458 C  C2    . DC  B 1 11 ? 15.649 21.344 23.968  1.00 38.67 ? 23  DC  B C2    1 
ATOM   459 O  O2    . DC  B 1 11 ? 16.727 20.801 23.709  1.00 4.89  ? 23  DC  B O2    1 
ATOM   460 N  N3    . DC  B 1 11 ? 15.471 22.652 23.762  1.00 0.83  ? 23  DC  B N3    1 
ATOM   461 C  C4    . DC  B 1 11 ? 14.312 23.243 24.068  1.00 41.89 ? 23  DC  B C4    1 
ATOM   462 N  N4    . DC  B 1 11 ? 14.151 24.583 23.849  1.00 10.00 ? 23  DC  B N4    1 
ATOM   463 C  C5    . DC  B 1 11 ? 13.256 22.514 24.616  1.00 41.83 ? 23  DC  B C5    1 
ATOM   464 C  C6    . DC  B 1 11 ? 13.429 21.145 24.813  1.00 4.58  ? 23  DC  B C6    1 
ATOM   465 P  P     . DG  B 1 12 ? 14.412 17.496 29.103  1.00 33.37 ? 24  DG  B P     1 
ATOM   466 O  OP1   . DG  B 1 12 ? 14.339 16.312 29.981  1.00 42.21 ? 24  DG  B OP1   1 
ATOM   467 O  OP2   . DG  B 1 12 ? 13.450 18.557 29.423  1.00 19.11 ? 24  DG  B OP2   1 
ATOM   468 O  "O5'" . DG  B 1 12 ? 15.899 18.109 29.121  1.00 22.80 ? 24  DG  B "O5'" 1 
ATOM   469 C  "C5'" . DG  B 1 12 ? 17.032 17.346 28.624  1.00 42.00 ? 24  DG  B "C5'" 1 
ATOM   470 C  "C4'" . DG  B 1 12 ? 18.282 18.212 28.619  1.00 2.72  ? 24  DG  B "C4'" 1 
ATOM   471 O  "O4'" . DG  B 1 12 ? 18.316 19.037 27.442  1.00 10.00 ? 24  DG  B "O4'" 1 
ATOM   472 C  "C3'" . DG  B 1 12 ? 18.475 19.146 29.800  1.00 0.03  ? 24  DG  B "C3'" 1 
ATOM   473 O  "O3'" . DG  B 1 12 ? 19.092 18.497 30.930  1.00 11.28 ? 24  DG  B "O3'" 1 
ATOM   474 C  "C2'" . DG  B 1 12 ? 19.346 20.236 29.200  1.00 14.54 ? 24  DG  B "C2'" 1 
ATOM   475 C  "C1'" . DG  B 1 12 ? 18.817 20.345 27.780  1.00 24.03 ? 24  DG  B "C1'" 1 
ATOM   476 N  N9    . DG  B 1 12 ? 17.716 21.344 27.691  1.00 7.00  ? 24  DG  B N9    1 
ATOM   477 C  C8    . DG  B 1 12 ? 16.409 21.222 28.093  1.00 0.84  ? 24  DG  B C8    1 
ATOM   478 N  N7    . DG  B 1 12 ? 15.688 22.328 27.884  1.00 20.43 ? 24  DG  B N7    1 
ATOM   479 C  C5    . DG  B 1 12 ? 16.573 23.183 27.332  1.00 2.42  ? 24  DG  B C5    1 
ATOM   480 C  C6    . DG  B 1 12 ? 16.374 24.526 26.905  1.00 10.00 ? 24  DG  B C6    1 
ATOM   481 O  O6    . DG  B 1 12 ? 15.350 25.198 26.947  1.00 2.54  ? 24  DG  B O6    1 
ATOM   482 N  N1    . DG  B 1 12 ? 17.526 25.071 26.395  1.00 10.00 ? 24  DG  B N1    1 
ATOM   483 C  C2    . DG  B 1 12 ? 18.736 24.457 26.274  1.00 8.33  ? 24  DG  B C2    1 
ATOM   484 N  N2    . DG  B 1 12 ? 19.756 25.184 25.732  1.00 35.51 ? 24  DG  B N2    1 
ATOM   485 N  N3    . DG  B 1 12 ? 18.925 23.192 26.668  1.00 26.38 ? 24  DG  B N3    1 
ATOM   486 C  C4    . DG  B 1 12 ? 17.810 22.624 27.191  1.00 10.00 ? 24  DG  B C4    1 
HETATM 487 O  O1    A HT  C 2 .  ? 7.810  19.714 13.910  0.50 10.52 ? 25  HT  A O1    1 
HETATM 488 O  O1    B HT  C 2 .  ? 7.810  19.714 13.910  0.50 10.52 ? 25  HT  A O1    1 
HETATM 489 C  C1    A HT  C 2 .  ? 7.926  20.423 12.785  0.50 46.29 ? 25  HT  A C1    1 
HETATM 490 C  C1    B HT  C 2 .  ? 7.926  20.423 12.785  0.50 46.29 ? 25  HT  A C1    1 
HETATM 491 C  C4    A HT  C 2 .  ? 8.203  21.894 10.424  0.50 29.99 ? 25  HT  A C4    1 
HETATM 492 C  C4    B HT  C 2 .  ? 8.203  21.894 10.424  0.50 29.99 ? 25  HT  A C4    1 
HETATM 493 C  C2    A HT  C 2 .  ? 6.867  21.218 12.326  0.50 43.53 ? 25  HT  A C2    1 
HETATM 494 C  C2    B HT  C 2 .  ? 6.867  21.218 12.326  0.50 43.53 ? 25  HT  A C2    1 
HETATM 495 C  C3    A HT  C 2 .  ? 7.007  21.959 11.144  0.50 11.77 ? 25  HT  A C3    1 
HETATM 496 C  C3    B HT  C 2 .  ? 7.007  21.959 11.144  0.50 11.77 ? 25  HT  A C3    1 
HETATM 497 C  C6    A HT  C 2 .  ? 9.122  20.365 12.065  0.50 19.62 ? 25  HT  A C6    1 
HETATM 498 C  C6    B HT  C 2 .  ? 9.122  20.365 12.065  0.50 19.62 ? 25  HT  A C6    1 
HETATM 499 C  C5    A HT  C 2 .  ? 9.259  21.100 10.885  0.50 34.01 ? 25  HT  A C5    1 
HETATM 500 C  C5    B HT  C 2 .  ? 9.259  21.100 10.885  0.50 34.01 ? 25  HT  A C5    1 
HETATM 501 C  C7    A HT  C 2 .  ? 8.386  22.673 9.162   0.50 5.02  ? 25  HT  A C7    1 
HETATM 502 C  C7    B HT  C 2 .  ? 8.386  22.673 9.162   0.50 5.02  ? 25  HT  A C7    1 
HETATM 503 N  N1    A HT  C 2 .  ? 9.491  22.651 8.427   0.50 22.17 ? 25  HT  A N1    1 
HETATM 504 N  N1    B HT  C 2 .  ? 9.491  22.651 8.427   0.50 22.17 ? 25  HT  A N1    1 
HETATM 505 C  C8    A HT  C 2 .  ? 9.299  23.468 7.338   0.50 41.25 ? 25  HT  A C8    1 
HETATM 506 C  C8    B HT  C 2 .  ? 9.299  23.468 7.338   0.50 41.25 ? 25  HT  A C8    1 
HETATM 507 C  C9    A HT  C 2 .  ? 8.024  23.982 7.444   0.50 13.62 ? 25  HT  A C9    1 
HETATM 508 C  C9    B HT  C 2 .  ? 8.024  23.982 7.444   0.50 13.62 ? 25  HT  A C9    1 
HETATM 509 N  N2    A HT  C 2 .  ? 7.481  23.462 8.600   0.50 25.41 ? 25  HT  A N2    1 
HETATM 510 N  N2    B HT  C 2 .  ? 7.481  23.462 8.600   0.50 25.41 ? 25  HT  A N2    1 
HETATM 511 C  C10   A HT  C 2 .  ? 7.502  24.848 6.504   0.50 12.77 ? 25  HT  A C10   1 
HETATM 512 C  C10   B HT  C 2 .  ? 7.502  24.848 6.504   0.50 12.77 ? 25  HT  A C10   1 
HETATM 513 C  C11   A HT  C 2 .  ? 8.318  25.182 5.442   0.50 13.43 ? 25  HT  A C11   1 
HETATM 514 C  C11   B HT  C 2 .  ? 8.318  25.182 5.442   0.50 13.43 ? 25  HT  A C11   1 
HETATM 515 C  C12   A HT  C 2 .  ? 9.631  24.651 5.334   0.50 5.52  ? 25  HT  A C12   1 
HETATM 516 C  C12   B HT  C 2 .  ? 9.631  24.651 5.334   0.50 5.52  ? 25  HT  A C12   1 
HETATM 517 C  C13   A HT  C 2 .  ? 10.128 23.784 6.282   0.50 24.75 ? 25  HT  A C13   1 
HETATM 518 C  C13   B HT  C 2 .  ? 10.128 23.784 6.282   0.50 24.75 ? 25  HT  A C13   1 
HETATM 519 C  C14   A HT  C 2 .  ? 10.418 25.033 4.193   0.50 15.58 ? 25  HT  A C14   1 
HETATM 520 C  C14   B HT  C 2 .  ? 10.418 25.033 4.193   0.50 15.58 ? 25  HT  A C14   1 
HETATM 521 N  N3    A HT  C 2 .  ? 11.247 24.229 3.537   0.50 24.14 ? 25  HT  A N3    1 
HETATM 522 N  N3    B HT  C 2 .  ? 10.403 26.226 3.617   0.50 19.95 ? 25  HT  A N3    1 
HETATM 523 C  C15   A HT  C 2 .  ? 11.791 24.929 2.489   0.50 21.54 ? 25  HT  A C15   1 
HETATM 524 C  C15   B HT  C 2 .  ? 11.260 26.199 2.541   0.50 40.90 ? 25  HT  A C15   1 
HETATM 525 C  C16   A HT  C 2 .  ? 11.260 26.199 2.541   0.50 40.90 ? 25  HT  A C16   1 
HETATM 526 C  C16   B HT  C 2 .  ? 11.791 24.929 2.489   0.50 21.54 ? 25  HT  A C16   1 
HETATM 527 N  N4    A HT  C 2 .  ? 10.403 26.226 3.617   0.50 19.95 ? 25  HT  A N4    1 
HETATM 528 N  N4    B HT  C 2 .  ? 11.247 24.229 3.537   0.50 24.14 ? 25  HT  A N4    1 
HETATM 529 C  C17   A HT  C 2 .  ? 11.596 27.167 1.617   0.50 52.32 ? 25  HT  A C17   1 
HETATM 530 C  C17   B HT  C 2 .  ? 12.669 24.545 1.499   0.50 50.83 ? 25  HT  A C17   1 
HETATM 531 C  C18   A HT  C 2 .  ? 12.481 26.810 0.620   0.50 52.92 ? 25  HT  A C18   1 
HETATM 532 C  C18   B HT  C 2 .  ? 13.013 25.489 0.554   0.50 37.36 ? 25  HT  A C18   1 
HETATM 533 C  C19   A HT  C 2 .  ? 13.013 25.489 0.554   0.50 37.36 ? 25  HT  A C19   1 
HETATM 534 C  C19   B HT  C 2 .  ? 12.481 26.810 0.620   0.50 52.92 ? 25  HT  A C19   1 
HETATM 535 C  C20   A HT  C 2 .  ? 12.669 24.545 1.499   0.50 50.83 ? 25  HT  A C20   1 
HETATM 536 C  C20   B HT  C 2 .  ? 11.596 27.167 1.617   0.50 52.32 ? 25  HT  A C20   1 
HETATM 537 N  N5    A HT  C 2 .  ? 13.912 25.078 -0.588  0.50 52.23 ? 25  HT  A N5    1 
HETATM 538 N  N5    B HT  C 2 .  ? 12.877 27.825 -0.414  0.50 27.46 ? 25  HT  A N5    1 
HETATM 539 C  C21   A HT  C 2 .  ? 13.310 24.875 -1.908  0.50 6.76  ? 25  HT  A C21   1 
HETATM 540 C  C21   B HT  C 2 .  ? 11.823 28.322 -1.297  0.50 50.97 ? 25  HT  A C21   1 
HETATM 541 C  C22   A HT  C 2 .  ? 14.211 24.050 -2.814  0.50 27.06 ? 25  HT  A C22   1 
HETATM 542 C  C22   B HT  C 2 .  ? 12.430 29.026 -2.501  0.50 12.07 ? 25  HT  A C22   1 
HETATM 543 N  N6    A HT  C 2 .  ? 15.536 24.660 -2.932  0.50 29.02 ? 25  HT  A N6    1 
HETATM 544 N  N6    B HT  C 2 .  ? 13.259 30.152 -2.073  0.50 47.57 ? 25  HT  A N6    1 
HETATM 545 C  C23   A HT  C 2 .  ? 16.124 24.798 -1.603  0.50 10.00 ? 25  HT  A C23   1 
HETATM 546 C  C23   B HT  C 2 .  ? 14.295 29.681 -1.153  0.50 37.32 ? 25  HT  A C23   1 
HETATM 547 C  C24   A HT  C 2 .  ? 15.243 25.664 -0.722  0.50 34.13 ? 25  HT  A C24   1 
HETATM 548 C  C24   B HT  C 2 .  ? 13.675 28.966 0.038   0.50 36.40 ? 25  HT  A C24   1 
HETATM 549 C  C25   A HT  C 2 .  ? 16.393 23.876 -3.800  0.50 23.21 ? 25  HT  A C25   1 
HETATM 550 C  C25   B HT  C 2 .  ? 13.840 30.822 -3.220  0.50 41.50 ? 25  HT  A C25   1 
HETATM 551 MG MG    . MG  D 3 .  ? 10.700 10.023 13.050  1.00 5.62  ? 27  MG  A MG    1 
HETATM 552 O  O     . HOH E 4 .  ? 13.146 31.366 -6.186  1.00 14.59 ? 29  HOH A O     1 
HETATM 553 O  O     . HOH E 4 .  ? 21.084 24.553 13.576  1.00 13.61 ? 31  HOH A O     1 
HETATM 554 O  O     . HOH E 4 .  ? 23.297 31.774 13.775  1.00 20.02 ? 33  HOH A O     1 
HETATM 555 O  O     . HOH E 4 .  ? 1.016  15.971 14.014  1.00 10.53 ? 34  HOH A O     1 
HETATM 556 O  O     . HOH E 4 .  ? 20.376 14.595 10.540  1.00 19.80 ? 35  HOH A O     1 
HETATM 557 O  O     . HOH E 4 .  ? 14.877 6.424  7.159   1.00 6.65  ? 36  HOH A O     1 
HETATM 558 O  O     . HOH E 4 .  ? 6.953  15.679 0.437   1.00 13.95 ? 38  HOH A O     1 
HETATM 559 O  O     . HOH E 4 .  ? 14.349 6.740  13.452  1.00 8.76  ? 39  HOH A O     1 
HETATM 560 O  O     . HOH E 4 .  ? 22.030 19.573 12.130  1.00 19.19 ? 41  HOH A O     1 
HETATM 561 O  O     . HOH E 4 .  ? 9.866  10.007 4.489   1.00 21.15 ? 47  HOH A O     1 
HETATM 562 O  O     . HOH E 4 .  ? 8.366  13.202 2.721   1.00 18.49 ? 48  HOH A O     1 
HETATM 563 O  O     . HOH E 4 .  ? 21.060 9.684  13.427  1.00 25.42 ? 50  HOH A O     1 
HETATM 564 O  O     . HOH E 4 .  ? 19.750 3.864  8.178   1.00 30.72 ? 53  HOH A O     1 
HETATM 565 O  O     . HOH E 4 .  ? 15.726 11.828 7.693   1.00 12.66 ? 54  HOH A O     1 
HETATM 566 O  O     . HOH E 4 .  ? 16.276 5.930  3.174   1.00 26.61 ? 55  HOH A O     1 
HETATM 567 O  O     . HOH E 4 .  ? 12.605 31.994 -3.797  1.00 31.46 ? 56  HOH A O     1 
HETATM 568 O  O     . HOH E 4 .  ? 10.969 8.817  15.801  1.00 13.84 ? 58  HOH A O     1 
HETATM 569 O  O     . HOH E 4 .  ? 7.504  13.796 17.714  1.00 25.43 ? 59  HOH A O     1 
HETATM 570 O  O     . HOH E 4 .  ? 6.979  11.323 18.286  1.00 23.85 ? 60  HOH A O     1 
HETATM 571 O  O     . HOH E 4 .  ? 18.585 7.383  11.891  1.00 25.51 ? 61  HOH A O     1 
HETATM 572 O  O     . HOH E 4 .  ? 2.874  19.422 10.688  1.00 5.64  ? 62  HOH A O     1 
HETATM 573 O  O     . HOH E 4 .  ? 16.446 32.389 -3.737  1.00 16.36 ? 66  HOH A O     1 
HETATM 574 O  O     . HOH E 4 .  ? 3.975  16.845 1.119   1.00 36.04 ? 67  HOH A O     1 
HETATM 575 O  O     . HOH E 4 .  ? 16.551 0.894  1.303   1.00 12.02 ? 68  HOH A O     1 
HETATM 576 O  O     . HOH E 4 .  ? 2.429  12.482 4.009   1.00 30.06 ? 69  HOH A O     1 
HETATM 577 O  O     . HOH E 4 .  ? 12.772 17.697 18.601  1.00 3.94  ? 71  HOH A O     1 
HETATM 578 O  O     . HOH E 4 .  ? 9.981  19.404 14.617  1.00 7.97  ? 72  HOH A O     1 
HETATM 579 O  O     . HOH E 4 .  ? 7.849  18.201 16.231  1.00 17.66 ? 73  HOH A O     1 
HETATM 580 O  O     . HOH E 4 .  ? 10.886 17.659 16.391  1.00 13.47 ? 74  HOH A O     1 
HETATM 581 O  O     . HOH E 4 .  ? 1.885  22.890 -2.271  1.00 19.66 ? 76  HOH A O     1 
HETATM 582 O  O     . HOH E 4 .  ? 9.021  16.498 1.759   1.00 12.72 ? 77  HOH A O     1 
HETATM 583 O  O     . HOH E 4 .  ? 6.433  16.471 19.268  1.00 34.67 ? 81  HOH A O     1 
HETATM 584 O  O     . HOH E 4 .  ? 3.917  16.543 4.196   1.00 32.79 ? 85  HOH A O     1 
HETATM 585 O  O     . HOH E 4 .  ? 5.384  13.186 18.656  1.00 23.01 ? 86  HOH A O     1 
HETATM 586 O  O     . HOH E 4 .  ? 21.120 7.304  15.166  1.00 38.30 ? 90  HOH A O     1 
HETATM 587 O  O     . HOH E 4 .  ? 18.054 27.963 15.591  1.00 21.29 ? 91  HOH A O     1 
HETATM 588 O  O     . HOH E 4 .  ? 0.833  17.906 2.049   1.00 25.76 ? 93  HOH A O     1 
HETATM 589 O  O     . HOH E 4 .  ? 8.419  16.076 -2.438  1.00 27.89 ? 95  HOH A O     1 
HETATM 590 O  O     . HOH E 4 .  ? 12.868 12.305 5.520   1.00 20.53 ? 97  HOH A O     1 
HETATM 591 O  O     . HOH E 4 .  ? 1.753  15.683 6.144   1.00 38.34 ? 98  HOH A O     1 
HETATM 592 O  O     . HOH E 4 .  ? 18.823 1.462  6.481   1.00 22.29 ? 99  HOH A O     1 
HETATM 593 O  O     . HOH E 4 .  ? 7.416  14.315 14.990  1.00 13.75 ? 100 HOH A O     1 
HETATM 594 O  O     . HOH E 4 .  ? 20.682 28.849 16.223  1.00 15.17 ? 101 HOH A O     1 
HETATM 595 O  O     . HOH E 4 .  ? 14.073 8.965  3.084   1.00 15.89 ? 103 HOH A O     1 
HETATM 596 O  O     . HOH E 4 .  ? 21.999 28.210 13.985  1.00 32.55 ? 105 HOH A O     1 
HETATM 597 O  O     . HOH E 4 .  ? 5.068  26.223 7.803   1.00 22.40 ? 107 HOH A O     1 
HETATM 598 O  O     . HOH E 4 .  ? -0.218 18.808 8.671   1.00 35.42 ? 108 HOH A O     1 
HETATM 599 O  O     . HOH E 4 .  ? 16.586 12.852 10.349  1.00 7.73  ? 109 HOH A O     1 
HETATM 600 O  O     . HOH E 4 .  ? 0.480  21.155 12.481  1.00 21.28 ? 110 HOH A O     1 
HETATM 601 O  O     . HOH E 4 .  ? 18.021 2.075  3.285   1.00 32.10 ? 112 HOH A O     1 
HETATM 602 O  O     . HOH E 4 .  ? 18.108 9.741  6.182   1.00 25.18 ? 114 HOH A O     1 
HETATM 603 O  O     . HOH E 4 .  ? 0.791  21.656 6.822   1.00 32.84 ? 115 HOH A O     1 
HETATM 604 O  O     . HOH E 4 .  ? 0.279  16.531 8.944   1.00 33.82 ? 116 HOH A O     1 
HETATM 605 O  O     . HOH E 4 .  ? 26.164 16.088 17.901  1.00 29.22 ? 118 HOH A O     1 
HETATM 606 O  O     . HOH E 4 .  ? 14.229 33.576 -1.385  1.00 23.86 ? 119 HOH A O     1 
HETATM 607 O  O     . HOH E 4 .  ? 2.593  17.981 8.355   1.00 25.69 ? 120 HOH A O     1 
HETATM 608 O  O     . HOH E 4 .  ? 12.143 11.092 3.369   1.00 29.26 ? 121 HOH A O     1 
HETATM 609 O  O     . HOH E 4 .  ? 14.403 10.882 9.960   1.00 36.13 ? 123 HOH A O     1 
HETATM 610 O  O     . HOH E 4 .  ? 2.286  25.351 -0.784  1.00 32.01 ? 124 HOH A O     1 
HETATM 611 O  O     . HOH E 4 .  ? 6.417  15.768 4.395   1.00 40.69 ? 128 HOH A O     1 
HETATM 612 O  O     . HOH E 4 .  ? 11.837 4.292  6.060   1.00 34.45 ? 129 HOH A O     1 
HETATM 613 O  O     . HOH E 4 .  ? 17.141 5.807  13.076  1.00 15.61 ? 130 HOH A O     1 
HETATM 614 O  O     . HOH E 4 .  ? 20.303 4.784  14.631  1.00 24.27 ? 131 HOH A O     1 
HETATM 615 O  O     . HOH E 4 .  ? 21.963 11.044 16.144  1.00 24.12 ? 132 HOH A O     1 
HETATM 616 O  O     . HOH E 4 .  ? 5.830  12.419 2.096   1.00 40.24 ? 133 HOH A O     1 
HETATM 617 O  O     . HOH E 4 .  ? 10.004 13.729 4.183   1.00 18.35 ? 134 HOH A O     1 
HETATM 618 O  O     . HOH E 4 .  ? 17.388 10.217 11.770  1.00 24.79 ? 137 HOH A O     1 
HETATM 619 O  O     . HOH E 4 .  ? 7.278  11.352 14.600  1.00 39.17 ? 138 HOH A O     1 
HETATM 620 O  O     . HOH E 4 .  ? 20.928 12.894 9.032   1.00 33.20 ? 142 HOH A O     1 
HETATM 621 O  O     . HOH E 4 .  ? 17.375 15.478 9.899   1.00 15.68 ? 143 HOH A O     1 
HETATM 622 O  O     . HOH E 4 .  ? 18.970 26.315 12.300  1.00 31.25 ? 144 HOH A O     1 
HETATM 623 O  O     . HOH E 4 .  ? 5.332  12.903 13.603  1.00 35.24 ? 145 HOH A O     1 
HETATM 624 O  O     . HOH E 4 .  ? 18.681 3.937  5.320   1.00 26.71 ? 146 HOH A O     1 
HETATM 625 O  O     . HOH E 4 .  ? 13.954 16.213 20.967  1.00 24.73 ? 149 HOH A O     1 
HETATM 626 O  O     . HOH E 4 .  ? 17.933 8.606  14.443  1.00 28.65 ? 150 HOH A O     1 
HETATM 627 O  O     . HOH E 4 .  ? 9.931  12.884 18.368  1.00 36.10 ? 151 HOH A O     1 
HETATM 628 O  O     . HOH E 4 .  ? 13.407 7.639  15.270  1.00 29.35 ? 152 HOH A O     1 
HETATM 629 O  O     . HOH E 4 .  ? 15.755 5.521  5.087   1.00 21.50 ? 154 HOH A O     1 
HETATM 630 O  O     . HOH E 4 .  ? 24.373 23.933 7.847   1.00 33.78 ? 156 HOH A O     1 
HETATM 631 O  O     . HOH E 4 .  ? 11.722 8.442  10.036  1.00 33.45 ? 158 HOH A O     1 
HETATM 632 O  O     . HOH E 4 .  ? 22.576 14.636 12.506  1.00 41.48 ? 159 HOH A O     1 
HETATM 633 O  O     . HOH E 4 .  ? 11.898 15.001 19.969  1.00 39.53 ? 160 HOH A O     1 
HETATM 634 O  O     . HOH E 4 .  ? 13.327 5.382  4.139   1.00 30.97 ? 161 HOH A O     1 
HETATM 635 O  O     . HOH E 4 .  ? 3.878  24.156 9.223   1.00 39.79 ? 163 HOH A O     1 
HETATM 636 O  O     . HOH E 4 .  ? 22.425 16.284 10.504  1.00 32.74 ? 164 HOH A O     1 
HETATM 637 O  O     . HOH E 4 .  ? 20.176 14.922 12.462  1.00 19.46 ? 165 HOH A O     1 
HETATM 638 O  O     . HOH E 4 .  ? 27.633 14.632 20.099  1.00 39.93 ? 166 HOH A O     1 
HETATM 639 O  O     . HOH E 4 .  ? 23.623 17.851 14.152  1.00 25.65 ? 168 HOH A O     1 
HETATM 640 O  O     . HOH E 4 .  ? 3.641  14.812 12.471  1.00 32.85 ? 169 HOH A O     1 
HETATM 641 O  O     . HOH E 4 .  ? 13.471 7.934  6.806   1.00 33.08 ? 170 HOH A O     1 
HETATM 642 O  O     . HOH E 4 .  ? 18.228 30.328 12.025  1.00 40.15 ? 172 HOH A O     1 
HETATM 643 O  O     . HOH E 4 .  ? 3.801  14.614 0.181   1.00 37.66 ? 173 HOH A O     1 
HETATM 644 O  O     . HOH E 4 .  ? 2.137  18.502 4.103   1.00 23.28 ? 176 HOH A O     1 
HETATM 645 O  O     . HOH E 4 .  ? 1.869  23.075 4.532   1.00 41.47 ? 177 HOH A O     1 
HETATM 646 O  O     . HOH E 4 .  ? 19.096 7.141  4.352   1.00 27.31 ? 178 HOH A O     1 
HETATM 647 O  O     . HOH E 4 .  ? 17.008 10.185 4.323   1.00 37.20 ? 182 HOH A O     1 
HETATM 648 O  O     . HOH E 4 .  ? 16.690 3.677  7.376   1.00 40.77 ? 184 HOH A O     1 
HETATM 649 O  O     . HOH E 4 .  ? 21.849 22.158 11.473  1.00 34.80 ? 186 HOH A O     1 
HETATM 650 O  O     . HOH E 4 .  ? 12.658 9.441  12.689  1.00 27.50 ? 187 HOH A O     1 
HETATM 651 O  O     . HOH E 4 .  ? -0.455 24.326 -0.242  1.00 26.98 ? 188 HOH A O     1 
HETATM 652 O  O     . HOH E 4 .  ? 13.277 3.576  1.790   1.00 28.81 ? 190 HOH A O     1 
HETATM 653 O  O     . HOH E 4 .  ? 24.292 18.670 11.713  1.00 36.51 ? 193 HOH A O     1 
HETATM 654 O  O     . HOH E 4 .  ? 14.467 14.827 18.526  1.00 38.70 ? 194 HOH A O     1 
HETATM 655 O  O     . HOH E 4 .  ? 2.018  22.887 0.685   1.00 38.06 ? 195 HOH A O     1 
HETATM 656 O  O     . HOH E 4 .  ? 11.711 2.984  4.561   1.00 24.41 ? 196 HOH A O     1 
HETATM 657 O  O     . HOH E 4 .  ? 14.536 2.265  6.202   1.00 27.48 ? 197 HOH A O     1 
HETATM 658 O  O     . HOH E 4 .  ? 17.225 10.434 8.938   1.00 33.82 ? 198 HOH A O     1 
HETATM 659 O  O     . HOH E 4 .  ? 19.287 23.206 -13.550 1.00 13.97 ? 201 HOH A O     1 
HETATM 660 O  O     . HOH F 4 .  ? 8.750  29.010 1.700   1.00 20.77 ? 28  HOH B O     1 
HETATM 661 O  O     . HOH F 4 .  ? 20.357 19.533 8.131   1.00 15.32 ? 30  HOH B O     1 
HETATM 662 O  O     . HOH F 4 .  ? 12.370 30.708 13.387  1.00 21.71 ? 32  HOH B O     1 
HETATM 663 O  O     . HOH F 4 .  ? 20.007 26.993 5.364   1.00 13.63 ? 37  HOH B O     1 
HETATM 664 O  O     . HOH F 4 .  ? 2.706  30.757 11.766  1.00 21.11 ? 40  HOH B O     1 
HETATM 665 O  O     . HOH F 4 .  ? 20.758 33.569 11.198  1.00 8.70  ? 42  HOH B O     1 
HETATM 666 O  O     . HOH F 4 .  ? 20.272 21.431 10.223  1.00 30.43 ? 43  HOH B O     1 
HETATM 667 O  O     . HOH F 4 .  ? 23.081 28.651 10.060  1.00 5.83  ? 44  HOH B O     1 
HETATM 668 O  O     . HOH F 4 .  ? 20.278 28.491 8.044   1.00 23.21 ? 45  HOH B O     1 
HETATM 669 O  O     . HOH F 4 .  ? 18.171 14.768 5.477   1.00 19.81 ? 46  HOH B O     1 
HETATM 670 O  O     . HOH F 4 .  ? 4.291  17.475 15.944  1.00 16.20 ? 49  HOH B O     1 
HETATM 671 O  O     . HOH F 4 .  ? 1.166  26.846 11.363  1.00 15.54 ? 51  HOH B O     1 
HETATM 672 O  O     . HOH F 4 .  ? 9.466  30.681 12.309  1.00 24.26 ? 52  HOH B O     1 
HETATM 673 O  O     . HOH F 4 .  ? 9.224  12.822 -1.662  1.00 34.14 ? 57  HOH B O     1 
HETATM 674 O  O     . HOH F 4 .  ? 3.511  30.290 8.405   1.00 28.70 ? 63  HOH B O     1 
HETATM 675 O  O     . HOH F 4 .  ? 5.013  31.229 6.354   1.00 14.64 ? 64  HOH B O     1 
HETATM 676 O  O     . HOH F 4 .  ? 18.606 10.979 1.183   1.00 12.62 ? 65  HOH B O     1 
HETATM 677 O  O     . HOH F 4 .  ? 4.535  34.586 12.159  1.00 15.19 ? 70  HOH B O     1 
HETATM 678 O  O     . HOH F 4 .  ? 9.498  14.810 -0.731  1.00 32.01 ? 75  HOH B O     1 
HETATM 679 O  O     . HOH F 4 .  ? 15.695 33.978 6.169   1.00 17.52 ? 78  HOH B O     1 
HETATM 680 O  O     . HOH F 4 .  ? 17.664 32.392 7.793   1.00 16.06 ? 79  HOH B O     1 
HETATM 681 O  O     . HOH F 4 .  ? 12.186 34.093 9.834   1.00 5.72  ? 80  HOH B O     1 
HETATM 682 O  O     . HOH F 4 .  ? 3.468  20.181 13.996  1.00 16.83 ? 82  HOH B O     1 
HETATM 683 O  O     . HOH F 4 .  ? 14.737 14.193 1.518   1.00 14.86 ? 83  HOH B O     1 
HETATM 684 O  O     . HOH F 4 .  ? 16.931 13.547 2.416   1.00 28.22 ? 84  HOH B O     1 
HETATM 685 O  O     . HOH F 4 .  ? 23.555 17.170 7.360   1.00 25.95 ? 87  HOH B O     1 
HETATM 686 O  O     . HOH F 4 .  ? 19.609 37.252 10.312  1.00 19.17 ? 88  HOH B O     1 
HETATM 687 O  O     . HOH F 4 .  ? 21.491 39.161 10.990  1.00 20.65 ? 89  HOH B O     1 
HETATM 688 O  O     . HOH F 4 .  ? 23.891 10.441 0.451   1.00 21.94 ? 92  HOH B O     1 
HETATM 689 O  O     . HOH F 4 .  ? 12.247 33.151 2.102   1.00 34.47 ? 94  HOH B O     1 
HETATM 690 O  O     . HOH F 4 .  ? 23.012 15.760 2.758   1.00 25.05 ? 96  HOH B O     1 
HETATM 691 O  O     . HOH F 4 .  ? 10.248 31.510 2.701   1.00 34.82 ? 102 HOH B O     1 
HETATM 692 O  O     . HOH F 4 .  ? 8.889  7.957  -4.018  1.00 27.77 ? 104 HOH B O     1 
HETATM 693 O  O     . HOH F 4 .  ? 22.387 19.576 5.341   1.00 12.10 ? 106 HOH B O     1 
HETATM 694 O  O     . HOH F 4 .  ? 4.599  31.016 -0.081  1.00 28.85 ? 111 HOH B O     1 
HETATM 695 O  O     . HOH F 4 .  ? 19.631 29.256 4.236   1.00 40.67 ? 113 HOH B O     1 
HETATM 696 O  O     . HOH F 4 .  ? 5.030  29.550 13.909  1.00 38.16 ? 117 HOH B O     1 
HETATM 697 O  O     . HOH F 4 .  ? 21.808 17.319 5.512   1.00 25.02 ? 122 HOH B O     1 
HETATM 698 O  O     . HOH F 4 .  ? 16.878 28.820 13.967  1.00 31.64 ? 125 HOH B O     1 
HETATM 699 O  O     . HOH F 4 .  ? 23.812 21.198 3.982   1.00 13.75 ? 126 HOH B O     1 
HETATM 700 O  O     . HOH F 4 .  ? 10.798 11.260 -4.036  1.00 34.76 ? 127 HOH B O     1 
HETATM 701 O  O     . HOH F 4 .  ? 6.913  30.194 4.245   1.00 36.73 ? 135 HOH B O     1 
HETATM 702 O  O     . HOH F 4 .  ? 18.285 13.156 6.916   1.00 37.27 ? 136 HOH B O     1 
HETATM 703 O  O     . HOH F 4 .  ? 7.983  28.918 15.290  1.00 17.33 ? 139 HOH B O     1 
HETATM 704 O  O     . HOH F 4 .  ? 11.892 15.759 28.863  1.00 34.85 ? 140 HOH B O     1 
HETATM 705 O  O     . HOH F 4 .  ? 22.212 30.503 2.704   1.00 21.80 ? 141 HOH B O     1 
HETATM 706 O  O     . HOH F 4 .  ? 16.806 35.498 9.131   1.00 34.50 ? 147 HOH B O     1 
HETATM 707 O  O     . HOH F 4 .  ? 8.022  33.250 4.638   1.00 23.86 ? 148 HOH B O     1 
HETATM 708 O  O     . HOH F 4 .  ? 18.087 37.553 3.661   1.00 29.73 ? 153 HOH B O     1 
HETATM 709 O  O     . HOH F 4 .  ? 19.825 31.702 5.464   1.00 36.55 ? 155 HOH B O     1 
HETATM 710 O  O     . HOH F 4 .  ? 18.770 29.137 9.346   1.00 33.86 ? 157 HOH B O     1 
HETATM 711 O  O     . HOH F 4 .  ? 19.823 17.137 9.054   1.00 26.01 ? 162 HOH B O     1 
HETATM 712 O  O     . HOH F 4 .  ? -0.248 25.618 12.268  1.00 29.59 ? 167 HOH B O     1 
HETATM 713 O  O     . HOH F 4 .  ? 18.693 36.829 7.273   1.00 26.02 ? 171 HOH B O     1 
HETATM 714 O  O     . HOH F 4 .  ? 23.937 14.231 0.520   1.00 38.43 ? 174 HOH B O     1 
HETATM 715 O  O     . HOH F 4 .  ? 18.995 31.555 1.759   1.00 33.56 ? 175 HOH B O     1 
HETATM 716 O  O     . HOH F 4 .  ? 9.982  32.806 6.179   1.00 27.97 ? 179 HOH B O     1 
HETATM 717 O  O     . HOH F 4 .  ? 3.890  28.365 12.288  1.00 31.67 ? 180 HOH B O     1 
HETATM 718 O  O     . HOH F 4 .  ? 2.900  23.201 14.403  1.00 39.39 ? 181 HOH B O     1 
HETATM 719 O  O     . HOH F 4 .  ? 16.737 36.051 5.958   1.00 39.81 ? 183 HOH B O     1 
HETATM 720 O  O     . HOH F 4 .  ? 20.203 15.151 7.426   1.00 28.37 ? 185 HOH B O     1 
HETATM 721 O  O     . HOH F 4 .  ? 15.195 10.623 -0.950  1.00 31.13 ? 189 HOH B O     1 
HETATM 722 O  O     . HOH F 4 .  ? 4.749  31.325 2.586   1.00 42.60 ? 191 HOH B O     1 
HETATM 723 O  O     . HOH F 4 .  ? 10.681 18.916 28.459  1.00 29.54 ? 192 HOH B O     1 
HETATM 724 O  O     . HOH F 4 .  ? 6.642  32.035 11.861  1.00 29.11 ? 199 HOH B O     1 
HETATM 725 O  O     . HOH F 4 .  ? 17.550 17.248 3.168   1.00 35.79 ? 200 HOH B O     1 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1  DC 1  1  1  DC C A . n 
A 1 2  DG 2  2  2  DG G A . n 
A 1 3  DC 3  3  3  DC C A . n 
A 1 4  DG 4  4  4  DG G A . n 
A 1 5  DA 5  5  5  DA A A . n 
A 1 6  DA 6  6  6  DA A A . n 
A 1 7  DT 7  7  7  DT T A . n 
A 1 8  DT 8  8  8  DT T A . n 
A 1 9  DC 9  9  9  DC C A . n 
A 1 10 DG 10 10 10 DG G A . n 
A 1 11 DC 11 11 11 DC C A . n 
A 1 12 DG 12 12 12 DG G A . n 
B 1 1  DC 1  13 13 DC C B . n 
B 1 2  DG 2  14 14 DG G B . n 
B 1 3  DC 3  15 15 DC C B . n 
B 1 4  DG 4  16 16 DG G B . n 
B 1 5  DA 5  17 17 DA A B . n 
B 1 6  DA 6  18 18 DA A B . n 
B 1 7  DT 7  19 19 DT T B . n 
B 1 8  DT 8  20 20 DT T B . n 
B 1 9  DC 9  21 21 DC C B . n 
B 1 10 DG 10 22 22 DG G B . n 
B 1 11 DC 11 23 23 DC C B . n 
B 1 12 DG 12 24 24 DG G B . n 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
C 2 HT  1   25  25  HT  HT  A . 
D 3 MG  1   27  27  MG  MG  A . 
E 4 HOH 1   29  29  HOH HOH A . 
E 4 HOH 2   31  31  HOH HOH A . 
E 4 HOH 3   33  33  HOH HOH A . 
E 4 HOH 4   34  34  HOH HOH A . 
E 4 HOH 5   35  35  HOH HOH A . 
E 4 HOH 6   36  36  HOH HOH A . 
E 4 HOH 7   38  38  HOH HOH A . 
E 4 HOH 8   39  39  HOH HOH A . 
E 4 HOH 9   41  41  HOH HOH A . 
E 4 HOH 10  47  47  HOH HOH A . 
E 4 HOH 11  48  48  HOH HOH A . 
E 4 HOH 12  50  50  HOH HOH A . 
E 4 HOH 13  53  53  HOH HOH A . 
E 4 HOH 14  54  54  HOH HOH A . 
E 4 HOH 15  55  55  HOH HOH A . 
E 4 HOH 16  56  56  HOH HOH A . 
E 4 HOH 17  58  58  HOH HOH A . 
E 4 HOH 18  59  59  HOH HOH A . 
E 4 HOH 19  60  60  HOH HOH A . 
E 4 HOH 20  61  61  HOH HOH A . 
E 4 HOH 21  62  62  HOH HOH A . 
E 4 HOH 22  66  66  HOH HOH A . 
E 4 HOH 23  67  67  HOH HOH A . 
E 4 HOH 24  68  68  HOH HOH A . 
E 4 HOH 25  69  69  HOH HOH A . 
E 4 HOH 26  71  71  HOH HOH A . 
E 4 HOH 27  72  72  HOH HOH A . 
E 4 HOH 28  73  73  HOH HOH A . 
E 4 HOH 29  74  74  HOH HOH A . 
E 4 HOH 30  76  76  HOH HOH A . 
E 4 HOH 31  77  77  HOH HOH A . 
E 4 HOH 32  81  81  HOH HOH A . 
E 4 HOH 33  85  85  HOH HOH A . 
E 4 HOH 34  86  86  HOH HOH A . 
E 4 HOH 35  90  90  HOH HOH A . 
E 4 HOH 36  91  91  HOH HOH A . 
E 4 HOH 37  93  93  HOH HOH A . 
E 4 HOH 38  95  95  HOH HOH A . 
E 4 HOH 39  97  97  HOH HOH A . 
E 4 HOH 40  98  98  HOH HOH A . 
E 4 HOH 41  99  99  HOH HOH A . 
E 4 HOH 42  100 100 HOH HOH A . 
E 4 HOH 43  101 101 HOH HOH A . 
E 4 HOH 44  103 103 HOH HOH A . 
E 4 HOH 45  105 105 HOH HOH A . 
E 4 HOH 46  107 107 HOH HOH A . 
E 4 HOH 47  108 108 HOH HOH A . 
E 4 HOH 48  109 109 HOH HOH A . 
E 4 HOH 49  110 110 HOH HOH A . 
E 4 HOH 50  112 112 HOH HOH A . 
E 4 HOH 51  114 114 HOH HOH A . 
E 4 HOH 52  115 115 HOH HOH A . 
E 4 HOH 53  116 116 HOH HOH A . 
E 4 HOH 54  118 118 HOH HOH A . 
E 4 HOH 55  119 119 HOH HOH A . 
E 4 HOH 56  120 120 HOH HOH A . 
E 4 HOH 57  121 121 HOH HOH A . 
E 4 HOH 58  123 123 HOH HOH A . 
E 4 HOH 59  124 124 HOH HOH A . 
E 4 HOH 60  128 128 HOH HOH A . 
E 4 HOH 61  129 129 HOH HOH A . 
E 4 HOH 62  130 130 HOH HOH A . 
E 4 HOH 63  131 131 HOH HOH A . 
E 4 HOH 64  132 132 HOH HOH A . 
E 4 HOH 65  133 133 HOH HOH A . 
E 4 HOH 66  134 134 HOH HOH A . 
E 4 HOH 67  137 137 HOH HOH A . 
E 4 HOH 68  138 138 HOH HOH A . 
E 4 HOH 69  142 142 HOH HOH A . 
E 4 HOH 70  143 143 HOH HOH A . 
E 4 HOH 71  144 144 HOH HOH A . 
E 4 HOH 72  145 145 HOH HOH A . 
E 4 HOH 73  146 146 HOH HOH A . 
E 4 HOH 74  149 149 HOH HOH A . 
E 4 HOH 75  150 150 HOH HOH A . 
E 4 HOH 76  151 151 HOH HOH A . 
E 4 HOH 77  152 152 HOH HOH A . 
E 4 HOH 78  154 154 HOH HOH A . 
E 4 HOH 79  156 156 HOH HOH A . 
E 4 HOH 80  158 158 HOH HOH A . 
E 4 HOH 81  159 159 HOH HOH A . 
E 4 HOH 82  160 160 HOH HOH A . 
E 4 HOH 83  161 161 HOH HOH A . 
E 4 HOH 84  163 163 HOH HOH A . 
E 4 HOH 85  164 164 HOH HOH A . 
E 4 HOH 86  165 165 HOH HOH A . 
E 4 HOH 87  166 166 HOH HOH A . 
E 4 HOH 88  168 168 HOH HOH A . 
E 4 HOH 89  169 169 HOH HOH A . 
E 4 HOH 90  170 170 HOH HOH A . 
E 4 HOH 91  172 172 HOH HOH A . 
E 4 HOH 92  173 173 HOH HOH A . 
E 4 HOH 93  176 176 HOH HOH A . 
E 4 HOH 94  177 177 HOH HOH A . 
E 4 HOH 95  178 178 HOH HOH A . 
E 4 HOH 96  182 182 HOH HOH A . 
E 4 HOH 97  184 184 HOH HOH A . 
E 4 HOH 98  186 186 HOH HOH A . 
E 4 HOH 99  187 187 HOH HOH A . 
E 4 HOH 100 188 188 HOH HOH A . 
E 4 HOH 101 190 190 HOH HOH A . 
E 4 HOH 102 193 193 HOH HOH A . 
E 4 HOH 103 194 194 HOH HOH A . 
E 4 HOH 104 195 195 HOH HOH A . 
E 4 HOH 105 196 196 HOH HOH A . 
E 4 HOH 106 197 197 HOH HOH A . 
E 4 HOH 107 198 198 HOH HOH A . 
E 4 HOH 108 201 201 HOH HOH A . 
F 4 HOH 1   28  28  HOH HOH B . 
F 4 HOH 2   30  30  HOH HOH B . 
F 4 HOH 3   32  32  HOH HOH B . 
F 4 HOH 4   37  37  HOH HOH B . 
F 4 HOH 5   40  40  HOH HOH B . 
F 4 HOH 6   42  42  HOH HOH B . 
F 4 HOH 7   43  43  HOH HOH B . 
F 4 HOH 8   44  44  HOH HOH B . 
F 4 HOH 9   45  45  HOH HOH B . 
F 4 HOH 10  46  46  HOH HOH B . 
F 4 HOH 11  49  49  HOH HOH B . 
F 4 HOH 12  51  51  HOH HOH B . 
F 4 HOH 13  52  52  HOH HOH B . 
F 4 HOH 14  57  57  HOH HOH B . 
F 4 HOH 15  63  63  HOH HOH B . 
F 4 HOH 16  64  64  HOH HOH B . 
F 4 HOH 17  65  65  HOH HOH B . 
F 4 HOH 18  70  70  HOH HOH B . 
F 4 HOH 19  75  75  HOH HOH B . 
F 4 HOH 20  78  78  HOH HOH B . 
F 4 HOH 21  79  79  HOH HOH B . 
F 4 HOH 22  80  80  HOH HOH B . 
F 4 HOH 23  82  82  HOH HOH B . 
F 4 HOH 24  83  83  HOH HOH B . 
F 4 HOH 25  84  84  HOH HOH B . 
F 4 HOH 26  87  87  HOH HOH B . 
F 4 HOH 27  88  88  HOH HOH B . 
F 4 HOH 28  89  89  HOH HOH B . 
F 4 HOH 29  92  92  HOH HOH B . 
F 4 HOH 30  94  94  HOH HOH B . 
F 4 HOH 31  96  96  HOH HOH B . 
F 4 HOH 32  102 102 HOH HOH B . 
F 4 HOH 33  104 104 HOH HOH B . 
F 4 HOH 34  106 106 HOH HOH B . 
F 4 HOH 35  111 111 HOH HOH B . 
F 4 HOH 36  113 113 HOH HOH B . 
F 4 HOH 37  117 117 HOH HOH B . 
F 4 HOH 38  122 122 HOH HOH B . 
F 4 HOH 39  125 125 HOH HOH B . 
F 4 HOH 40  126 126 HOH HOH B . 
F 4 HOH 41  127 127 HOH HOH B . 
F 4 HOH 42  135 135 HOH HOH B . 
F 4 HOH 43  136 136 HOH HOH B . 
F 4 HOH 44  139 139 HOH HOH B . 
F 4 HOH 45  140 140 HOH HOH B . 
F 4 HOH 46  141 141 HOH HOH B . 
F 4 HOH 47  147 147 HOH HOH B . 
F 4 HOH 48  148 148 HOH HOH B . 
F 4 HOH 49  153 153 HOH HOH B . 
F 4 HOH 50  155 155 HOH HOH B . 
F 4 HOH 51  157 157 HOH HOH B . 
F 4 HOH 52  162 162 HOH HOH B . 
F 4 HOH 53  167 167 HOH HOH B . 
F 4 HOH 54  171 171 HOH HOH B . 
F 4 HOH 55  174 174 HOH HOH B . 
F 4 HOH 56  175 175 HOH HOH B . 
F 4 HOH 57  179 179 HOH HOH B . 
F 4 HOH 58  180 180 HOH HOH B . 
F 4 HOH 59  181 181 HOH HOH B . 
F 4 HOH 60  183 183 HOH HOH B . 
F 4 HOH 61  185 185 HOH HOH B . 
F 4 HOH 62  189 189 HOH HOH B . 
F 4 HOH 63  191 191 HOH HOH B . 
F 4 HOH 64  192 192 HOH HOH B . 
F 4 HOH 65  199 199 HOH HOH B . 
F 4 HOH 66  200 200 HOH HOH B . 
# 
_struct_site_keywords.site_id   1 
_struct_site_keywords.text      'MINOR GROOVE BINDER' 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   dimeric 
_pdbx_struct_assembly.oligomeric_count     2 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E,F 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
1 'Structure model' 1 0 1987-01-15 
2 'Structure model' 1 1 2008-05-22 
3 'Structure model' 1 2 2011-07-13 
4 'Structure model' 1 3 2014-07-02 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
# 
loop_
_pdbx_audit_revision_group.ordinal 
_pdbx_audit_revision_group.revision_ordinal 
_pdbx_audit_revision_group.data_content_type 
_pdbx_audit_revision_group.group 
1 2 'Structure model' 'Version format compliance' 
2 3 'Structure model' 'Version format compliance' 
3 4 'Structure model' Other                       
# 
loop_
_refine_B_iso.class 
_refine_B_iso.details 
_refine_B_iso.treatment 
_refine_B_iso.pdbx_refine_id 
'ALL ATOMS'      TR isotropic 'X-RAY DIFFRACTION' 
'ALL DRUG ATOMS' TR isotropic 'X-RAY DIFFRACTION' 
'ALL WATERS'     TR isotropic 'X-RAY DIFFRACTION' 
# 
loop_
_refine_occupancy.class 
_refine_occupancy.treatment 
_refine_occupancy.pdbx_refine_id 
'ALL ATOMS'      fix 'X-RAY DIFFRACTION' 
'ALL DRUG ATOMS' fix 'X-RAY DIFFRACTION' 
'ALL WATERS'     fix 'X-RAY DIFFRACTION' 
# 
_software.name             JACK-LEVITT 
_software.classification   refinement 
_software.version          . 
_software.citation_id      ? 
_software.pdbx_ordinal     1 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1  1 C25   A HT  25  ? B O A HOH 56  ? ? 1.80 
2  1 OP2   B DG  14  ? ? O B HOH 127 ? ? 1.83 
3  1 OP2   B DA  17  ? ? O B HOH 126 ? ? 1.94 
4  1 "C2'" A DG  12  ? ? O A HOH 201 ? ? 1.95 
5  1 O     A HOH 35  ? ? O A HOH 165 ? ? 1.96 
6  1 O     A HOH 129 ? ? O A HOH 196 ? ? 1.99 
7  1 O     A HOH 55  ? ? O A HOH 154 ? ? 2.02 
8  1 OP1   B DG  16  ? ? O B HOH 174 ? ? 2.08 
9  1 O     B HOH 51  ? ? O B HOH 167 ? ? 2.08 
10 1 OP2   B DA  18  ? ? O B HOH 37  ? ? 2.08 
11 1 O     A HOH 36  ? ? O A HOH 170 ? ? 2.09 
12 1 O     B HOH 45  ? ? O B HOH 157 ? ? 2.09 
13 1 OP1   A DT  8   ? ? O A HOH 120 ? ? 2.13 
14 1 O     A HOH 186 ? ? O B HOH 43  ? ? 2.14 
15 1 O     B HOH 46  ? ? O B HOH 136 ? ? 2.16 
16 1 OP2   A DA  5   ? ? O A HOH 165 ? ? 2.18 
17 1 O     A HOH 91  ? ? O B HOH 125 ? ? 2.18 
18 1 N7    B DG  16  ? ? O B HOH 200 ? ? 2.19 
# 
loop_
_pdbx_validate_symm_contact.id 
_pdbx_validate_symm_contact.PDB_model_num 
_pdbx_validate_symm_contact.auth_atom_id_1 
_pdbx_validate_symm_contact.auth_asym_id_1 
_pdbx_validate_symm_contact.auth_comp_id_1 
_pdbx_validate_symm_contact.auth_seq_id_1 
_pdbx_validate_symm_contact.PDB_ins_code_1 
_pdbx_validate_symm_contact.label_alt_id_1 
_pdbx_validate_symm_contact.site_symmetry_1 
_pdbx_validate_symm_contact.auth_atom_id_2 
_pdbx_validate_symm_contact.auth_asym_id_2 
_pdbx_validate_symm_contact.auth_comp_id_2 
_pdbx_validate_symm_contact.auth_seq_id_2 
_pdbx_validate_symm_contact.PDB_ins_code_2 
_pdbx_validate_symm_contact.label_alt_id_2 
_pdbx_validate_symm_contact.site_symmetry_2 
_pdbx_validate_symm_contact.dist 
1 1 OP2 A DG 12 ? ? 1_555 O B HOH 70  ? ? 4_565 1.69 
2 1 OP1 A DG 10 ? ? 1_555 O B HOH 175 ? ? 4_465 1.89 
# 
loop_
_pdbx_validate_rmsd_bond.id 
_pdbx_validate_rmsd_bond.PDB_model_num 
_pdbx_validate_rmsd_bond.auth_atom_id_1 
_pdbx_validate_rmsd_bond.auth_asym_id_1 
_pdbx_validate_rmsd_bond.auth_comp_id_1 
_pdbx_validate_rmsd_bond.auth_seq_id_1 
_pdbx_validate_rmsd_bond.PDB_ins_code_1 
_pdbx_validate_rmsd_bond.label_alt_id_1 
_pdbx_validate_rmsd_bond.auth_atom_id_2 
_pdbx_validate_rmsd_bond.auth_asym_id_2 
_pdbx_validate_rmsd_bond.auth_comp_id_2 
_pdbx_validate_rmsd_bond.auth_seq_id_2 
_pdbx_validate_rmsd_bond.PDB_ins_code_2 
_pdbx_validate_rmsd_bond.label_alt_id_2 
_pdbx_validate_rmsd_bond.bond_value 
_pdbx_validate_rmsd_bond.bond_target_value 
_pdbx_validate_rmsd_bond.bond_deviation 
_pdbx_validate_rmsd_bond.bond_standard_deviation 
_pdbx_validate_rmsd_bond.linker_flag 
1  1 C5 A DC 1  ? ? C6 A DC 1  ? ? 1.393 1.339 0.054  0.008 N 
2  1 C5 A DG 2  ? ? N7 A DG 2  ? ? 1.349 1.388 -0.039 0.006 N 
3  1 N7 A DG 2  ? ? C8 A DG 2  ? ? 1.344 1.305 0.039  0.006 N 
4  1 C5 A DC 3  ? ? C6 A DC 3  ? ? 1.391 1.339 0.052  0.008 N 
5  1 C5 A DG 4  ? ? N7 A DG 4  ? ? 1.352 1.388 -0.036 0.006 N 
6  1 N7 A DG 4  ? ? C8 A DG 4  ? ? 1.350 1.305 0.045  0.006 N 
7  1 C5 A DA 5  ? ? N7 A DA 5  ? ? 1.351 1.388 -0.037 0.006 N 
8  1 C5 A DA 6  ? ? N7 A DA 6  ? ? 1.346 1.388 -0.042 0.006 N 
9  1 C5 A DT 7  ? ? C6 A DT 7  ? ? 1.393 1.339 0.054  0.007 N 
10 1 C5 A DT 8  ? ? C6 A DT 8  ? ? 1.396 1.339 0.057  0.007 N 
11 1 C5 A DC 9  ? ? C6 A DC 9  ? ? 1.390 1.339 0.051  0.008 N 
12 1 C5 A DG 10 ? ? N7 A DG 10 ? ? 1.349 1.388 -0.039 0.006 N 
13 1 N7 A DG 10 ? ? C8 A DG 10 ? ? 1.343 1.305 0.038  0.006 N 
14 1 C5 A DC 11 ? ? C6 A DC 11 ? ? 1.391 1.339 0.052  0.008 N 
15 1 C5 A DG 12 ? ? N7 A DG 12 ? ? 1.348 1.388 -0.040 0.006 N 
16 1 C5 B DC 13 ? ? C6 B DC 13 ? ? 1.391 1.339 0.052  0.008 N 
17 1 C5 B DG 14 ? ? N7 B DG 14 ? ? 1.346 1.388 -0.042 0.006 N 
18 1 N7 B DG 14 ? ? C8 B DG 14 ? ? 1.342 1.305 0.037  0.006 N 
19 1 C5 B DC 15 ? ? C6 B DC 15 ? ? 1.395 1.339 0.056  0.008 N 
20 1 C5 B DG 16 ? ? N7 B DG 16 ? ? 1.349 1.388 -0.039 0.006 N 
21 1 N7 B DG 16 ? ? C8 B DG 16 ? ? 1.344 1.305 0.039  0.006 N 
22 1 C5 B DA 17 ? ? N7 B DA 17 ? ? 1.347 1.388 -0.041 0.006 N 
23 1 C5 B DT 19 ? ? C6 B DT 19 ? ? 1.390 1.339 0.051  0.007 N 
24 1 C5 B DT 20 ? ? C6 B DT 20 ? ? 1.395 1.339 0.056  0.007 N 
25 1 C5 B DC 21 ? ? C6 B DC 21 ? ? 1.394 1.339 0.055  0.008 N 
26 1 C5 B DG 22 ? ? N7 B DG 22 ? ? 1.351 1.388 -0.037 0.006 N 
27 1 N7 B DG 22 ? ? C8 B DG 22 ? ? 1.345 1.305 0.040  0.006 N 
28 1 C5 B DC 23 ? ? C6 B DC 23 ? ? 1.394 1.339 0.055  0.008 N 
29 1 C5 B DG 24 ? ? N7 B DG 24 ? ? 1.349 1.388 -0.039 0.006 N 
# 
loop_
_pdbx_validate_rmsd_angle.id 
_pdbx_validate_rmsd_angle.PDB_model_num 
_pdbx_validate_rmsd_angle.auth_atom_id_1 
_pdbx_validate_rmsd_angle.auth_asym_id_1 
_pdbx_validate_rmsd_angle.auth_comp_id_1 
_pdbx_validate_rmsd_angle.auth_seq_id_1 
_pdbx_validate_rmsd_angle.PDB_ins_code_1 
_pdbx_validate_rmsd_angle.label_alt_id_1 
_pdbx_validate_rmsd_angle.auth_atom_id_2 
_pdbx_validate_rmsd_angle.auth_asym_id_2 
_pdbx_validate_rmsd_angle.auth_comp_id_2 
_pdbx_validate_rmsd_angle.auth_seq_id_2 
_pdbx_validate_rmsd_angle.PDB_ins_code_2 
_pdbx_validate_rmsd_angle.label_alt_id_2 
_pdbx_validate_rmsd_angle.auth_atom_id_3 
_pdbx_validate_rmsd_angle.auth_asym_id_3 
_pdbx_validate_rmsd_angle.auth_comp_id_3 
_pdbx_validate_rmsd_angle.auth_seq_id_3 
_pdbx_validate_rmsd_angle.PDB_ins_code_3 
_pdbx_validate_rmsd_angle.label_alt_id_3 
_pdbx_validate_rmsd_angle.angle_value 
_pdbx_validate_rmsd_angle.angle_target_value 
_pdbx_validate_rmsd_angle.angle_deviation 
_pdbx_validate_rmsd_angle.angle_standard_deviation 
_pdbx_validate_rmsd_angle.linker_flag 
1  1 "O5'" A DG 4  ? ? "C5'" A DG 4  ? ? "C4'" A DG 4  ? ? 102.63 109.40 -6.77 0.80 N 
2  1 N1    A DT 7  ? ? C2    A DT 7  ? ? N3    A DT 7  ? ? 118.93 114.60 4.33  0.60 N 
3  1 C2    A DT 7  ? ? N3    A DT 7  ? ? C4    A DT 7  ? ? 122.23 127.20 -4.97 0.60 N 
4  1 C5    A DT 7  ? ? C6    A DT 7  ? ? N1    A DT 7  ? ? 119.16 123.70 -4.54 0.60 N 
5  1 N1    A DT 8  ? ? C2    A DT 8  ? ? N3    A DT 8  ? ? 118.77 114.60 4.17  0.60 N 
6  1 C2    A DT 8  ? ? N3    A DT 8  ? ? C4    A DT 8  ? ? 122.60 127.20 -4.60 0.60 N 
7  1 C5    A DT 8  ? ? C6    A DT 8  ? ? N1    A DT 8  ? ? 119.41 123.70 -4.29 0.60 N 
8  1 "O4'" B DA 17 ? ? "C1'" B DA 17 ? ? N9    B DA 17 ? ? 110.26 108.30 1.96  0.30 N 
9  1 "C1'" B DT 19 ? ? "O4'" B DT 19 ? ? "C4'" B DT 19 ? ? 103.44 110.10 -6.66 1.00 N 
10 1 N1    B DT 19 ? ? C2    B DT 19 ? ? N3    B DT 19 ? ? 118.51 114.60 3.91  0.60 N 
11 1 C2    B DT 19 ? ? N3    B DT 19 ? ? C4    B DT 19 ? ? 122.32 127.20 -4.88 0.60 N 
12 1 C5    B DT 19 ? ? C6    B DT 19 ? ? N1    B DT 19 ? ? 119.41 123.70 -4.29 0.60 N 
13 1 N1    B DT 20 ? ? C2    B DT 20 ? ? N3    B DT 20 ? ? 118.58 114.60 3.98  0.60 N 
14 1 C2    B DT 20 ? ? N3    B DT 20 ? ? C4    B DT 20 ? ? 122.40 127.20 -4.80 0.60 N 
15 1 C5    B DT 20 ? ? C6    B DT 20 ? ? N1    B DT 20 ? ? 119.34 123.70 -4.36 0.60 N 
16 1 "O4'" B DC 21 ? ? "C1'" B DC 21 ? ? N1    B DC 21 ? ? 102.80 108.00 -5.20 0.70 N 
# 
_pdbx_validate_planes.id              1 
_pdbx_validate_planes.PDB_model_num   1 
_pdbx_validate_planes.auth_comp_id    DC 
_pdbx_validate_planes.auth_asym_id    B 
_pdbx_validate_planes.auth_seq_id     21 
_pdbx_validate_planes.PDB_ins_code    ? 
_pdbx_validate_planes.label_alt_id    ? 
_pdbx_validate_planes.rmsd            0.056 
_pdbx_validate_planes.type            'SIDE CHAIN' 
# 
_ndb_struct_conf_na.entry_id   8BNA 
_ndb_struct_conf_na.feature    'b-form double helix' 
# 
loop_
_ndb_struct_na_base_pair.model_number 
_ndb_struct_na_base_pair.i_label_asym_id 
_ndb_struct_na_base_pair.i_label_comp_id 
_ndb_struct_na_base_pair.i_label_seq_id 
_ndb_struct_na_base_pair.i_symmetry 
_ndb_struct_na_base_pair.j_label_asym_id 
_ndb_struct_na_base_pair.j_label_comp_id 
_ndb_struct_na_base_pair.j_label_seq_id 
_ndb_struct_na_base_pair.j_symmetry 
_ndb_struct_na_base_pair.shear 
_ndb_struct_na_base_pair.stretch 
_ndb_struct_na_base_pair.stagger 
_ndb_struct_na_base_pair.buckle 
_ndb_struct_na_base_pair.propeller 
_ndb_struct_na_base_pair.opening 
_ndb_struct_na_base_pair.pair_number 
_ndb_struct_na_base_pair.pair_name 
_ndb_struct_na_base_pair.i_auth_asym_id 
_ndb_struct_na_base_pair.i_auth_seq_id 
_ndb_struct_na_base_pair.i_PDB_ins_code 
_ndb_struct_na_base_pair.j_auth_asym_id 
_ndb_struct_na_base_pair.j_auth_seq_id 
_ndb_struct_na_base_pair.j_PDB_ins_code 
_ndb_struct_na_base_pair.hbond_type_28 
_ndb_struct_na_base_pair.hbond_type_12 
1 A DC 1  1_555 B DG 12 1_555 -0.070 0.128  0.043  7.649   -18.814 -2.750 1  A_DC1:DG24_B  A 1  ? B 24 ? 19 1 
1 A DG 2  1_555 B DC 11 1_555 -0.050 0.022  0.197  -1.035  -19.851 -4.273 2  A_DG2:DC23_B  A 2  ? B 23 ? 19 1 
1 A DC 3  1_555 B DG 10 1_555 0.138  -0.092 0.446  -7.107  -19.688 0.930  3  A_DC3:DG22_B  A 3  ? B 22 ? 19 1 
1 A DG 4  1_555 B DC 9  1_555 -1.214 -0.248 0.249  11.422  -7.855  -3.117 4  A_DG4:DC21_B  A 4  ? B 21 ? 19 1 
1 A DA 5  1_555 B DT 8  1_555 0.056  0.244  -0.560 -0.551  -19.687 1.165  5  A_DA5:DT20_B  A 5  ? B 20 ? 20 1 
1 A DA 6  1_555 B DT 7  1_555 -0.534 -0.078 0.440  1.257   -22.780 0.850  6  A_DA6:DT19_B  A 6  ? B 19 ? 20 1 
1 A DT 7  1_555 B DA 6  1_555 1.038  0.143  0.402  -5.660  -21.213 11.064 7  A_DT7:DA18_B  A 7  ? B 18 ? ?  1 
1 A DT 8  1_555 B DA 5  1_555 -0.012 -0.166 0.060  -10.683 -21.357 -3.015 8  A_DT8:DA17_B  A 8  ? B 17 ? 20 1 
1 A DC 9  1_555 B DG 4  1_555 -0.083 -0.037 -0.005 -12.390 -14.430 -4.999 9  A_DC9:DG16_B  A 9  ? B 16 ? 19 1 
1 A DG 10 1_555 B DC 3  1_555 0.075  -0.084 -0.473 -4.959  -8.818  3.673  10 A_DG10:DC15_B A 10 ? B 15 ? 19 1 
1 A DC 11 1_555 B DG 2  1_555 0.094  0.106  0.302  4.598   -27.091 -3.623 11 A_DC11:DG14_B A 11 ? B 14 ? 19 1 
1 A DG 12 1_555 B DC 1  1_555 -0.325 -0.030 0.045  9.513   3.282   -5.199 12 A_DG12:DC13_B A 12 ? B 13 ? 19 1 
# 
loop_
_ndb_struct_na_base_pair_step.model_number 
_ndb_struct_na_base_pair_step.i_label_asym_id_1 
_ndb_struct_na_base_pair_step.i_label_comp_id_1 
_ndb_struct_na_base_pair_step.i_label_seq_id_1 
_ndb_struct_na_base_pair_step.i_symmetry_1 
_ndb_struct_na_base_pair_step.j_label_asym_id_1 
_ndb_struct_na_base_pair_step.j_label_comp_id_1 
_ndb_struct_na_base_pair_step.j_label_seq_id_1 
_ndb_struct_na_base_pair_step.j_symmetry_1 
_ndb_struct_na_base_pair_step.i_label_asym_id_2 
_ndb_struct_na_base_pair_step.i_label_comp_id_2 
_ndb_struct_na_base_pair_step.i_label_seq_id_2 
_ndb_struct_na_base_pair_step.i_symmetry_2 
_ndb_struct_na_base_pair_step.j_label_asym_id_2 
_ndb_struct_na_base_pair_step.j_label_comp_id_2 
_ndb_struct_na_base_pair_step.j_label_seq_id_2 
_ndb_struct_na_base_pair_step.j_symmetry_2 
_ndb_struct_na_base_pair_step.shift 
_ndb_struct_na_base_pair_step.slide 
_ndb_struct_na_base_pair_step.rise 
_ndb_struct_na_base_pair_step.tilt 
_ndb_struct_na_base_pair_step.roll 
_ndb_struct_na_base_pair_step.twist 
_ndb_struct_na_base_pair_step.x_displacement 
_ndb_struct_na_base_pair_step.y_displacement 
_ndb_struct_na_base_pair_step.helical_rise 
_ndb_struct_na_base_pair_step.inclination 
_ndb_struct_na_base_pair_step.tip 
_ndb_struct_na_base_pair_step.helical_twist 
_ndb_struct_na_base_pair_step.step_number 
_ndb_struct_na_base_pair_step.step_name 
_ndb_struct_na_base_pair_step.i_auth_asym_id_1 
_ndb_struct_na_base_pair_step.i_auth_seq_id_1 
_ndb_struct_na_base_pair_step.i_PDB_ins_code_1 
_ndb_struct_na_base_pair_step.j_auth_asym_id_1 
_ndb_struct_na_base_pair_step.j_auth_seq_id_1 
_ndb_struct_na_base_pair_step.j_PDB_ins_code_1 
_ndb_struct_na_base_pair_step.i_auth_asym_id_2 
_ndb_struct_na_base_pair_step.i_auth_seq_id_2 
_ndb_struct_na_base_pair_step.i_PDB_ins_code_2 
_ndb_struct_na_base_pair_step.j_auth_asym_id_2 
_ndb_struct_na_base_pair_step.j_auth_seq_id_2 
_ndb_struct_na_base_pair_step.j_PDB_ins_code_2 
1 A DC 1  1_555 B DG 12 1_555 A DG 2  1_555 B DC 11 1_555 -0.406 0.060  3.677 -3.701 8.616   36.245 -1.192 0.081  3.619 13.572  
5.830  37.399 1  AA_DC1DG2:DC23DG24_BB   A 1  ? B 24 ? A 2  ? B 23 ? 
1 A DG 2  1_555 B DC 11 1_555 A DC 3  1_555 B DG 10 1_555 1.041  0.520  3.532 2.837  -9.225  37.921 1.969  -1.189 3.385 -13.922 
-4.281 39.087 2  AA_DG2DC3:DG22DC23_BB   A 2  ? B 23 ? A 3  ? B 22 ? 
1 A DC 3  1_555 B DG 10 1_555 A DG 4  1_555 B DC 9  1_555 -0.216 0.681  3.017 3.962  5.657   24.677 0.026  1.543  3.024 12.916  
-9.045 25.611 3  AA_DC3DG4:DC21DG22_BB   A 3  ? B 22 ? A 4  ? B 21 ? 
1 A DG 4  1_555 B DC 9  1_555 A DA 5  1_555 B DT 8  1_555 -0.253 -0.065 3.788 4.388  6.750   41.736 -0.880 0.863  3.691 9.370   
-6.091 42.471 4  AA_DG4DA5:DT20DC21_BB   A 4  ? B 21 ? A 5  ? B 20 ? 
1 A DA 5  1_555 B DT 8  1_555 A DA 6  1_555 B DT 7  1_555 0.330  -0.253 2.995 -7.810 3.836   36.443 -0.849 -1.441 2.827 6.028   
12.275 37.433 5  AA_DA5DA6:DT19DT20_BB   A 5  ? B 20 ? A 6  ? B 19 ? 
1 A DA 6  1_555 B DT 7  1_555 A DT 7  1_555 B DA 6  1_555 0.486  -0.510 3.539 0.853  1.308   38.310 -0.954 -0.625 3.530 1.992   
-1.299 38.340 6  AA_DA6DT7:DA18DT19_BB   A 6  ? B 19 ? A 7  ? B 18 ? 
1 A DT 7  1_555 B DA 6  1_555 A DT 8  1_555 B DA 5  1_555 -1.059 -0.130 3.308 1.918  3.561   30.428 -0.946 2.377  3.201 6.747   
-3.635 30.689 7  AA_DT7DT8:DA17DA18_BB   A 7  ? B 18 ? A 8  ? B 17 ? 
1 A DT 8  1_555 B DA 5  1_555 A DC 9  1_555 B DG 4  1_555 -0.093 0.157  3.324 -0.814 -3.612  37.583 0.716  0.037  3.297 -5.590  
1.260  37.758 8  AA_DT8DC9:DG16DA17_BB   A 8  ? B 17 ? A 9  ? B 16 ? 
1 A DC 9  1_555 B DG 4  1_555 A DG 10 1_555 B DC 3  1_555 0.377  1.406  3.423 1.488  6.687   30.727 1.224  -0.391 3.654 12.427  
-2.764 31.463 9  AA_DC9DG10:DC15DG16_BB  A 9  ? B 16 ? A 10 ? B 15 ? 
1 A DG 10 1_555 B DC 3  1_555 A DC 11 1_555 B DG 2  1_555 -0.970 0.967  3.237 -8.066 -12.308 40.549 2.509  0.542  2.968 -17.094 
11.202 43.031 10 AA_DG10DC11:DG14DC15_BB A 10 ? B 15 ? A 11 ? B 14 ? 
1 A DC 11 1_555 B DG 2  1_555 A DG 12 1_555 B DC 1  1_555 0.451  0.906  3.439 4.362  -2.218  37.847 1.680  -0.110 3.412 -3.402  
-6.691 38.151 11 AA_DC11DG12:DC13DG14_BB A 11 ? B 14 ? A 12 ? B 13 ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 "2'-(4-HYDROXYPHENYL)-5-(4-METHYL-1-PIPERAZINYL)-2,5'-BI-BENZIMIDAZOLE" HT  
3 'MAGNESIUM ION'                                                         MG  
4 water                                                                   HOH 
# 
