data_9KHW
# 
_entry.id   9KHW 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.402 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   9KHW         pdb_00009khw 10.2210/pdb9khw/pdb 
WWPDB D_1300053210 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2025-04-02 
_pdbx_audit_revision_history.part_number         ? 
# 
_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         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9KHW 
_pdbx_database_status.recvd_initial_deposition_date   2024-11-11 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBJ 
_pdbx_database_status.process_site                    PDBJ 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
loop_
_pdbx_contact_author.id 
_pdbx_contact_author.email 
_pdbx_contact_author.name_first 
_pdbx_contact_author.name_last 
_pdbx_contact_author.name_mi 
_pdbx_contact_author.role 
_pdbx_contact_author.identifier_ORCID 
3 j.kondo@sophia.ac.jp Kondo Jiro  ? 'principal investigator/group leader' 0000-0002-5682-3685 
4 tom@chem.ku.dk       Tom   Vosch ? 'principal investigator/group leader' 0000-0001-5435-2181 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Kanazawa, H.'  1 ? 
'Kondo, J.'     2 ? 
'Romolini, G.'  3 ? 
'Cerretani, C.' 4 ? 
'Lanza, A.'     5 ? 
'Huang, Z.'     6 ? 
'Vosch, T.'     7 ? 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   DE 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Small Struct' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2688-4062 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     'Shining Bright at 960 nm: A 28-Silver-Atom Nanorod Stabilized by DNA' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1002/sstr.202500022 
_citation.pdbx_database_id_PubMed   ? 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Romolini, G.'  1 ? 
primary 'Kanazawa, H.'  2 ? 
primary 'Mollerup, C.'  3 ? 
primary 'Lisberg, M.'   4 ? 
primary 'Lind, S.'      5 ? 
primary 'Huang, Z.'     6 ? 
primary 'Cerretani, C.' 7 ? 
primary 'Kondo, J.'     8 ? 
primary 'Vosch, T.'     9 ? 
# 
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*CP*GP*CP*GP*CP*GP*CP*GP*CP*CP*GP*CP*GP*AP*A)-3')
;
4870.146 2  ? ? ? ? 
2 non-polymer syn 'SILVER ION'                                                     107.868  28 ? ? ? ? 
3 non-polymer syn 'CHLORIDE ION'                                                   35.453   2  ? ? ? ? 
4 water       nat water                                                            18.015   39 ? ? ? ? 
# 
_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)(DC)(DG)(DC)(DG)(DC)(DG)(DC)(DG)(DC)(DC)(DG)(DC)(DG)(DA)(DA)' 
_entity_poly.pdbx_seq_one_letter_code_can   CCGCGCGCGCCGCGAA 
_entity_poly.pdbx_strand_id                 A,B 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 'SILVER ION'   AG  
3 'CHLORIDE ION' CL  
4 water          HOH 
# 
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  DC n 
1 3  DG n 
1 4  DC n 
1 5  DG n 
1 6  DC n 
1 7  DG n 
1 8  DC n 
1 9  DG n 
1 10 DC n 
1 11 DC n 
1 12 DG n 
1 13 DC n 
1 14 DG n 
1 15 DA n 
1 16 DA n 
# 
_pdbx_entity_src_syn.entity_id              1 
_pdbx_entity_src_syn.pdbx_src_id            1 
_pdbx_entity_src_syn.pdbx_alt_source_flag   sample 
_pdbx_entity_src_syn.pdbx_beg_seq_num       1 
_pdbx_entity_src_syn.pdbx_end_seq_num       16 
_pdbx_entity_src_syn.organism_scientific    'synthetic construct' 
_pdbx_entity_src_syn.organism_common_name   ? 
_pdbx_entity_src_syn.ncbi_taxonomy_id       32630 
_pdbx_entity_src_syn.details                ? 
# 
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 
AG  non-polymer   . 'SILVER ION'                         ? 'Ag 1'            107.868 
CL  non-polymer   . 'CHLORIDE ION'                       ? 'Cl -1'           35.453  
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 
HOH non-polymer   . WATER                                ? 'H2 O'            18.015  
# 
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 DC A . n 
A 1 2  DC 2  2  2  DC DC A . n 
A 1 3  DG 3  3  3  DG DG A . n 
A 1 4  DC 4  4  4  DC DC A . n 
A 1 5  DG 5  5  5  DG DG A . n 
A 1 6  DC 6  6  6  DC DC A . n 
A 1 7  DG 7  7  7  DG DG A . n 
A 1 8  DC 8  8  8  DC DC A . n 
A 1 9  DG 9  9  9  DG DG A . n 
A 1 10 DC 10 10 10 DC DC A . n 
A 1 11 DC 11 11 11 DC DC A . n 
A 1 12 DG 12 12 12 DG DG A . n 
A 1 13 DC 13 13 13 DC DC A . n 
A 1 14 DG 14 14 14 DG DG A . n 
A 1 15 DA 15 15 15 DA DA A . n 
A 1 16 DA 16 16 16 DA DA A . n 
B 1 1  DC 1  1  1  DC DC B . n 
B 1 2  DC 2  2  2  DC DC B . n 
B 1 3  DG 3  3  3  DG DG B . n 
B 1 4  DC 4  4  4  DC DC B . n 
B 1 5  DG 5  5  5  DG DG B . n 
B 1 6  DC 6  6  6  DC DC B . n 
B 1 7  DG 7  7  7  DG DG B . n 
B 1 8  DC 8  8  8  DC DC B . n 
B 1 9  DG 9  9  9  DG DG B . n 
B 1 10 DC 10 10 10 DC DC B . n 
B 1 11 DC 11 11 11 DC DC B . n 
B 1 12 DG 12 12 12 DG DG B . n 
B 1 13 DC 13 13 13 DC DC B . n 
B 1 14 DG 14 14 14 DG DG B . n 
B 1 15 DA 15 15 15 DA DA B . n 
B 1 16 DA 16 16 16 DA DA B . n 
# 
loop_
_pdbx_entity_instance_feature.ordinal 
_pdbx_entity_instance_feature.comp_id 
_pdbx_entity_instance_feature.asym_id 
_pdbx_entity_instance_feature.seq_num 
_pdbx_entity_instance_feature.auth_comp_id 
_pdbx_entity_instance_feature.auth_asym_id 
_pdbx_entity_instance_feature.auth_seq_num 
_pdbx_entity_instance_feature.feature_type 
_pdbx_entity_instance_feature.details 
1 CL ? ? CL ? ? 'SUBJECT OF INVESTIGATION' ? 
2 AG ? ? AG ? ? 'SUBJECT OF INVESTIGATION' ? 
# 
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 AG  1  101 1  AG  AG  A . 
D  2 AG  1  102 2  AG  AG  A . 
E  2 AG  1  103 3  AG  AG  A . 
F  2 AG  1  104 4  AG  AG  A . 
G  2 AG  1  105 5  AG  AG  A . 
H  2 AG  1  106 6  AG  AG  A . 
I  2 AG  1  107 7  AG  AG  A . 
J  2 AG  1  108 8  AG  AG  A . 
K  2 AG  1  109 9  AG  AG  A . 
L  2 AG  1  110 10 AG  AG  A . 
M  2 AG  1  111 11 AG  AG  A . 
N  2 AG  1  112 12 AG  AG  A . 
O  2 AG  1  113 13 AG  AG  A . 
P  2 AG  1  114 14 AG  AG  A . 
Q  3 CL  1  115 1  CL  CL  A . 
R  2 AG  1  101 15 AG  AG  B . 
S  2 AG  1  102 16 AG  AG  B . 
T  2 AG  1  103 17 AG  AG  B . 
U  2 AG  1  104 18 AG  AG  B . 
V  2 AG  1  105 19 AG  AG  B . 
W  2 AG  1  106 20 AG  AG  B . 
X  2 AG  1  107 21 AG  AG  B . 
Y  2 AG  1  108 22 AG  AG  B . 
Z  2 AG  1  109 23 AG  AG  B . 
AA 2 AG  1  110 24 AG  AG  B . 
BA 2 AG  1  111 25 AG  AG  B . 
CA 2 AG  1  112 26 AG  AG  B . 
DA 2 AG  1  113 27 AG  AG  B . 
EA 2 AG  1  114 28 AG  AG  B . 
FA 3 CL  1  115 2  CL  CL  B . 
GA 4 HOH 1  201 1  HOH HOH A . 
GA 4 HOH 2  202 25 HOH HOH A . 
GA 4 HOH 3  203 22 HOH HOH A . 
GA 4 HOH 4  204 21 HOH HOH A . 
GA 4 HOH 5  205 11 HOH HOH A . 
GA 4 HOH 6  206 8  HOH HOH A . 
GA 4 HOH 7  207 3  HOH HOH A . 
GA 4 HOH 8  208 6  HOH HOH A . 
GA 4 HOH 9  209 12 HOH HOH A . 
GA 4 HOH 10 210 19 HOH HOH A . 
GA 4 HOH 11 211 33 HOH HOH A . 
GA 4 HOH 12 212 4  HOH HOH A . 
GA 4 HOH 13 213 32 HOH HOH A . 
GA 4 HOH 14 214 15 HOH HOH A . 
GA 4 HOH 15 215 16 HOH HOH A . 
GA 4 HOH 16 216 31 HOH HOH A . 
GA 4 HOH 17 217 36 HOH HOH A . 
HA 4 HOH 1  201 14 HOH HOH B . 
HA 4 HOH 2  202 34 HOH HOH B . 
HA 4 HOH 3  203 17 HOH HOH B . 
HA 4 HOH 4  204 24 HOH HOH B . 
HA 4 HOH 5  205 10 HOH HOH B . 
HA 4 HOH 6  206 18 HOH HOH B . 
HA 4 HOH 7  207 7  HOH HOH B . 
HA 4 HOH 8  208 2  HOH HOH B . 
HA 4 HOH 9  209 26 HOH HOH B . 
HA 4 HOH 10 210 9  HOH HOH B . 
HA 4 HOH 11 211 13 HOH HOH B . 
HA 4 HOH 12 212 28 HOH HOH B . 
HA 4 HOH 13 213 5  HOH HOH B . 
HA 4 HOH 14 214 39 HOH HOH B . 
HA 4 HOH 15 215 29 HOH HOH B . 
HA 4 HOH 16 216 20 HOH HOH B . 
HA 4 HOH 17 217 27 HOH HOH B . 
HA 4 HOH 18 218 23 HOH HOH B . 
HA 4 HOH 19 219 30 HOH HOH B . 
HA 4 HOH 20 220 35 HOH HOH B . 
HA 4 HOH 21 221 38 HOH HOH B . 
HA 4 HOH 22 222 37 HOH HOH B . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PHENIX  ? ? ? '(1.20.1_4487: ???)' 1 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? XSCALE  ? ? ? .                    2 
? phasing          ? ? ? ? ? ? ? ? ? ? ? Sir2014 ? ? ? Sir2019              3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? AutoSol ? ? ? .                    4 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS     ? ? ? .                    5 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   103.67 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9KHW 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     27.215 
_cell.length_a_esd                 ? 
_cell.length_b                     53.171 
_cell.length_b_esd                 ? 
_cell.length_c                     27.215 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        4 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         9KHW 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                4 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 1 21 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   9KHW 
_exptl.crystals_number            2 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
loop_
_exptl_crystal.colour 
_exptl_crystal.density_diffrn 
_exptl_crystal.density_Matthews 
_exptl_crystal.density_method 
_exptl_crystal.density_percent_sol 
_exptl_crystal.description 
_exptl_crystal.F_000 
_exptl_crystal.id 
_exptl_crystal.preparation 
_exptl_crystal.size_max 
_exptl_crystal.size_mid 
_exptl_crystal.size_min 
_exptl_crystal.size_rad 
_exptl_crystal.colour_lustre 
_exptl_crystal.colour_modifier 
_exptl_crystal.colour_primary 
_exptl_crystal.density_meas 
_exptl_crystal.density_meas_esd 
_exptl_crystal.density_meas_gt 
_exptl_crystal.density_meas_lt 
_exptl_crystal.density_meas_temp 
_exptl_crystal.density_meas_temp_esd 
_exptl_crystal.density_meas_temp_gt 
_exptl_crystal.density_meas_temp_lt 
_exptl_crystal.pdbx_crystal_image_url 
_exptl_crystal.pdbx_crystal_image_format 
_exptl_crystal.pdbx_mosaicity 
_exptl_crystal.pdbx_mosaicity_esd 
_exptl_crystal.pdbx_mosaic_method 
_exptl_crystal.pdbx_mosaic_block_size 
_exptl_crystal.pdbx_mosaic_block_size_esd 
? ? 1.96 ? 37.38 ? ? 1 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
? ? ?    ? ?     ? ? 2 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
# 
loop_
_exptl_crystal_grow.apparatus 
_exptl_crystal_grow.atmosphere 
_exptl_crystal_grow.crystal_id 
_exptl_crystal_grow.details 
_exptl_crystal_grow.method 
_exptl_crystal_grow.method_ref 
_exptl_crystal_grow.pH 
_exptl_crystal_grow.pressure 
_exptl_crystal_grow.pressure_esd 
_exptl_crystal_grow.seeding 
_exptl_crystal_grow.seeding_ref 
_exptl_crystal_grow.temp_details 
_exptl_crystal_grow.temp_esd 
_exptl_crystal_grow.time 
_exptl_crystal_grow.pdbx_details 
_exptl_crystal_grow.pdbx_pH_range 
_exptl_crystal_grow.temp 
? ? 1 ? 'VAPOR DIFFUSION, SITTING DROP' ? 7.0 ? ? ? ? ? ? ? '50 mM MOPS, 10 mM spermine, 10 mM KNO3, 10% MPD' ? 293 
? ? 2 ? 'VAPOR DIFFUSION, HANGING DROP' ? 7.0 ? ? ? ? ? ? ? 
;50 mM 3-(N-morpholino)propanesulfonic acid, 10 mM spermine, 10 mM Ca(NO3), 10% 2-methyl-2,4-pentanediol against a reservoir solution of 40% 2-methyl-2,4-pentanediol.
;
? 293 
# 
loop_
_diffrn.ambient_environment 
_diffrn.ambient_temp 
_diffrn.ambient_temp_details 
_diffrn.ambient_temp_esd 
_diffrn.crystal_id 
_diffrn.crystal_support 
_diffrn.crystal_treatment 
_diffrn.details 
_diffrn.id 
_diffrn.ambient_pressure 
_diffrn.ambient_pressure_esd 
_diffrn.ambient_pressure_gt 
_diffrn.ambient_pressure_lt 
_diffrn.ambient_temp_gt 
_diffrn.ambient_temp_lt 
_diffrn.pdbx_serial_crystal_experiment 
? 100 ? ? 1 ? ? ? 1 ? ? ? ? ? ? Y 
? 100 ? ? 2 ? ? ? 2 ? ? ? ? ? ? Y 
# 
loop_
_diffrn_detector.details 
_diffrn_detector.detector 
_diffrn_detector.diffrn_id 
_diffrn_detector.type 
_diffrn_detector.area_resol_mean 
_diffrn_detector.dtime 
_diffrn_detector.pdbx_frames_total 
_diffrn_detector.pdbx_collection_time_total 
_diffrn_detector.pdbx_collection_date 
_diffrn_detector.pdbx_frequency 
_diffrn_detector.id 
_diffrn_detector.number_of_axes 
? PIXEL 1 'DECTRIS PILATUS 6M'   ? ? ? ? 2024-10-12 ? ? ? 
? PIXEL 2 'DECTRIS EIGER2 S 16M' ? ? ? ? 2024-10-20 ? ? ? 
# 
loop_
_diffrn_radiation.collimation 
_diffrn_radiation.diffrn_id 
_diffrn_radiation.filter_edge 
_diffrn_radiation.inhomogeneity 
_diffrn_radiation.monochromator 
_diffrn_radiation.polarisn_norm 
_diffrn_radiation.polarisn_ratio 
_diffrn_radiation.probe 
_diffrn_radiation.type 
_diffrn_radiation.xray_symbol 
_diffrn_radiation.wavelength_id 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l 
_diffrn_radiation.pdbx_wavelength_list 
_diffrn_radiation.pdbx_wavelength 
_diffrn_radiation.pdbx_diffrn_protocol 
_diffrn_radiation.pdbx_analyzer 
_diffrn_radiation.pdbx_scattering_type 
? 1 ? ? ? ? ? ? ? ? 1 M ? ? 'SINGLE WAVELENGTH' ? x-ray 
? 2 ? ? ? ? ? ? ? ? 2 M ? ? 'SINGLE WAVELENGTH' ? x-ray 
# 
loop_
_diffrn_radiation_wavelength.id 
_diffrn_radiation_wavelength.wavelength 
_diffrn_radiation_wavelength.wt 
1 1.9    1.0 
2 0.6199 1.0 
# 
loop_
_diffrn_source.current 
_diffrn_source.details 
_diffrn_source.diffrn_id 
_diffrn_source.power 
_diffrn_source.size 
_diffrn_source.source 
_diffrn_source.target 
_diffrn_source.type 
_diffrn_source.voltage 
_diffrn_source.take-off_angle 
_diffrn_source.pdbx_wavelength_list 
_diffrn_source.pdbx_wavelength 
_diffrn_source.pdbx_synchrotron_beamline 
_diffrn_source.pdbx_synchrotron_site 
? ? 1 ? ? SYNCHROTRON ? 'PHOTON FACTORY BEAMLINE BL-5A' ? ? 1.9    ? BL-5A  'Photon Factory' 
? ? 2 ? ? SYNCHROTRON ? 'MAX IV BEAMLINE BioMAX'        ? ? 0.6199 ? BioMAX 'MAX IV'         
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9KHW 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.3 
_reflns.d_resolution_low                               26.4 
_reflns.details                                        ? 
_reflns.limit_h_max                                    ? 
_reflns.limit_h_min                                    ? 
_reflns.limit_k_max                                    ? 
_reflns.limit_k_min                                    ? 
_reflns.limit_l_max                                    ? 
_reflns.limit_l_min                                    ? 
_reflns.number_all                                     ? 
_reflns.number_obs                                     35689 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           97.1 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                3.6 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          7.25 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.13 
_reflns.pdbx_Rpim_I_all                                ? 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 2 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.993 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.111 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
loop_
_reflns_shell.d_res_high 
_reflns_shell.d_res_low 
_reflns_shell.meanI_over_sigI_all 
_reflns_shell.meanI_over_sigI_obs 
_reflns_shell.number_measured_all 
_reflns_shell.number_measured_obs 
_reflns_shell.number_possible 
_reflns_shell.number_unique_all 
_reflns_shell.number_unique_obs 
_reflns_shell.percent_possible_obs 
_reflns_shell.Rmerge_F_all 
_reflns_shell.Rmerge_F_obs 
_reflns_shell.meanI_over_sigI_gt 
_reflns_shell.meanI_over_uI_all 
_reflns_shell.meanI_over_uI_gt 
_reflns_shell.number_measured_gt 
_reflns_shell.number_unique_gt 
_reflns_shell.percent_possible_gt 
_reflns_shell.Rmerge_F_gt 
_reflns_shell.Rmerge_I_gt 
_reflns_shell.pdbx_redundancy 
_reflns_shell.pdbx_chi_squared 
_reflns_shell.pdbx_netI_over_sigmaI_all 
_reflns_shell.pdbx_netI_over_sigmaI_obs 
_reflns_shell.pdbx_Rrim_I_all 
_reflns_shell.pdbx_Rpim_I_all 
_reflns_shell.pdbx_rejects 
_reflns_shell.pdbx_ordinal 
_reflns_shell.pdbx_diffrn_id 
_reflns_shell.pdbx_CC_half 
_reflns_shell.pdbx_CC_star 
_reflns_shell.pdbx_R_split 
_reflns_shell.percent_possible_all 
_reflns_shell.Rmerge_I_all 
_reflns_shell.Rmerge_I_obs 
_reflns_shell.pdbx_Rsym_value 
_reflns_shell.pdbx_percent_possible_ellipsoidal 
_reflns_shell.pdbx_percent_possible_spherical 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous 
_reflns_shell.pdbx_percent_possible_spherical_anomalous 
_reflns_shell.pdbx_redundancy_anomalous 
_reflns_shell.pdbx_CC_half_anomalous 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous 
_reflns_shell.pdbx_percent_possible_anomalous 
1.30 1.33 ? ? ? ? ? ? 2549 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.376 ? ? 1  2 0.899 ? ? ? ? 0.319 ? ? ? ? ? ? ? ? ? 
1.33 1.37 ? ? ? ? ? ? 2543 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.339 ? ? 2  2 0.918 ? ? ? ? 0.288 ? ? ? ? ? ? ? ? ? 
1.37 1.41 ? ? ? ? ? ? 2478 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.314 ? ? 3  2 0.939 ? ? ? ? 0.266 ? ? ? ? ? ? ? ? ? 
1.41 1.45 ? ? ? ? ? ? 2443 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.315 ? ? 4  2 0.933 ? ? ? ? 0.267 ? ? ? ? ? ? ? ? ? 
1.45 1.5  ? ? ? ? ? ? 2414 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.291 ? ? 5  2 0.938 ? ? ? ? 0.247 ? ? ? ? ? ? ? ? ? 
1.50 1.55 ? ? ? ? ? ? 2202 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.295 ? ? 6  2 0.931 ? ? ? ? 0.249 ? ? ? ? ? ? ? ? ? 
1.55 1.61 ? ? ? ? ? ? 2257 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.275 ? ? 7  2 0.951 ? ? ? ? 0.235 ? ? ? ? ? ? ? ? ? 
1.61 1.67 ? ? ? ? ? ? 2089 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.238 ? ? 8  2 0.96  ? ? ? ? 0.203 ? ? ? ? ? ? ? ? ? 
1.67 1.75 ? ? ? ? ? ? 2071 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.216 ? ? 9  2 0.962 ? ? ? ? 0.184 ? ? ? ? ? ? ? ? ? 
1.75 1.83 ? ? ? ? ? ? 1967 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.181 ? ? 10 2 0.973 ? ? ? ? 0.154 ? ? ? ? ? ? ? ? ? 
1.83 1.93 ? ? ? ? ? ? 1919 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.156 ? ? 11 2 0.982 ? ? ? ? 0.133 ? ? ? ? ? ? ? ? ? 
1.93 2.05 ? ? ? ? ? ? 1737 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.12  ? ? 12 2 0.987 ? ? ? ? 0.102 ? ? ? ? ? ? ? ? ? 
2.05 2.19 ? ? ? ? ? ? 1646 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.104 ? ? 13 2 0.989 ? ? ? ? 0.089 ? ? ? ? ? ? ? ? ? 
2.19 2.37 ? ? ? ? ? ? 1539 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.087 ? ? 14 2 0.992 ? ? ? ? 0.074 ? ? ? ? ? ? ? ? ? 
2.37 2.59 ? ? ? ? ? ? 1371 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.08  ? ? 15 2 0.996 ? ? ? ? 0.068 ? ? ? ? ? ? ? ? ? 
2.59 2.9  ? ? ? ? ? ? 1268 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.089 ? ? 16 2 0.991 ? ? ? ? 0.076 ? ? ? ? ? ? ? ? ? 
2.90 3.35 ? ? ? ? ? ? 1143 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.079 ? ? 17 2 0.995 ? ? ? ? 0.068 ? ? ? ? ? ? ? ? ? 
3.35 4.1  ? ? ? ? ? ? 939  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.077 ? ? 18 2 0.995 ? ? ? ? 0.067 ? ? ? ? ? ? ? ? ? 
4.10 5.8  ? ? ? ? ? ? 742  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.074 ? ? 19 2 0.994 ? ? ? ? 0.063 ? ? ? ? ? ? ? ? ? 
5.80 26.4 ? ? ? ? ? ? 372  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.065 ? ? 20 2 0.995 ? ? ? ? 0.056 ? ? ? ? ? ? ? ? ? 
2.0  26.6 ? ? ? ? ? ? 9236 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ?     ? ? 21 1 0.994 ? ? ? ? ?     ? ? ? ? ? ? ? ? ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               ? 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.details                                  ? 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 9KHW 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            1.30 
_refine.ls_d_res_low                             16.82 
_refine.ls_extinction_coef                       ? 
_refine.ls_extinction_coef_esd                   ? 
_refine.ls_extinction_expression                 ? 
_refine.ls_extinction_method                     ? 
_refine.ls_goodness_of_fit_all                   ? 
_refine.ls_goodness_of_fit_all_esd               ? 
_refine.ls_goodness_of_fit_obs                   ? 
_refine.ls_goodness_of_fit_obs_esd               ? 
_refine.ls_hydrogen_treatment                    ? 
_refine.ls_matrix_type                           ? 
_refine.ls_number_constraints                    ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.ls_number_reflns_obs                     35654 
_refine.ls_number_reflns_R_free                  3521 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    97.16 
_refine.ls_percent_reflns_R_free                 9.88 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1632 
_refine.ls_R_factor_R_free                       0.1642 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1631 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.98 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'AB INITIO PHASING' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ML 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.10 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.90 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 19.95 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            0.10 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.30 
_refine_hist.d_res_low                        16.82 
_refine_hist.number_atoms_solvent             39 
_refine_hist.number_atoms_total               715 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        0 
_refine_hist.pdbx_number_atoms_nucleic_acid   646 
_refine_hist.pdbx_number_atoms_ligand         30 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.009  ? 724  ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 1.210  ? 1112 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 28.714 ? 312  ? f_dihedral_angle_d ? ? 
'X-RAY DIFFRACTION' ? 0.097  ? 126  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.018  ? 32   ? f_plane_restr      ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 1.30 1.31  . . 132 1189 96.00 . . . . 0.2335 . . . . . . . . . . . 0.2676 
'X-RAY DIFFRACTION' 1.31 1.33  . . 138 1257 96.00 . . . . 0.2342 . . . . . . . . . . . 0.2502 
'X-RAY DIFFRACTION' 1.33 1.35  . . 146 1303 97.00 . . . . 0.2214 . . . . . . . . . . . 0.2243 
'X-RAY DIFFRACTION' 1.35 1.37  . . 143 1280 96.00 . . . . 0.2155 . . . . . . . . . . . 0.2757 
'X-RAY DIFFRACTION' 1.37 1.40  . . 139 1244 96.00 . . . . 0.2181 . . . . . . . . . . . 0.2001 
'X-RAY DIFFRACTION' 1.40 1.42  . . 142 1318 98.00 . . . . 0.2176 . . . . . . . . . . . 0.1800 
'X-RAY DIFFRACTION' 1.42 1.45  . . 136 1272 97.00 . . . . 0.2127 . . . . . . . . . . . 0.1995 
'X-RAY DIFFRACTION' 1.45 1.47  . . 147 1337 98.00 . . . . 0.2026 . . . . . . . . . . . 0.1992 
'X-RAY DIFFRACTION' 1.47 1.50  . . 143 1276 97.00 . . . . 0.2146 . . . . . . . . . . . 0.1946 
'X-RAY DIFFRACTION' 1.50 1.54  . . 147 1256 97.00 . . . . 0.2155 . . . . . . . . . . . 0.2174 
'X-RAY DIFFRACTION' 1.54 1.57  . . 140 1311 97.00 . . . . 0.1921 . . . . . . . . . . . 0.2367 
'X-RAY DIFFRACTION' 1.57 1.61  . . 142 1291 98.00 . . . . 0.2110 . . . . . . . . . . . 0.2775 
'X-RAY DIFFRACTION' 1.61 1.66  . . 139 1287 98.00 . . . . 0.1801 . . . . . . . . . . . 0.2026 
'X-RAY DIFFRACTION' 1.66 1.70  . . 148 1335 98.00 . . . . 0.1841 . . . . . . . . . . . 0.1607 
'X-RAY DIFFRACTION' 1.70 1.76  . . 141 1258 98.00 . . . . 0.1702 . . . . . . . . . . . 0.1409 
'X-RAY DIFFRACTION' 1.76 1.82  . . 145 1323 98.00 . . . . 0.1652 . . . . . . . . . . . 0.1497 
'X-RAY DIFFRACTION' 1.82 1.89  . . 136 1283 98.00 . . . . 0.1396 . . . . . . . . . . . 0.1351 
'X-RAY DIFFRACTION' 1.89 1.98  . . 145 1309 98.00 . . . . 0.1281 . . . . . . . . . . . 0.1499 
'X-RAY DIFFRACTION' 1.98 2.08  . . 137 1310 98.00 . . . . 0.1284 . . . . . . . . . . . 0.1304 
'X-RAY DIFFRACTION' 2.09 2.21  . . 125 1313 98.00 . . . . 0.1232 . . . . . . . . . . . 0.1258 
'X-RAY DIFFRACTION' 2.21 2.39  . . 144 1294 97.00 . . . . 0.1226 . . . . . . . . . . . 0.1093 
'X-RAY DIFFRACTION' 2.39 2.62  . . 149 1239 96.00 . . . . 0.1157 . . . . . . . . . . . 0.1062 
'X-RAY DIFFRACTION' 2.62 3.00  . . 133 1298 97.00 . . . . 0.1430 . . . . . . . . . . . 0.1635 
'X-RAY DIFFRACTION' 3.00 3.78  . . 138 1302 98.00 . . . . 0.1657 . . . . . . . . . . . 0.1747 
'X-RAY DIFFRACTION' 3.78 16.82 . . 146 1248 95.00 . . . . 0.1688 . . . . . . . . . . . 0.1749 
# 
_struct.entry_id                     9KHW 
_struct.title                        'A DNA-stabilized atomically precise silver nanorod with emission at 960 nm' 
_struct.pdbx_model_details           ? 
_struct.pdbx_formula_weight          ? 
_struct.pdbx_formula_weight_method   ? 
_struct.pdbx_model_type_details      ? 
_struct.pdbx_CASP_flag               N 
# 
_struct_keywords.entry_id        9KHW 
_struct_keywords.text            'DNA, silver, Ag28, near infrared emission, fluorescence, DNA-AgNC' 
_struct_keywords.pdbx_keywords   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 2 ? 
E  N N 2 ? 
F  N N 2 ? 
G  N N 2 ? 
H  N N 2 ? 
I  N N 2 ? 
J  N N 2 ? 
K  N N 2 ? 
L  N N 2 ? 
M  N N 2 ? 
N  N N 2 ? 
O  N N 2 ? 
P  N N 2 ? 
Q  N N 3 ? 
R  N N 2 ? 
S  N N 2 ? 
T  N N 2 ? 
U  N N 2 ? 
V  N N 2 ? 
W  N N 2 ? 
X  N N 2 ? 
Y  N N 2 ? 
Z  N N 2 ? 
AA N N 2 ? 
BA N N 2 ? 
CA N N 2 ? 
DA N N 2 ? 
EA N N 2 ? 
FA N N 3 ? 
GA N N 4 ? 
HA N N 4 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    PDB 
_struct_ref.db_code                    9KHW 
_struct_ref.pdbx_db_accession          9KHW 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   ? 
_struct_ref.pdbx_align_begin           1 
# 
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 9KHW A 1 ? 16 ? 9KHW 1 ? 16 ? 1 16 
2 1 9KHW B 1 ? 16 ? 9KHW 1 ? 16 ? 1 16 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   dimeric 
_pdbx_struct_assembly.oligomeric_count     2 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 5790 ? 
1 MORE         -196 ? 
1 'SSA (A^2)'  3790 ? 
# 
_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,G,H,I,J,K,L,M,N,O,P,Q,R,S,T,U,V,W,X,Y,Z,AA,BA,CA,DA,EA,FA,GA,HA 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'mass spectrometry' 
_pdbx_struct_assembly_auth_evidence.details                'Electron Dispersive X-ray Spectroscopy' 
# 
_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_
_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 
_struct_conn.pdbx_role 
metalc1  metalc ? ? A DC 1  O2 ? ? ? 1_555 I  AG .  AG ? ? A DC 1  A AG 107 1_555 ? ? ? ? ? ? ?               2.306 ? ? 
metalc2  metalc ? ? A DC 1  N3 ? ? ? 1_555 L  AG .  AG ? ? A DC 1  A AG 110 1_555 ? ? ? ? ? ? ?               2.372 ? ? 
metalc3  metalc ? ? A DC 2  N3 ? ? ? 1_555 D  AG .  AG ? ? A DC 2  A AG 102 1_555 ? ? ? ? ? ? ?               2.284 ? ? 
metalc4  metalc ? ? A DC 2  O2 ? ? ? 1_555 G  AG .  AG ? ? A DC 2  A AG 105 1_555 ? ? ? ? ? ? ?               2.632 ? ? 
metalc5  metalc ? ? A DG 3  N7 ? ? ? 1_555 C  AG .  AG ? ? A DG 3  A AG 101 1_555 ? ? ? ? ? ? ?               2.303 ? ? 
metalc6  metalc ? ? A DC 4  O2 ? ? ? 1_555 F  AG .  AG ? ? A DC 4  A AG 104 1_555 ? ? ? ? ? ? ?               2.370 ? ? 
metalc7  metalc ? ? A DC 4  N3 ? ? ? 1_555 G  AG .  AG ? ? A DC 4  A AG 105 1_555 ? ? ? ? ? ? ?               2.285 ? ? 
metalc8  metalc ? ? A DG 5  N7 ? ? ? 1_555 J  AG .  AG ? ? A DG 5  A AG 108 1_555 ? ? ? ? ? ? ?               2.235 ? ? 
metalc9  metalc ? ? A DG 5  O6 ? ? ? 1_555 L  AG .  AG ? ? A DG 5  A AG 110 1_555 ? ? ? ? ? ? ?               2.513 ? ? 
metalc10 metalc ? ? A DC 6  O2 ? ? ? 1_555 M  AG .  AG ? ? A DC 6  A AG 111 1_555 ? ? ? ? ? ? ?               2.495 ? ? 
metalc11 metalc ? ? A DC 6  N3 ? ? ? 1_555 N  AG .  AG ? ? A DC 6  A AG 112 1_555 ? ? ? ? ? ? ?               2.225 ? ? 
metalc12 metalc ? ? A DG 7  O6 ? ? ? 1_555 O  AG .  AG ? ? A DG 7  A AG 113 1_555 ? ? ? ? ? ? ?               2.652 ? ? 
metalc13 metalc ? ? A DG 7  N7 ? ? ? 1_555 P  AG .  AG ? ? A DG 7  A AG 114 1_555 ? ? ? ? ? ? ?               2.312 ? ? 
metalc14 metalc ? ? A DG 9  O6 ? ? ? 1_555 K  AG .  AG ? ? A DG 9  A AG 109 1_555 ? ? ? ? ? ? ?               2.200 ? ? 
metalc15 metalc ? ? A DG 9  N1 ? ? ? 1_555 M  AG .  AG ? ? A DG 9  A AG 111 1_555 ? ? ? ? ? ? ?               2.305 ? ? 
metalc16 metalc ? ? A DC 10 O2 ? ? ? 1_555 F  AG .  AG ? ? A DC 10 A AG 104 1_555 ? ? ? ? ? ? ?               2.480 ? ? 
metalc17 metalc ? ? A DC 10 N3 ? ? ? 1_555 H  AG .  AG ? ? A DC 10 A AG 106 1_555 ? ? ? ? ? ? ?               2.348 ? ? 
metalc18 metalc ? ? A DC 11 O2 ? ? ? 1_555 E  AG .  AG ? ? A DC 11 A AG 103 1_555 ? ? ? ? ? ? ?               2.363 ? ? 
metalc19 metalc ? ? A DC 11 N3 ? ? ? 1_555 F  AG .  AG ? ? A DC 11 A AG 104 1_555 ? ? ? ? ? ? ?               2.441 ? ? 
metalc20 metalc ? ? A DG 12 N7 ? ? ? 1_555 C  AG .  AG ? ? A DG 12 A AG 101 1_555 ? ? ? ? ? ? ?               2.415 ? ? 
metalc21 metalc ? ? A DC 13 O2 ? ? ? 1_555 D  AG .  AG ? ? A DC 13 A AG 102 1_555 ? ? ? ? ? ? ?               2.604 ? ? 
metalc22 metalc ? ? A DC 13 N3 ? ? ? 1_555 E  AG .  AG ? ? A DC 13 A AG 103 1_555 ? ? ? ? ? ? ?               2.313 ? ? 
metalc23 metalc ? ? A DG 14 O6 ? ? ? 1_555 H  AG .  AG ? ? A DG 14 A AG 106 1_555 ? ? ? ? ? ? ?               2.352 ? ? 
metalc24 metalc ? ? A DG 14 N1 ? ? ? 1_555 I  AG .  AG ? ? A DG 14 A AG 107 1_555 ? ? ? ? ? ? ?               2.377 ? ? 
metalc25 metalc ? ? A DA 15 N1 ? ? ? 1_555 K  AG .  AG ? ? A DA 15 A AG 109 1_555 ? ? ? ? ? ? ?               2.345 ? ? 
metalc26 metalc ? ? A DA 16 N1 ? ? ? 1_555 O  AG .  AG ? ? A DA 16 A AG 113 1_555 ? ? ? ? ? ? ?               2.271 ? ? 
metalc27 metalc ? ? B DC 1  N3 ? ? ? 1_555 W  AG .  AG ? ? B DC 1  B AG 106 1_555 ? ? ? ? ? ? ?               2.377 ? ? 
metalc28 metalc ? ? B DC 1  O2 ? ? ? 1_555 Y  AG .  AG ? ? B DC 1  B AG 108 1_555 ? ? ? ? ? ? ?               2.314 ? ? 
metalc29 metalc ? ? B DC 2  O2 ? ? ? 1_555 AA AG .  AG ? ? B DC 2  B AG 110 1_555 ? ? ? ? ? ? ?               2.642 ? ? 
metalc30 metalc ? ? B DC 2  N3 ? ? ? 1_555 CA AG .  AG ? ? B DC 2  B AG 112 1_555 ? ? ? ? ? ? ?               2.289 ? ? 
metalc31 metalc ? ? B DG 3  N7 ? ? ? 1_555 EA AG .  AG ? ? B DG 3  B AG 114 1_555 ? ? ? ? ? ? ?               2.305 ? ? 
metalc32 metalc ? ? B DC 4  N3 ? ? ? 1_555 AA AG .  AG ? ? B DC 4  B AG 110 1_555 ? ? ? ? ? ? ?               2.233 ? ? 
metalc33 metalc ? ? B DC 4  O2 ? ? ? 1_555 BA AG .  AG ? ? B DC 4  B AG 111 1_555 ? ? ? ? ? ? ?               2.365 ? ? 
metalc34 metalc ? ? B DG 5  O6 ? ? ? 1_555 W  AG .  AG ? ? B DG 5  B AG 106 1_555 ? ? ? ? ? ? ?               2.470 ? ? 
metalc35 metalc ? ? B DG 5  N7 ? ? ? 1_555 X  AG .  AG ? ? B DG 5  B AG 107 1_555 ? ? ? ? ? ? ?               2.365 ? ? 
metalc36 metalc ? ? B DC 6  N3 ? ? ? 1_555 S  AG .  AG ? ? B DC 6  B AG 102 1_555 ? ? ? ? ? ? ?               2.263 ? ? 
metalc37 metalc ? ? B DC 6  O2 ? ? ? 1_555 T  AG .  AG ? ? B DC 6  B AG 103 1_555 ? ? ? ? ? ? ?               2.530 ? ? 
metalc38 metalc ? ? B DG 7  N7 ? ? ? 1_555 R  AG .  AG ? ? B DG 7  B AG 101 1_555 ? ? ? ? ? ? ?               2.337 ? ? 
metalc39 metalc ? ? B DG 7  O6 ? ? ? 1_555 U  AG .  AG ? ? B DG 7  B AG 104 1_555 ? ? ? ? ? ? ?               2.692 ? ? 
metalc40 metalc ? ? B DG 9  N1 ? ? ? 1_555 T  AG .  AG ? ? B DG 9  B AG 103 1_555 ? ? ? ? ? ? ?               2.324 ? ? 
metalc41 metalc ? ? B DG 9  O6 ? ? ? 1_555 V  AG .  AG ? ? B DG 9  B AG 105 1_555 ? ? ? ? ? ? ?               2.207 ? ? 
metalc42 metalc ? ? B DC 10 N3 ? ? ? 1_555 Z  AG .  AG ? ? B DC 10 B AG 109 1_555 ? ? ? ? ? ? ?               2.366 ? ? 
metalc43 metalc ? ? B DC 10 O2 ? ? ? 1_555 BA AG .  AG ? ? B DC 10 B AG 111 1_555 ? ? ? ? ? ? ?               2.465 ? ? 
metalc44 metalc ? ? B DC 11 N3 ? ? ? 1_555 BA AG .  AG ? ? B DC 11 B AG 111 1_555 ? ? ? ? ? ? ?               2.406 ? ? 
metalc45 metalc ? ? B DC 11 O2 ? ? ? 1_555 DA AG .  AG ? ? B DC 11 B AG 113 1_555 ? ? ? ? ? ? ?               2.357 ? ? 
metalc46 metalc ? ? B DG 12 N7 ? ? ? 1_555 EA AG .  AG ? ? B DG 12 B AG 114 1_555 ? ? ? ? ? ? ?               2.409 ? ? 
metalc47 metalc ? ? B DC 13 O2 ? ? ? 1_555 CA AG .  AG ? ? B DC 13 B AG 112 1_555 ? ? ? ? ? ? ?               2.593 ? ? 
metalc48 metalc ? ? B DC 13 N3 ? ? ? 1_555 DA AG .  AG ? ? B DC 13 B AG 113 1_555 ? ? ? ? ? ? ?               2.310 ? ? 
metalc49 metalc ? ? B DG 14 N1 ? ? ? 1_555 Y  AG .  AG ? ? B DG 14 B AG 108 1_555 ? ? ? ? ? ? ?               2.372 ? ? 
metalc50 metalc ? ? B DG 14 O6 ? ? ? 1_555 Z  AG .  AG ? ? B DG 14 B AG 109 1_555 ? ? ? ? ? ? ?               2.354 ? ? 
metalc51 metalc ? ? B DA 15 N1 ? ? ? 1_555 V  AG .  AG ? ? B DA 15 B AG 105 1_555 ? ? ? ? ? ? ?               2.351 ? ? 
metalc52 metalc ? ? B DA 16 N1 ? ? ? 1_555 U  AG .  AG ? ? B DA 16 B AG 104 1_555 ? ? ? ? ? ? ?               2.269 ? ? 
hydrog1  hydrog ? ? A DC 1  N3 ? ? ? 1_555 A  DC 4  N4 ? ? A DC 1  A DC 4   1_555 ? ? ? ? ? ? 'DC-DC MISPAIR' ?     ? ? 
hydrog2  hydrog ? ? A DC 1  N4 ? ? ? 1_555 A  DG 5  O6 ? ? A DC 1  A DG 5   1_555 ? ? ? ? ? ? 'DC-DG PAIR'    ?     ? ? 
hydrog3  hydrog ? ? A DC 1  O2 ? ? ? 1_555 A  DG 14 N2 ? ? A DC 1  A DG 14  1_555 ? ? ? ? ? ? 'DC-DG PAIR'    ?     ? ? 
hydrog4  hydrog ? ? A DC 2  O2 ? ? ? 1_555 A  DC 4  N4 ? ? A DC 2  A DC 4   1_555 ? ? ? ? ? ? 'DC-DC MISPAIR' ?     ? ? 
hydrog5  hydrog ? ? A DC 4  O2 ? ? ? 1_555 A  DC 11 N4 ? ? A DC 4  A DC 11  1_555 ? ? ? ? ? ? 'DC-DC MISPAIR' ?     ? ? 
hydrog6  hydrog ? ? A DG 5  N7 ? ? ? 1_555 A  DG 9  N2 ? ? A DG 5  A DG 9   1_555 ? ? ? ? ? ? 'DG-DG MISPAIR' ?     ? ? 
hydrog7  hydrog ? ? A DC 6  O2 ? ? ? 1_555 A  DG 9  N2 ? ? A DC 6  A DG 9   1_555 ? ? ? ? ? ? 'DC-DG PAIR'    ?     ? ? 
hydrog8  hydrog ? ? A DG 7  O6 ? ? ? 1_555 A  DA 16 N6 ? ? A DG 7  A DA 16  1_555 ? ? ? ? ? ? 'DG-DA MISPAIR' ?     ? ? 
hydrog9  hydrog ? ? A DG 9  O6 ? ? ? 1_555 A  DA 15 N6 ? ? A DG 9  A DA 15  1_555 ? ? ? ? ? ? 'DG-DA MISPAIR' ?     ? ? 
hydrog10 hydrog ? ? A DC 10 N4 ? ? ? 1_555 A  DG 14 O6 ? ? A DC 10 A DG 14  1_555 ? ? ? ? ? ? 'DC-DG PAIR'    ?     ? ? 
hydrog11 hydrog ? ? A DC 11 O2 ? ? ? 1_555 A  DC 13 N4 ? ? A DC 11 A DC 13  1_555 ? ? ? ? ? ? 'DC-DC MISPAIR' ?     ? ? 
hydrog12 hydrog ? ? B DC 1  N3 ? ? ? 1_555 B  DC 4  N4 ? ? B DC 1  B DC 4   1_555 ? ? ? ? ? ? 'DC-DC MISPAIR' ?     ? ? 
hydrog13 hydrog ? ? B DC 1  N4 ? ? ? 1_555 B  DG 5  O6 ? ? B DC 1  B DG 5   1_555 ? ? ? ? ? ? 'DC-DG PAIR'    ?     ? ? 
hydrog14 hydrog ? ? B DC 1  O2 ? ? ? 1_555 B  DG 14 N2 ? ? B DC 1  B DG 14  1_555 ? ? ? ? ? ? 'DC-DG PAIR'    ?     ? ? 
hydrog15 hydrog ? ? B DC 2  O2 ? ? ? 1_555 B  DC 4  N4 ? ? B DC 2  B DC 4   1_555 ? ? ? ? ? ? 'DC-DC MISPAIR' ?     ? ? 
hydrog16 hydrog ? ? B DC 2  N4 ? ? ? 1_555 B  DC 13 O2 ? ? B DC 2  B DC 13  1_555 ? ? ? ? ? ? 'DC-DC MISPAIR' ?     ? ? 
hydrog17 hydrog ? ? B DC 4  O2 ? ? ? 1_555 B  DC 11 N4 ? ? B DC 4  B DC 11  1_555 ? ? ? ? ? ? 'DC-DC MISPAIR' ?     ? ? 
hydrog18 hydrog ? ? B DG 5  N7 ? ? ? 1_555 B  DG 9  N2 ? ? B DG 5  B DG 9   1_555 ? ? ? ? ? ? 'DG-DG MISPAIR' ?     ? ? 
hydrog19 hydrog ? ? B DC 6  O2 ? ? ? 1_555 B  DG 9  N2 ? ? B DC 6  B DG 9   1_555 ? ? ? ? ? ? 'DC-DG PAIR'    ?     ? ? 
hydrog20 hydrog ? ? B DG 7  O6 ? ? ? 1_555 B  DA 16 N6 ? ? B DG 7  B DA 16  1_555 ? ? ? ? ? ? 'DG-DA MISPAIR' ?     ? ? 
hydrog21 hydrog ? ? B DG 9  O6 ? ? ? 1_555 B  DA 15 N6 ? ? B DG 9  B DA 15  1_555 ? ? ? ? ? ? 'DG-DA MISPAIR' ?     ? ? 
hydrog22 hydrog ? ? B DC 10 N4 ? ? ? 1_555 B  DG 14 O6 ? ? B DC 10 B DG 14  1_555 ? ? ? ? ? ? 'DC-DG PAIR'    ?     ? ? 
hydrog23 hydrog ? ? B DC 11 O2 ? ? ? 1_555 B  DC 13 N4 ? ? B DC 11 B DC 13  1_555 ? ? ? ? ? ? 'DC-DC MISPAIR' ?     ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
metalc ? ? 
hydrog ? ? 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1  O2 ? A DC 1  ? A DC 1  ? 1_555 AG ? I  AG . ? A AG 107 ? 1_555 N1 ? A DG 14 ? A DG 14 ? 1_555 97.5  ? 
2  N3 ? A DC 1  ? A DC 1  ? 1_555 AG ? L  AG . ? A AG 110 ? 1_555 O6 ? A DG 5  ? A DG 5  ? 1_555 92.2  ? 
3  N3 ? A DC 2  ? A DC 2  ? 1_555 AG ? D  AG . ? A AG 102 ? 1_555 O2 ? A DC 13 ? A DC 13 ? 1_555 99.6  ? 
4  O2 ? A DC 2  ? A DC 2  ? 1_555 AG ? G  AG . ? A AG 105 ? 1_555 N3 ? A DC 4  ? A DC 4  ? 1_555 91.9  ? 
5  N7 ? A DG 3  ? A DG 3  ? 1_555 AG ? C  AG . ? A AG 101 ? 1_555 N7 ? A DG 12 ? A DG 12 ? 1_555 102.4 ? 
6  O2 ? A DC 4  ? A DC 4  ? 1_555 AG ? F  AG . ? A AG 104 ? 1_555 O2 ? A DC 10 ? A DC 10 ? 1_555 119.6 ? 
7  O2 ? A DC 4  ? A DC 4  ? 1_555 AG ? F  AG . ? A AG 104 ? 1_555 N3 ? A DC 11 ? A DC 11 ? 1_555 88.9  ? 
8  O2 ? A DC 10 ? A DC 10 ? 1_555 AG ? F  AG . ? A AG 104 ? 1_555 N3 ? A DC 11 ? A DC 11 ? 1_555 87.0  ? 
9  O2 ? A DC 6  ? A DC 6  ? 1_555 AG ? M  AG . ? A AG 111 ? 1_555 N1 ? A DG 9  ? A DG 9  ? 1_555 95.4  ? 
10 O6 ? A DG 7  ? A DG 7  ? 1_555 AG ? O  AG . ? A AG 113 ? 1_555 N1 ? A DA 16 ? A DA 16 ? 1_555 92.0  ? 
11 O6 ? A DG 9  ? A DG 9  ? 1_555 AG ? K  AG . ? A AG 109 ? 1_555 N1 ? A DA 15 ? A DA 15 ? 1_555 92.1  ? 
12 N3 ? A DC 10 ? A DC 10 ? 1_555 AG ? H  AG . ? A AG 106 ? 1_555 O6 ? A DG 14 ? A DG 14 ? 1_555 92.6  ? 
13 O2 ? A DC 11 ? A DC 11 ? 1_555 AG ? E  AG . ? A AG 103 ? 1_555 N3 ? A DC 13 ? A DC 13 ? 1_555 99.3  ? 
14 N3 ? B DC 1  ? B DC 1  ? 1_555 AG ? W  AG . ? B AG 106 ? 1_555 O6 ? B DG 5  ? B DG 5  ? 1_555 92.2  ? 
15 O2 ? B DC 1  ? B DC 1  ? 1_555 AG ? Y  AG . ? B AG 108 ? 1_555 N1 ? B DG 14 ? B DG 14 ? 1_555 98.1  ? 
16 O2 ? B DC 2  ? B DC 2  ? 1_555 AG ? AA AG . ? B AG 110 ? 1_555 N3 ? B DC 4  ? B DC 4  ? 1_555 90.2  ? 
17 N3 ? B DC 2  ? B DC 2  ? 1_555 AG ? CA AG . ? B AG 112 ? 1_555 O2 ? B DC 13 ? B DC 13 ? 1_555 99.6  ? 
18 N7 ? B DG 3  ? B DG 3  ? 1_555 AG ? EA AG . ? B AG 114 ? 1_555 N7 ? B DG 12 ? B DG 12 ? 1_555 101.1 ? 
19 O2 ? B DC 4  ? B DC 4  ? 1_555 AG ? BA AG . ? B AG 111 ? 1_555 O2 ? B DC 10 ? B DC 10 ? 1_555 120.9 ? 
20 O2 ? B DC 4  ? B DC 4  ? 1_555 AG ? BA AG . ? B AG 111 ? 1_555 N3 ? B DC 11 ? B DC 11 ? 1_555 90.0  ? 
21 O2 ? B DC 10 ? B DC 10 ? 1_555 AG ? BA AG . ? B AG 111 ? 1_555 N3 ? B DC 11 ? B DC 11 ? 1_555 87.0  ? 
22 O2 ? B DC 6  ? B DC 6  ? 1_555 AG ? T  AG . ? B AG 103 ? 1_555 N1 ? B DG 9  ? B DG 9  ? 1_555 95.1  ? 
23 O6 ? B DG 7  ? B DG 7  ? 1_555 AG ? U  AG . ? B AG 104 ? 1_555 N1 ? B DA 16 ? B DA 16 ? 1_555 91.9  ? 
24 O6 ? B DG 9  ? B DG 9  ? 1_555 AG ? V  AG . ? B AG 105 ? 1_555 N1 ? B DA 15 ? B DA 15 ? 1_555 92.1  ? 
25 N3 ? B DC 10 ? B DC 10 ? 1_555 AG ? Z  AG . ? B AG 109 ? 1_555 O6 ? B DG 14 ? B DG 14 ? 1_555 91.5  ? 
26 O2 ? B DC 11 ? B DC 11 ? 1_555 AG ? DA AG . ? B AG 113 ? 1_555 N3 ? B DC 13 ? B DC 13 ? 1_555 99.0  ? 
# 
_pdbx_entry_details.entry_id                   9KHW 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.has_protein_modification   N 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
AG  AG     AG N N 1   
CL  CL     CL N N 2   
DA  OP3    O  N N 3   
DA  P      P  N N 4   
DA  OP1    O  N N 5   
DA  OP2    O  N N 6   
DA  "O5'"  O  N N 7   
DA  "C5'"  C  N N 8   
DA  "C4'"  C  N R 9   
DA  "O4'"  O  N N 10  
DA  "C3'"  C  N S 11  
DA  "O3'"  O  N N 12  
DA  "C2'"  C  N N 13  
DA  "C1'"  C  N R 14  
DA  N9     N  Y N 15  
DA  C8     C  Y N 16  
DA  N7     N  Y N 17  
DA  C5     C  Y N 18  
DA  C6     C  Y N 19  
DA  N6     N  N N 20  
DA  N1     N  Y N 21  
DA  C2     C  Y N 22  
DA  N3     N  Y N 23  
DA  C4     C  Y N 24  
DA  HOP3   H  N N 25  
DA  HOP2   H  N N 26  
DA  "H5'"  H  N N 27  
DA  "H5''" H  N N 28  
DA  "H4'"  H  N N 29  
DA  "H3'"  H  N N 30  
DA  "HO3'" H  N N 31  
DA  "H2'"  H  N N 32  
DA  "H2''" H  N N 33  
DA  "H1'"  H  N N 34  
DA  H8     H  N N 35  
DA  H61    H  N N 36  
DA  H62    H  N N 37  
DA  H2     H  N N 38  
DC  OP3    O  N N 39  
DC  P      P  N N 40  
DC  OP1    O  N N 41  
DC  OP2    O  N N 42  
DC  "O5'"  O  N N 43  
DC  "C5'"  C  N N 44  
DC  "C4'"  C  N R 45  
DC  "O4'"  O  N N 46  
DC  "C3'"  C  N S 47  
DC  "O3'"  O  N N 48  
DC  "C2'"  C  N N 49  
DC  "C1'"  C  N R 50  
DC  N1     N  N N 51  
DC  C2     C  N N 52  
DC  O2     O  N N 53  
DC  N3     N  N N 54  
DC  C4     C  N N 55  
DC  N4     N  N N 56  
DC  C5     C  N N 57  
DC  C6     C  N N 58  
DC  HOP3   H  N N 59  
DC  HOP2   H  N N 60  
DC  "H5'"  H  N N 61  
DC  "H5''" H  N N 62  
DC  "H4'"  H  N N 63  
DC  "H3'"  H  N N 64  
DC  "HO3'" H  N N 65  
DC  "H2'"  H  N N 66  
DC  "H2''" H  N N 67  
DC  "H1'"  H  N N 68  
DC  H41    H  N N 69  
DC  H42    H  N N 70  
DC  H5     H  N N 71  
DC  H6     H  N N 72  
DG  OP3    O  N N 73  
DG  P      P  N N 74  
DG  OP1    O  N N 75  
DG  OP2    O  N N 76  
DG  "O5'"  O  N N 77  
DG  "C5'"  C  N N 78  
DG  "C4'"  C  N R 79  
DG  "O4'"  O  N N 80  
DG  "C3'"  C  N S 81  
DG  "O3'"  O  N N 82  
DG  "C2'"  C  N N 83  
DG  "C1'"  C  N R 84  
DG  N9     N  Y N 85  
DG  C8     C  Y N 86  
DG  N7     N  Y N 87  
DG  C5     C  Y N 88  
DG  C6     C  N N 89  
DG  O6     O  N N 90  
DG  N1     N  N N 91  
DG  C2     C  N N 92  
DG  N2     N  N N 93  
DG  N3     N  N N 94  
DG  C4     C  Y N 95  
DG  HOP3   H  N N 96  
DG  HOP2   H  N N 97  
DG  "H5'"  H  N N 98  
DG  "H5''" H  N N 99  
DG  "H4'"  H  N N 100 
DG  "H3'"  H  N N 101 
DG  "HO3'" H  N N 102 
DG  "H2'"  H  N N 103 
DG  "H2''" H  N N 104 
DG  "H1'"  H  N N 105 
DG  H8     H  N N 106 
DG  H1     H  N N 107 
DG  H21    H  N N 108 
DG  H22    H  N N 109 
HOH O      O  N N 110 
HOH H1     H  N N 111 
HOH H2     H  N N 112 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
DA  OP3   P      sing N N 1   
DA  OP3   HOP3   sing N N 2   
DA  P     OP1    doub N N 3   
DA  P     OP2    sing N N 4   
DA  P     "O5'"  sing N N 5   
DA  OP2   HOP2   sing N N 6   
DA  "O5'" "C5'"  sing N N 7   
DA  "C5'" "C4'"  sing N N 8   
DA  "C5'" "H5'"  sing N N 9   
DA  "C5'" "H5''" sing N N 10  
DA  "C4'" "O4'"  sing N N 11  
DA  "C4'" "C3'"  sing N N 12  
DA  "C4'" "H4'"  sing N N 13  
DA  "O4'" "C1'"  sing N N 14  
DA  "C3'" "O3'"  sing N N 15  
DA  "C3'" "C2'"  sing N N 16  
DA  "C3'" "H3'"  sing N N 17  
DA  "O3'" "HO3'" sing N N 18  
DA  "C2'" "C1'"  sing N N 19  
DA  "C2'" "H2'"  sing N N 20  
DA  "C2'" "H2''" sing N N 21  
DA  "C1'" N9     sing N N 22  
DA  "C1'" "H1'"  sing N N 23  
DA  N9    C8     sing Y N 24  
DA  N9    C4     sing Y N 25  
DA  C8    N7     doub Y N 26  
DA  C8    H8     sing N N 27  
DA  N7    C5     sing Y N 28  
DA  C5    C6     sing Y N 29  
DA  C5    C4     doub Y N 30  
DA  C6    N6     sing N N 31  
DA  C6    N1     doub Y N 32  
DA  N6    H61    sing N N 33  
DA  N6    H62    sing N N 34  
DA  N1    C2     sing Y N 35  
DA  C2    N3     doub Y N 36  
DA  C2    H2     sing N N 37  
DA  N3    C4     sing Y N 38  
DC  OP3   P      sing N N 39  
DC  OP3   HOP3   sing N N 40  
DC  P     OP1    doub N N 41  
DC  P     OP2    sing N N 42  
DC  P     "O5'"  sing N N 43  
DC  OP2   HOP2   sing N N 44  
DC  "O5'" "C5'"  sing N N 45  
DC  "C5'" "C4'"  sing N N 46  
DC  "C5'" "H5'"  sing N N 47  
DC  "C5'" "H5''" sing N N 48  
DC  "C4'" "O4'"  sing N N 49  
DC  "C4'" "C3'"  sing N N 50  
DC  "C4'" "H4'"  sing N N 51  
DC  "O4'" "C1'"  sing N N 52  
DC  "C3'" "O3'"  sing N N 53  
DC  "C3'" "C2'"  sing N N 54  
DC  "C3'" "H3'"  sing N N 55  
DC  "O3'" "HO3'" sing N N 56  
DC  "C2'" "C1'"  sing N N 57  
DC  "C2'" "H2'"  sing N N 58  
DC  "C2'" "H2''" sing N N 59  
DC  "C1'" N1     sing N N 60  
DC  "C1'" "H1'"  sing N N 61  
DC  N1    C2     sing N N 62  
DC  N1    C6     sing N N 63  
DC  C2    O2     doub N N 64  
DC  C2    N3     sing N N 65  
DC  N3    C4     doub N N 66  
DC  C4    N4     sing N N 67  
DC  C4    C5     sing N N 68  
DC  N4    H41    sing N N 69  
DC  N4    H42    sing N N 70  
DC  C5    C6     doub N N 71  
DC  C5    H5     sing N N 72  
DC  C6    H6     sing N N 73  
DG  OP3   P      sing N N 74  
DG  OP3   HOP3   sing N N 75  
DG  P     OP1    doub N N 76  
DG  P     OP2    sing N N 77  
DG  P     "O5'"  sing N N 78  
DG  OP2   HOP2   sing N N 79  
DG  "O5'" "C5'"  sing N N 80  
DG  "C5'" "C4'"  sing N N 81  
DG  "C5'" "H5'"  sing N N 82  
DG  "C5'" "H5''" sing N N 83  
DG  "C4'" "O4'"  sing N N 84  
DG  "C4'" "C3'"  sing N N 85  
DG  "C4'" "H4'"  sing N N 86  
DG  "O4'" "C1'"  sing N N 87  
DG  "C3'" "O3'"  sing N N 88  
DG  "C3'" "C2'"  sing N N 89  
DG  "C3'" "H3'"  sing N N 90  
DG  "O3'" "HO3'" sing N N 91  
DG  "C2'" "C1'"  sing N N 92  
DG  "C2'" "H2'"  sing N N 93  
DG  "C2'" "H2''" sing N N 94  
DG  "C1'" N9     sing N N 95  
DG  "C1'" "H1'"  sing N N 96  
DG  N9    C8     sing Y N 97  
DG  N9    C4     sing Y N 98  
DG  C8    N7     doub Y N 99  
DG  C8    H8     sing N N 100 
DG  N7    C5     sing Y N 101 
DG  C5    C6     sing N N 102 
DG  C5    C4     doub Y N 103 
DG  C6    O6     doub N N 104 
DG  C6    N1     sing N N 105 
DG  N1    C2     sing N N 106 
DG  N1    H1     sing N N 107 
DG  C2    N2     sing N N 108 
DG  C2    N3     doub N N 109 
DG  N2    H21    sing N N 110 
DG  N2    H22    sing N N 111 
DG  N3    C4     sing N N 112 
HOH O     H1     sing N N 113 
HOH O     H2     sing N N 114 
# 
loop_
_ndb_struct_conf_na.entry_id 
_ndb_struct_conf_na.feature 
9KHW 'double helix'         
9KHW 'mismatched base pair' 
# 
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 4  1_555 A DC 11 1_555 1.614  -3.371 -0.470 -9.268  37.689  -82.521  1 A_DC4:DC11_A  A 4  ? A 11 ? ? ? 
1 A DG 5  1_555 A DC 1  1_555 0.049  -3.072 0.239  -25.985 -6.215  148.192  2 A_DG5:DC1_A   A 5  ? A 1  ? ? ? 
1 A DG 9  1_555 A DA 15 1_555 -2.120 3.185  -0.212 -0.964  -5.322  -114.814 3 A_DG9:DA15_A  A 9  ? A 15 ? ? 4 
1 A DA 16 1_555 A DG 7  1_555 0.896  3.860  0.350  -18.733 -19.336 -162.946 4 A_DA16:DG7_A  A 16 ? A 7  ? ? ? 
1 B DG 7  1_555 B DA 16 1_555 -0.852 -3.923 -0.296 18.546  19.210  162.875  5 B_DG7:DA16_B  B 7  ? B 16 ? ? ? 
1 B DG 9  1_555 B DA 15 1_555 -2.110 3.195  -0.238 -0.816  -5.480  -114.862 6 B_DG9:DA15_B  B 9  ? B 15 ? ? 4 
1 B DC 10 1_555 B DG 14 1_555 1.343  1.892  0.005  0.082   5.184   -97.452  7 B_DC10:DG14_B B 10 ? B 14 ? ? ? 
1 B DC 2  1_555 B DC 13 1_555 -0.944 3.271  2.496  -18.703 -1.363  96.927   8 B_DC2:DC13_B  B 2  ? B 13 ? ? ? 
# 
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 4  1_555 A DC 11 1_555 A DG 5  1_555 A DC 1  1_555 2.087  -2.747 -1.617 -147.831 63.788  76.779   -0.909 0.051  -3.355 
33.307  77.190  165.139  1 AA_DC4DG5:DC1DC11_AA   A 4  ? A 11 ? A 5  ? A 1  ? 
1 A DG 5  1_555 A DC 1  1_555 A DG 9  1_555 A DA 15 1_555 2.335  5.334  -1.918 -14.145  -5.471  106.121  3.273  -1.332 -2.314 
-3.411  8.820   106.872  2 AA_DG5DG9:DA15DC1_AA   A 5  ? A 1  ? A 9  ? A 15 ? 
1 A DA 16 1_555 A DG 7  1_555 B DG 7  1_555 B DA 16 1_555 -2.965 -2.484 0.105  -140.151 105.237 -169.094 1.240  -1.485 0.021  
-52.625 -70.084 -179.550 3 AB_DA16DG7:DA16DG7_BA  A 16 ? A 7  ? B 7  ? B 16 ? 
1 B DG 7  1_555 B DA 16 1_555 B DG 9  1_555 B DA 15 1_555 -0.201 3.222  0.436  -150.668 83.223  80.684   1.385  -0.312 1.603  
42.282  76.547  173.999  4 BB_DG7DG9:DA15DA16_BB  B 7  ? B 16 ? B 9  ? B 15 ? 
1 B DG 9  1_555 B DA 15 1_555 B DC 10 1_555 B DG 14 1_555 -0.023 -1.617 3.239  -0.038   -3.387  38.102   -2.038 0.030  3.365  
-5.176  0.058   38.247   5 BB_DG9DC10:DG14DA15_BB B 9  ? B 15 ? B 10 ? B 14 ? 
1 B DC 10 1_555 B DG 14 1_555 B DC 2  1_555 B DC 13 1_555 0.293  2.425  -0.674 161.276  -21.774 -30.557  -1.268 -0.165 -0.147 
11.735  86.921  -163.354 6 BB_DC10DC2:DC13DG14_BB B 10 ? B 14 ? B 2  ? B 13 ? 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'Novo Nordisk Foundation'                                                Denmark          NNF22OC0073734                   1 
'Independent Research Fund Denmark - Technology and Production Sciences' Denmark          0136-00024B                      2 
'Independent Research Fund Denmark - Technology and Production Sciences' Denmark          3103-00279B                      3 
'Marie Sklodowska-Curie Actions, FragNET ITN'                            'European Union' 'NIR-emitting Ag-DNAs 101151897' 4 
'Japan Agency for Medical Research and Development (AMED)'               Japan            JP24ama121014                    5 
# 
loop_
_pdbx_serial_crystallography_sample_delivery.diffrn_id 
_pdbx_serial_crystallography_sample_delivery.description 
_pdbx_serial_crystallography_sample_delivery.method 
1 ? 'fixed target' 
2 ? 'fixed target' 
# 
_atom_sites.entry_id                    9KHW 
_atom_sites.Cartn_transf_matrix[1][1]   ? 
_atom_sites.Cartn_transf_matrix[1][2]   ? 
_atom_sites.Cartn_transf_matrix[1][3]   ? 
_atom_sites.Cartn_transf_matrix[2][1]   ? 
_atom_sites.Cartn_transf_matrix[2][2]   ? 
_atom_sites.Cartn_transf_matrix[2][3]   ? 
_atom_sites.Cartn_transf_matrix[3][1]   ? 
_atom_sites.Cartn_transf_matrix[3][2]   ? 
_atom_sites.Cartn_transf_matrix[3][3]   ? 
_atom_sites.Cartn_transf_vector[1]      ? 
_atom_sites.Cartn_transf_vector[2]      ? 
_atom_sites.Cartn_transf_vector[3]      ? 
_atom_sites.Cartn_transform_axes        ? 
_atom_sites.fract_transf_matrix[1][1]   0.036744 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.008937 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.018807 
_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]   0.037816 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
AG 
C  
CL 
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  ? 0.159   13.231 6.841  1.00 13.18 ? 1   DC  A "O5'" 1 
ATOM   2   C  "C5'" . DC  A  1 1  ? 1.355   12.899 6.162  1.00 11.37 ? 1   DC  A "C5'" 1 
ATOM   3   C  "C4'" . DC  A  1 1  ? 2.563   13.302 6.982  1.00 11.09 ? 1   DC  A "C4'" 1 
ATOM   4   O  "O4'" . DC  A  1 1  ? 2.502   14.723 7.247  1.00 11.78 ? 1   DC  A "O4'" 1 
ATOM   5   C  "C3'" . DC  A  1 1  ? 2.649   12.671 8.355  1.00 10.97 ? 1   DC  A "C3'" 1 
ATOM   6   O  "O3'" . DC  A  1 1  ? 3.254   11.393 8.269  1.00 11.69 ? 1   DC  A "O3'" 1 
ATOM   7   C  "C2'" . DC  A  1 1  ? 3.546   13.657 9.082  1.00 9.57  ? 1   DC  A "C2'" 1 
ATOM   8   C  "C1'" . DC  A  1 1  ? 3.044   14.986 8.528  1.00 10.06 ? 1   DC  A "C1'" 1 
ATOM   9   N  N1    . DC  A  1 1  ? 1.994   15.624 9.370  1.00 8.91  ? 1   DC  A N1    1 
ATOM   10  C  C2    . DC  A  1 1  ? 2.373   16.384 10.474 1.00 8.87  ? 1   DC  A C2    1 
ATOM   11  O  O2    . DC  A  1 1  ? 3.576   16.492 10.742 1.00 10.23 ? 1   DC  A O2    1 
ATOM   12  N  N3    . DC  A  1 1  ? 1.407   16.974 11.221 1.00 8.38  ? 1   DC  A N3    1 
ATOM   13  C  C4    . DC  A  1 1  ? 0.114   16.837 10.904 1.00 9.09  ? 1   DC  A C4    1 
ATOM   14  N  N4    . DC  A  1 1  ? -0.786  17.439 11.666 1.00 9.22  ? 1   DC  A N4    1 
ATOM   15  C  C5    . DC  A  1 1  ? -0.300  16.058 9.779  1.00 9.56  ? 1   DC  A C5    1 
ATOM   16  C  C6    . DC  A  1 1  ? 0.685   15.478 9.042  1.00 7.39  ? 1   DC  A C6    1 
ATOM   17  P  P     . DC  A  1 2  ? 2.533   10.116 8.917  1.00 12.16 ? 2   DC  A P     1 
ATOM   18  O  OP1   . DC  A  1 2  ? 3.444   8.963  8.758  1.00 16.62 ? 2   DC  A OP1   1 
ATOM   19  O  OP2   . DC  A  1 2  ? 1.151   10.053 8.414  1.00 15.42 ? 2   DC  A OP2   1 
ATOM   20  O  "O5'" . DC  A  1 2  ? 2.454   10.475 10.462 1.00 10.33 ? 2   DC  A "O5'" 1 
ATOM   21  C  "C5'" . DC  A  1 2  ? 1.711   9.659  11.319 1.00 11.12 ? 2   DC  A "C5'" 1 
ATOM   22  C  "C4'" . DC  A  1 2  ? 1.272   10.428 12.547 1.00 11.05 ? 2   DC  A "C4'" 1 
ATOM   23  O  "O4'" . DC  A  1 2  ? 2.425   10.954 13.247 1.00 11.83 ? 2   DC  A "O4'" 1 
ATOM   24  C  "C3'" . DC  A  1 2  ? 0.396   11.637 12.291 1.00 11.16 ? 2   DC  A "C3'" 1 
ATOM   25  O  "O3'" . DC  A  1 2  ? -0.336  11.857 13.469 1.00 10.89 ? 2   DC  A "O3'" 1 
ATOM   26  C  "C2'" . DC  A  1 2  ? 1.436   12.743 12.084 1.00 8.52  ? 2   DC  A "C2'" 1 
ATOM   27  C  "C1'" . DC  A  1 2  ? 2.419   12.373 13.177 1.00 9.93  ? 2   DC  A "C1'" 1 
ATOM   28  N  N1    . DC  A  1 2  ? 3.807   12.807 12.991 1.00 11.42 ? 2   DC  A N1    1 
ATOM   29  C  C2    . DC  A  1 2  ? 4.186   14.102 13.337 1.00 9.22  ? 2   DC  A C2    1 
ATOM   30  O  O2    . DC  A  1 2  ? 3.321   14.892 13.736 1.00 13.27 ? 2   DC  A O2    1 
ATOM   31  N  N3    . DC  A  1 2  ? 5.490   14.455 13.219 1.00 11.36 ? 2   DC  A N3    1 
ATOM   32  C  C4    . DC  A  1 2  ? 6.401   13.576 12.784 1.00 6.93  ? 2   DC  A C4    1 
ATOM   33  N  N4    . DC  A  1 2  ? 7.661   13.971 12.692 1.00 13.00 ? 2   DC  A N4    1 
ATOM   34  C  C5    . DC  A  1 2  ? 6.037   12.242 12.418 1.00 9.88  ? 2   DC  A C5    1 
ATOM   35  C  C6    . DC  A  1 2  ? 4.724   11.910 12.547 1.00 11.40 ? 2   DC  A C6    1 
ATOM   36  P  P     . DG  A  1 3  ? -1.730  12.634 13.459 1.00 12.72 ? 3   DG  A P     1 
ATOM   37  O  OP1   . DG  A  1 3  ? -2.700  11.777 12.731 1.00 12.38 ? 3   DG  A OP1   1 
ATOM   38  O  OP2   . DG  A  1 3  ? -1.520  14.031 13.023 1.00 13.70 ? 3   DG  A OP2   1 
ATOM   39  O  "O5'" . DG  A  1 3  ? -2.099  12.724 15.013 1.00 9.08  ? 3   DG  A "O5'" 1 
ATOM   40  C  "C5'" . DG  A  1 3  ? -2.485  11.561 15.713 1.00 10.72 ? 3   DG  A "C5'" 1 
ATOM   41  C  "C4'" . DG  A  1 3  ? -1.602  11.336 16.918 1.00 10.49 ? 3   DG  A "C4'" 1 
ATOM   42  O  "O4'" . DG  A  1 3  ? -0.228  11.310 16.509 1.00 12.44 ? 3   DG  A "O4'" 1 
ATOM   43  C  "C3'" . DG  A  1 3  ? -1.625  12.428 17.965 1.00 10.82 ? 3   DG  A "C3'" 1 
ATOM   44  O  "O3'" . DG  A  1 3  ? -2.745  12.265 18.811 1.00 8.96  ? 3   DG  A "O3'" 1 
ATOM   45  C  "C2'" . DG  A  1 3  ? -0.320  12.177 18.719 1.00 10.92 ? 3   DG  A "C2'" 1 
ATOM   46  C  "C1'" . DG  A  1 3  ? 0.561   11.505 17.657 1.00 9.56  ? 3   DG  A "C1'" 1 
ATOM   47  N  N9    . DG  A  1 3  ? 1.723   12.230 17.277 1.00 9.26  ? 3   DG  A N9    1 
ATOM   48  C  C8    . DG  A  1 3  ? 2.010   13.556 17.534 1.00 9.34  ? 3   DG  A C8    1 
ATOM   49  N  N7    . DG  A  1 3  ? 3.215   13.932 17.161 1.00 11.33 ? 3   DG  A N7    1 
ATOM   50  C  C5    . DG  A  1 3  ? 3.777   12.763 16.658 1.00 9.16  ? 3   DG  A C5    1 
ATOM   51  C  C6    . DG  A  1 3  ? 5.074   12.533 16.131 1.00 10.24 ? 3   DG  A C6    1 
ATOM   52  O  O6    . DG  A  1 3  ? 6.021   13.314 16.000 1.00 9.52  ? 3   DG  A O6    1 
ATOM   53  N  N1    . DG  A  1 3  ? 5.228   11.207 15.745 1.00 10.02 ? 3   DG  A N1    1 
ATOM   54  C  C2    . DG  A  1 3  ? 4.279   10.224 15.865 1.00 8.48  ? 3   DG  A C2    1 
ATOM   55  N  N2    . DG  A  1 3  ? 4.628   9.001  15.445 1.00 9.75  ? 3   DG  A N2    1 
ATOM   56  N  N3    . DG  A  1 3  ? 3.070   10.422 16.383 1.00 8.43  ? 3   DG  A N3    1 
ATOM   57  C  C4    . DG  A  1 3  ? 2.886   11.709 16.756 1.00 10.37 ? 3   DG  A C4    1 
ATOM   58  P  P     . DC  A  1 4  ? -3.877  13.397 18.806 1.00 10.54 ? 4   DC  A P     1 
ATOM   59  O  OP1   . DC  A  1 4  ? -4.945  12.971 19.799 1.00 10.59 ? 4   DC  A OP1   1 
ATOM   60  O  OP2   . DC  A  1 4  ? -4.331  13.676 17.396 1.00 11.78 ? 4   DC  A OP2   1 
ATOM   61  O  "O5'" . DC  A  1 4  ? -3.120  14.725 19.348 1.00 12.30 ? 4   DC  A "O5'" 1 
ATOM   62  C  "C5'" . DC  A  1 4  ? -2.522  14.741 20.669 1.00 10.92 ? 4   DC  A "C5'" 1 
ATOM   63  C  "C4'" . DC  A  1 4  ? -1.569  15.910 20.828 1.00 9.91  ? 4   DC  A "C4'" 1 
ATOM   64  O  "O4'" . DC  A  1 4  ? -0.339  15.669 20.128 1.00 11.16 ? 4   DC  A "O4'" 1 
ATOM   65  C  "C3'" . DC  A  1 4  ? -2.034  17.264 20.304 1.00 9.56  ? 4   DC  A "C3'" 1 
ATOM   66  O  "O3'" . DC  A  1 4  ? -2.774  17.842 21.364 1.00 11.07 ? 4   DC  A "O3'" 1 
ATOM   67  C  "C2'" . DC  A  1 4  ? -0.736  18.030 20.048 1.00 10.26 ? 4   DC  A "C2'" 1 
ATOM   68  C  "C1'" . DC  A  1 4  ? 0.124   16.879 19.509 1.00 10.28 ? 4   DC  A "C1'" 1 
ATOM   69  N  N1    . DC  A  1 4  ? 0.183   16.663 18.023 1.00 8.70  ? 4   DC  A N1    1 
ATOM   70  C  C2    . DC  A  1 4  ? 1.282   17.142 17.283 1.00 7.97  ? 4   DC  A C2    1 
ATOM   71  O  O2    . DC  A  1 4  ? 2.130   17.847 17.850 1.00 9.23  ? 4   DC  A O2    1 
ATOM   72  N  N3    . DC  A  1 4  ? 1.378   16.860 15.949 1.00 9.02  ? 4   DC  A N3    1 
ATOM   73  C  C4    . DC  A  1 4  ? 0.425   16.118 15.364 1.00 7.60  ? 4   DC  A C4    1 
ATOM   74  N  N4    . DC  A  1 4  ? 0.554   15.869 14.072 1.00 10.93 ? 4   DC  A N4    1 
ATOM   75  C  C5    . DC  A  1 4  ? -0.705  15.637 16.091 1.00 8.04  ? 4   DC  A C5    1 
ATOM   76  C  C6    . DC  A  1 4  ? -0.772  15.923 17.399 1.00 9.04  ? 4   DC  A C6    1 
ATOM   77  P  P     . DG  A  1 5  ? -3.712  19.071 20.933 1.00 11.89 ? 5   DG  A P     1 
ATOM   78  O  OP1   . DG  A  1 5  ? -4.582  19.405 22.127 1.00 15.06 ? 5   DG  A OP1   1 
ATOM   79  O  OP2   . DG  A  1 5  ? -4.456  18.884 19.639 1.00 12.01 ? 5   DG  A OP2   1 
ATOM   80  O  "O5'" . DG  A  1 5  ? -2.716  20.315 20.729 1.00 13.03 ? 5   DG  A "O5'" 1 
ATOM   81  C  "C5'" . DG  A  1 5  ? -1.782  20.692 21.755 1.00 12.31 ? 5   DG  A "C5'" 1 
ATOM   82  C  "C4'" . DG  A  1 5  ? -0.845  21.711 21.162 1.00 12.72 ? 5   DG  A "C4'" 1 
ATOM   83  O  "O4'" . DG  A  1 5  ? -0.027  21.064 20.163 1.00 9.83  ? 5   DG  A "O4'" 1 
ATOM   84  C  "C3'" . DG  A  1 5  ? -1.544  22.892 20.480 1.00 14.06 ? 5   DG  A "C3'" 1 
ATOM   85  O  "O3'" . DG  A  1 5  ? -1.018  24.107 20.996 1.00 13.50 ? 5   DG  A "O3'" 1 
ATOM   86  C  "C2'" . DG  A  1 5  ? -1.180  22.727 19.010 1.00 10.12 ? 5   DG  A "C2'" 1 
ATOM   87  C  "C1'" . DG  A  1 5  ? 0.134   21.970 19.083 1.00 9.58  ? 5   DG  A "C1'" 1 
ATOM   88  N  N9    . DG  A  1 5  ? 0.424   21.227 17.903 1.00 8.59  ? 5   DG  A N9    1 
ATOM   89  C  C8    . DG  A  1 5  ? 1.559   21.401 17.148 1.00 9.64  ? 5   DG  A C8    1 
ATOM   90  N  N7    . DG  A  1 5  ? 1.580   20.718 16.024 1.00 8.43  ? 5   DG  A N7    1 
ATOM   91  C  C5    . DG  A  1 5  ? 0.332   20.110 16.003 1.00 8.79  ? 5   DG  A C5    1 
ATOM   92  C  C6    . DG  A  1 5  ? -0.231  19.258 15.023 1.00 9.53  ? 5   DG  A C6    1 
ATOM   93  O  O6    . DG  A  1 5  ? 0.266   18.857 13.968 1.00 8.91  ? 5   DG  A O6    1 
ATOM   94  N  N1    . DG  A  1 5  ? -1.496  18.821 15.409 1.00 7.81  ? 5   DG  A N1    1 
ATOM   95  C  C2    . DG  A  1 5  ? -2.152  19.185 16.562 1.00 7.62  ? 5   DG  A C2    1 
ATOM   96  N  N2    . DG  A  1 5  ? -3.374  18.673 16.759 1.00 10.88 ? 5   DG  A N2    1 
ATOM   97  N  N3    . DG  A  1 5  ? -1.634  19.995 17.476 1.00 8.79  ? 5   DG  A N3    1 
ATOM   98  C  C4    . DG  A  1 5  ? -0.394  20.422 17.140 1.00 7.54  ? 5   DG  A C4    1 
ATOM   99  P  P     . DC  A  1 6  ? -1.805  25.473 20.663 1.00 15.64 ? 6   DC  A P     1 
ATOM   100 O  OP1   . DC  A  1 6  ? -1.369  26.480 21.676 1.00 18.80 ? 6   DC  A OP1   1 
ATOM   101 O  OP2   . DC  A  1 6  ? -3.266  25.307 20.470 1.00 17.77 ? 6   DC  A OP2   1 
ATOM   102 O  "O5'" . DC  A  1 6  ? -1.236  25.950 19.222 1.00 12.79 ? 6   DC  A "O5'" 1 
ATOM   103 C  "C5'" . DC  A  1 6  ? 0.182   26.019 18.994 1.00 12.04 ? 6   DC  A "C5'" 1 
ATOM   104 C  "C4'" . DC  A  1 6  ? 0.423   26.080 17.502 1.00 11.15 ? 6   DC  A "C4'" 1 
ATOM   105 O  "O4'" . DC  A  1 6  ? 0.129   24.798 16.872 1.00 11.16 ? 6   DC  A "O4'" 1 
ATOM   106 C  "C3'" . DC  A  1 6  ? -0.388  27.139 16.736 1.00 10.36 ? 6   DC  A "C3'" 1 
ATOM   107 O  "O3'" . DC  A  1 6  ? 0.492   27.818 15.842 1.00 10.89 ? 6   DC  A "O3'" 1 
ATOM   108 C  "C2'" . DC  A  1 6  ? -1.363  26.285 15.942 1.00 11.93 ? 6   DC  A "C2'" 1 
ATOM   109 C  "C1'" . DC  A  1 6  ? -0.457  25.100 15.644 1.00 10.21 ? 6   DC  A "C1'" 1 
ATOM   110 N  N1    . DC  A  1 6  ? -1.102  23.884 15.130 1.00 9.46  ? 6   DC  A N1    1 
ATOM   111 C  C2    . DC  A  1 6  ? -0.356  23.097 14.253 1.00 8.49  ? 6   DC  A C2    1 
ATOM   112 O  O2    . DC  A  1 6  ? 0.824   23.414 14.064 1.00 10.21 ? 6   DC  A O2    1 
ATOM   113 N  N3    . DC  A  1 6  ? -0.939  22.021 13.668 1.00 9.47  ? 6   DC  A N3    1 
ATOM   114 C  C4    . DC  A  1 6  ? -2.213  21.730 13.972 1.00 8.05  ? 6   DC  A C4    1 
ATOM   115 N  N4    . DC  A  1 6  ? -2.756  20.680 13.386 1.00 10.82 ? 6   DC  A N4    1 
ATOM   116 C  C5    . DC  A  1 6  ? -2.979  22.518 14.877 1.00 9.30  ? 6   DC  A C5    1 
ATOM   117 C  C6    . DC  A  1 6  ? -2.388  23.577 15.440 1.00 11.07 ? 6   DC  A C6    1 
ATOM   118 P  P     . DG  A  1 7  ? 0.300   29.341 15.364 1.00 11.68 ? 7   DG  A P     1 
ATOM   119 O  OP1   . DG  A  1 7  ? -0.040  30.146 16.556 1.00 15.65 ? 7   DG  A OP1   1 
ATOM   120 O  OP2   . DG  A  1 7  ? -0.579  29.372 14.171 1.00 13.88 ? 7   DG  A OP2   1 
ATOM   121 O  "O5'" . DG  A  1 7  ? 1.781   29.717 14.908 1.00 10.57 ? 7   DG  A "O5'" 1 
ATOM   122 C  "C5'" . DG  A  1 7  ? 2.808   29.643 15.863 1.00 11.32 ? 7   DG  A "C5'" 1 
ATOM   123 C  "C4'" . DG  A  1 7  ? 4.112   29.269 15.206 1.00 10.44 ? 7   DG  A "C4'" 1 
ATOM   124 O  "O4'" . DG  A  1 7  ? 4.015   27.949 14.641 1.00 10.05 ? 7   DG  A "O4'" 1 
ATOM   125 C  "C3'" . DG  A  1 7  ? 4.534   30.183 14.062 1.00 11.94 ? 7   DG  A "C3'" 1 
ATOM   126 O  "O3'" . DG  A  1 7  ? 5.782   30.688 14.385 1.00 13.97 ? 7   DG  A "O3'" 1 
ATOM   127 C  "C2'" . DG  A  1 7  ? 4.595   29.252 12.837 1.00 12.20 ? 7   DG  A "C2'" 1 
ATOM   128 C  "C1'" . DG  A  1 7  ? 4.821   27.910 13.504 1.00 11.08 ? 7   DG  A "C1'" 1 
ATOM   129 N  N9    . DG  A  1 7  ? 4.427   26.770 12.711 1.00 8.15  ? 7   DG  A N9    1 
ATOM   130 C  C8    . DG  A  1 7  ? 3.190   26.169 12.662 1.00 10.36 ? 7   DG  A C8    1 
ATOM   131 N  N7    . DG  A  1 7  ? 3.142   25.129 11.869 1.00 10.53 ? 7   DG  A N7    1 
ATOM   132 C  C5    . DG  A  1 7  ? 4.428   25.021 11.351 1.00 9.56  ? 7   DG  A C5    1 
ATOM   133 C  C6    . DG  A  1 7  ? 4.994   24.096 10.441 1.00 7.54  ? 7   DG  A C6    1 
ATOM   134 O  O6    . DG  A  1 7  ? 4.445   23.136 9.881  1.00 9.09  ? 7   DG  A O6    1 
ATOM   135 N  N1    . DG  A  1 7  ? 6.341   24.367 10.197 1.00 10.16 ? 7   DG  A N1    1 
ATOM   136 C  C2    . DG  A  1 7  ? 7.056   25.401 10.759 1.00 9.40  ? 7   DG  A C2    1 
ATOM   137 N  N2    . DG  A  1 7  ? 8.348   25.510 10.407 1.00 11.62 ? 7   DG  A N2    1 
ATOM   138 N  N3    . DG  A  1 7  ? 6.536   26.273 11.612 1.00 10.11 ? 7   DG  A N3    1 
ATOM   139 C  C4    . DG  A  1 7  ? 5.226   26.027 11.863 1.00 7.39  ? 7   DG  A C4    1 
ATOM   140 P  P     . DC  A  1 8  ? 6.107   32.248 14.236 1.00 12.46 ? 8   DC  A P     1 
ATOM   141 O  OP1   . DC  A  1 8  ? 6.930   32.666 15.391 1.00 17.45 ? 8   DC  A OP1   1 
ATOM   142 O  OP2   . DC  A  1 8  ? 4.931   33.036 13.822 1.00 11.56 ? 8   DC  A OP2   1 
ATOM   143 O  "O5'" . DC  A  1 8  ? 7.054   32.214 12.962 1.00 18.83 ? 8   DC  A "O5'" 1 
ATOM   144 C  "C5'" . DC  A  1 8  ? 7.989   33.231 12.745 1.00 12.60 ? 8   DC  A "C5'" 1 
ATOM   145 C  "C4'" . DC  A  1 8  ? 9.396   32.675 12.810 1.00 13.18 ? 8   DC  A "C4'" 1 
ATOM   146 O  "O4'" . DC  A  1 8  ? 10.245  33.459 11.939 1.00 14.33 ? 8   DC  A "O4'" 1 
ATOM   147 C  "C3'" . DC  A  1 8  ? 10.047  32.737 14.186 1.00 14.09 ? 8   DC  A "C3'" 1 
ATOM   148 O  "O3'" . DC  A  1 8  ? 10.977  31.673 14.336 1.00 14.36 ? 8   DC  A "O3'" 1 
ATOM   149 C  "C2'" . DC  A  1 8  ? 10.756  34.079 14.146 1.00 12.64 ? 8   DC  A "C2'" 1 
ATOM   150 C  "C1'" . DC  A  1 8  ? 11.238  34.108 12.707 1.00 13.13 ? 8   DC  A "C1'" 1 
ATOM   151 N  N1    . DC  A  1 8  ? 11.412  35.461 12.184 1.00 11.90 ? 8   DC  A N1    1 
ATOM   152 C  C2    . DC  A  1 8  ? 12.699  35.943 11.958 1.00 12.86 ? 8   DC  A C2    1 
ATOM   153 O  O2    . DC  A  1 8  ? 13.665  35.214 12.213 1.00 11.13 ? 8   DC  A O2    1 
ATOM   154 N  N3    . DC  A  1 8  ? 12.848  37.201 11.473 1.00 8.75  ? 8   DC  A N3    1 
ATOM   155 C  C4    . DC  A  1 8  ? 11.782  37.966 11.207 1.00 11.38 ? 8   DC  A C4    1 
ATOM   156 N  N4    . DC  A  1 8  ? 11.986  39.183 10.730 1.00 10.25 ? 8   DC  A N4    1 
ATOM   157 C  C5    . DC  A  1 8  ? 10.451  37.495 11.435 1.00 12.30 ? 8   DC  A C5    1 
ATOM   158 C  C6    . DC  A  1 8  ? 10.325  36.230 11.920 1.00 12.14 ? 8   DC  A C6    1 
ATOM   159 P  P     . DG  A  1 9  ? 11.266  31.062 15.792 1.00 17.21 ? 9   DG  A P     1 
ATOM   160 O  OP1   . DG  A  1 9  ? 11.621  32.166 16.705 1.00 19.82 ? 9   DG  A OP1   1 
ATOM   161 O  OP2   . DG  A  1 9  ? 12.200  29.932 15.603 1.00 18.89 ? 9   DG  A OP2   1 
ATOM   162 O  "O5'" . DG  A  1 9  ? 9.845   30.501 16.258 1.00 14.96 ? 9   DG  A "O5'" 1 
ATOM   163 C  "C5'" . DG  A  1 9  ? 9.163   29.562 15.468 1.00 14.66 ? 9   DG  A "C5'" 1 
ATOM   164 C  "C4'" . DG  A  1 9  ? 8.248   28.747 16.338 1.00 12.85 ? 9   DG  A "C4'" 1 
ATOM   165 O  "O4'" . DG  A  1 9  ? 7.545   27.785 15.510 1.00 11.48 ? 9   DG  A "O4'" 1 
ATOM   166 C  "C3'" . DG  A  1 9  ? 8.973   27.933 17.419 1.00 15.29 ? 9   DG  A "C3'" 1 
ATOM   167 O  "O3'" . DG  A  1 9  ? 8.313   28.084 18.669 1.00 15.16 ? 9   DG  A "O3'" 1 
ATOM   168 C  "C2'" . DG  A  1 9  ? 8.878   26.504 16.900 1.00 13.21 ? 9   DG  A "C2'" 1 
ATOM   169 C  "C1'" . DG  A  1 9  ? 7.555   26.557 16.170 1.00 12.27 ? 9   DG  A "C1'" 1 
ATOM   170 N  N9    . DG  A  1 9  ? 7.403   25.514 15.205 1.00 10.03 ? 9   DG  A N9    1 
ATOM   171 C  C8    . DG  A  1 9  ? 8.339   25.016 14.328 1.00 11.63 ? 9   DG  A C8    1 
ATOM   172 N  N7    . DG  A  1 9  ? 7.890   24.042 13.578 1.00 8.30  ? 9   DG  A N7    1 
ATOM   173 C  C5    . DG  A  1 9  ? 6.567   23.873 13.975 1.00 8.74  ? 9   DG  A C5    1 
ATOM   174 C  C6    . DG  A  1 9  ? 5.567   22.975 13.531 1.00 9.08  ? 9   DG  A C6    1 
ATOM   175 O  O6    . DG  A  1 9  ? 5.651   22.104 12.654 1.00 9.30  ? 9   DG  A O6    1 
ATOM   176 N  N1    . DG  A  1 9  ? 4.365   23.158 14.217 1.00 9.66  ? 9   DG  A N1    1 
ATOM   177 C  C2    . DG  A  1 9  ? 4.153   24.092 15.207 1.00 8.05  ? 9   DG  A C2    1 
ATOM   178 N  N2    . DG  A  1 9  ? 2.927   24.125 15.759 1.00 10.22 ? 9   DG  A N2    1 
ATOM   179 N  N3    . DG  A  1 9  ? 5.083   24.937 15.630 1.00 7.83  ? 9   DG  A N3    1 
ATOM   180 C  C4    . DG  A  1 9  ? 6.259   24.775 14.976 1.00 8.94  ? 9   DG  A C4    1 
ATOM   181 P  P     . DC  A  1 10 ? 8.798   27.248 19.960 1.00 18.81 ? 10  DC  A P     1 
ATOM   182 O  OP1   . DC  A  1 10 ? 8.399   28.066 21.123 1.00 17.71 ? 10  DC  A OP1   1 
ATOM   183 O  OP2   . DC  A  1 10 ? 10.189  26.778 19.790 1.00 17.80 ? 10  DC  A OP2   1 
ATOM   184 O  "O5'" . DC  A  1 10 ? 7.890   25.930 19.928 1.00 16.65 ? 10  DC  A "O5'" 1 
ATOM   185 C  "C5'" . DC  A  1 10 ? 6.529   26.016 20.270 1.00 12.06 ? 10  DC  A "C5'" 1 
ATOM   186 C  "C4'" . DC  A  1 10 ? 5.804   24.713 19.981 1.00 10.61 ? 10  DC  A "C4'" 1 
ATOM   187 O  "O4'" . DC  A  1 10 ? 5.921   24.381 18.588 1.00 9.49  ? 10  DC  A "O4'" 1 
ATOM   188 C  "C3'" . DC  A  1 10 ? 6.350   23.484 20.676 1.00 10.96 ? 10  DC  A "C3'" 1 
ATOM   189 O  "O3'" . DC  A  1 10 ? 5.868   23.428 22.012 1.00 11.78 ? 10  DC  A "O3'" 1 
ATOM   190 C  "C2'" . DC  A  1 10 ? 5.754   22.356 19.823 1.00 9.87  ? 10  DC  A "C2'" 1 
ATOM   191 C  "C1'" . DC  A  1 10 ? 5.565   23.014 18.445 1.00 8.80  ? 10  DC  A "C1'" 1 
ATOM   192 N  N1    . DC  A  1 10 ? 6.412   22.380 17.406 1.00 9.57  ? 10  DC  A N1    1 
ATOM   193 C  C2    . DC  A  1 10 ? 5.883   21.345 16.638 1.00 8.47  ? 10  DC  A C2    1 
ATOM   194 O  O2    . DC  A  1 10 ? 4.717   20.986 16.839 1.00 9.27  ? 10  DC  A O2    1 
ATOM   195 N  N3    . DC  A  1 10 ? 6.671   20.760 15.702 1.00 9.51  ? 10  DC  A N3    1 
ATOM   196 C  C4    . DC  A  1 10 ? 7.930   21.172 15.509 1.00 8.61  ? 10  DC  A C4    1 
ATOM   197 N  N4    . DC  A  1 10 ? 8.652   20.569 14.578 1.00 9.18  ? 10  DC  A N4    1 
ATOM   198 C  C5    . DC  A  1 10 ? 8.496   22.229 16.287 1.00 8.56  ? 10  DC  A C5    1 
ATOM   199 C  C6    . DC  A  1 10 ? 7.688   22.803 17.220 1.00 9.38  ? 10  DC  A C6    1 
ATOM   200 P  P     . DC  A  1 11 ? 6.892   23.221 23.229 1.00 13.27 ? 11  DC  A P     1 
ATOM   201 O  OP1   . DC  A  1 11 ? 6.088   23.216 24.469 1.00 14.58 ? 11  DC  A OP1   1 
ATOM   202 O  OP2   . DC  A  1 11 ? 8.004   24.182 23.081 1.00 13.97 ? 11  DC  A OP2   1 
ATOM   203 O  "O5'" . DC  A  1 11 ? 7.481   21.756 22.982 1.00 15.36 ? 11  DC  A "O5'" 1 
ATOM   204 C  "C5'" . DC  A  1 11 ? 8.438   21.199 23.884 1.00 12.22 ? 11  DC  A "C5'" 1 
ATOM   205 C  "C4'" . DC  A  1 11 ? 9.078   19.943 23.303 1.00 15.65 ? 11  DC  A "C4'" 1 
ATOM   206 O  "O4'" . DC  A  1 11 ? 8.048   18.998 22.933 1.00 12.35 ? 11  DC  A "O4'" 1 
ATOM   207 C  "C3'" . DC  A  1 11 ? 9.887   20.152 22.033 1.00 15.81 ? 11  DC  A "C3'" 1 
ATOM   208 O  "O3'" . DC  A  1 11 ? 10.821  19.096 21.887 1.00 16.24 ? 11  DC  A "O3'" 1 
ATOM   209 C  "C2'" . DC  A  1 11 ? 8.813   20.064 20.962 1.00 14.46 ? 11  DC  A "C2'" 1 
ATOM   210 C  "C1'" . DC  A  1 11 ? 7.921   18.960 21.526 1.00 12.19 ? 11  DC  A "C1'" 1 
ATOM   211 N  N1    . DC  A  1 11 ? 6.502   19.114 21.198 1.00 10.96 ? 11  DC  A N1    1 
ATOM   212 C  C2    . DC  A  1 11 ? 6.089   18.874 19.890 1.00 9.96  ? 11  DC  A C2    1 
ATOM   213 O  O2    . DC  A  1 11 ? 6.934   18.556 19.044 1.00 10.87 ? 11  DC  A O2    1 
ATOM   214 N  N3    . DC  A  1 11 ? 4.773   19.005 19.587 1.00 8.61  ? 11  DC  A N3    1 
ATOM   215 C  C4    . DC  A  1 11 ? 3.884   19.351 20.526 1.00 11.22 ? 11  DC  A C4    1 
ATOM   216 N  N4    . DC  A  1 11 ? 2.612   19.460 20.176 1.00 10.80 ? 11  DC  A N4    1 
ATOM   217 C  C5    . DC  A  1 11 ? 4.284   19.607 21.875 1.00 9.88  ? 11  DC  A C5    1 
ATOM   218 C  C6    . DC  A  1 11 ? 5.608   19.467 22.156 1.00 12.02 ? 11  DC  A C6    1 
ATOM   219 P  P     . DG  A  1 12 ? 12.207  19.350 21.120 1.00 20.22 ? 12  DG  A P     1 
ATOM   220 O  OP1   . DG  A  1 12 ? 13.198  19.739 22.142 1.00 24.24 ? 12  DG  A OP1   1 
ATOM   221 O  OP2   . DG  A  1 12 ? 11.943  20.283 20.008 1.00 19.76 ? 12  DG  A OP2   1 
ATOM   222 O  "O5'" . DG  A  1 12 ? 12.621  17.930 20.528 1.00 21.07 ? 12  DG  A "O5'" 1 
ATOM   223 C  "C5'" . DG  A  1 12 ? 11.743  17.227 19.661 1.00 17.62 ? 12  DG  A "C5'" 1 
ATOM   224 C  "C4'" . DG  A  1 12 ? 11.209  15.991 20.355 1.00 17.01 ? 12  DG  A "C4'" 1 
ATOM   225 O  "O4'" . DG  A  1 12 ? 9.857   16.223 20.784 1.00 16.87 ? 12  DG  A "O4'" 1 
ATOM   226 C  "C3'" . DG  A  1 12 ? 11.134  14.749 19.493 1.00 16.40 ? 12  DG  A "C3'" 1 
ATOM   227 O  "O3'" . DG  A  1 12 ? 12.390  14.072 19.547 1.00 17.37 ? 12  DG  A "O3'" 1 
ATOM   228 C  "C2'" . DG  A  1 12 ? 10.026  13.933 20.167 1.00 16.72 ? 12  DG  A "C2'" 1 
ATOM   229 C  "C1'" . DG  A  1 12 ? 9.178   14.990 20.884 1.00 14.57 ? 12  DG  A "C1'" 1 
ATOM   230 N  N9    . DG  A  1 12 ? 7.874   15.168 20.305 1.00 15.79 ? 12  DG  A N9    1 
ATOM   231 C  C8    . DG  A  1 12 ? 7.518   15.019 18.984 1.00 14.07 ? 12  DG  A C8    1 
ATOM   232 N  N7    . DG  A  1 12 ? 6.254   15.263 18.749 1.00 11.73 ? 12  DG  A N7    1 
ATOM   233 C  C5    . DG  A  1 12 ? 5.724   15.598 19.991 1.00 11.99 ? 12  DG  A C5    1 
ATOM   234 C  C6    . DG  A  1 12 ? 4.411   15.960 20.378 1.00 12.35 ? 12  DG  A C6    1 
ATOM   235 O  O6    . DG  A  1 12 ? 3.402   16.065 19.667 1.00 12.25 ? 12  DG  A O6    1 
ATOM   236 N  N1    . DG  A  1 12 ? 4.328   16.216 21.747 1.00 12.88 ? 12  DG  A N1    1 
ATOM   237 C  C2    . DG  A  1 12 ? 5.378   16.133 22.635 1.00 14.84 ? 12  DG  A C2    1 
ATOM   238 N  N2    . DG  A  1 12 ? 5.111   16.416 23.922 1.00 17.97 ? 12  DG  A N2    1 
ATOM   239 N  N3    . DG  A  1 12 ? 6.610   15.795 22.282 1.00 12.72 ? 12  DG  A N3    1 
ATOM   240 C  C4    . DG  A  1 12 ? 6.713   15.542 20.954 1.00 12.74 ? 12  DG  A C4    1 
ATOM   241 P  P     . DC  A  1 13 ? 12.651  12.737 18.690 1.00 19.61 ? 13  DC  A P     1 
ATOM   242 O  OP1   . DC  A  1 13 ? 11.770  11.653 19.175 1.00 21.48 ? 13  DC  A OP1   1 
ATOM   243 O  OP2   . DC  A  1 13 ? 14.117  12.538 18.647 1.00 21.05 ? 13  DC  A OP2   1 
ATOM   244 O  "O5'" . DC  A  1 13 ? 12.193  13.123 17.214 1.00 17.05 ? 13  DC  A "O5'" 1 
ATOM   245 C  "C5'" . DC  A  1 13 ? 12.957  14.037 16.459 1.00 16.72 ? 13  DC  A "C5'" 1 
ATOM   246 C  "C4'" . DC  A  1 13 ? 12.586  13.943 14.995 1.00 14.55 ? 13  DC  A "C4'" 1 
ATOM   247 O  "O4'" . DC  A  1 13 ? 11.184  14.266 14.825 1.00 15.05 ? 13  DC  A "O4'" 1 
ATOM   248 C  "C3'" . DC  A  1 13 ? 13.382  14.862 14.085 1.00 14.07 ? 13  DC  A "C3'" 1 
ATOM   249 O  "O3'" . DC  A  1 13 ? 14.205  14.076 13.236 1.00 16.36 ? 13  DC  A "O3'" 1 
ATOM   250 C  "C2'" . DC  A  1 13 ? 12.331  15.657 13.289 1.00 13.61 ? 13  DC  A "C2'" 1 
ATOM   251 C  "C1'" . DC  A  1 13 ? 11.021  15.424 14.043 1.00 12.96 ? 13  DC  A "C1'" 1 
ATOM   252 N  N1    . DC  A  1 13 ? 10.629  16.508 14.964 1.00 11.90 ? 13  DC  A N1    1 
ATOM   253 C  C2    . DC  A  1 13 ? 9.318   16.545 15.432 1.00 12.04 ? 13  DC  A C2    1 
ATOM   254 O  O2    . DC  A  1 13 ? 8.516   15.691 15.036 1.00 8.65  ? 13  DC  A O2    1 
ATOM   255 N  N3    . DC  A  1 13 ? 8.965   17.524 16.302 1.00 11.13 ? 13  DC  A N3    1 
ATOM   256 C  C4    . DC  A  1 13 ? 9.857   18.435 16.711 1.00 11.48 ? 13  DC  A C4    1 
ATOM   257 N  N4    . DC  A  1 13 ? 9.459   19.365 17.564 1.00 10.88 ? 13  DC  A N4    1 
ATOM   258 C  C5    . DC  A  1 13 ? 11.207  18.420 16.241 1.00 10.66 ? 13  DC  A C5    1 
ATOM   259 C  C6    . DC  A  1 13 ? 11.541  17.428 15.371 1.00 13.69 ? 13  DC  A C6    1 
ATOM   260 P  P     . DG  A  1 14 ? 15.174  14.783 12.169 1.00 19.43 ? 14  DG  A P     1 
ATOM   261 O  OP1   . DG  A  1 14 ? 16.264  13.832 11.860 1.00 21.44 ? 14  DG  A OP1   1 
ATOM   262 O  OP2   . DG  A  1 14 ? 15.486  16.148 12.639 1.00 17.19 ? 14  DG  A OP2   1 
ATOM   263 O  "O5'" . DG  A  1 14 ? 14.261  14.957 10.877 1.00 15.89 ? 14  DG  A "O5'" 1 
ATOM   264 C  "C5'" . DG  A  1 14 ? 13.704  13.823 10.263 1.00 18.28 ? 14  DG  A "C5'" 1 
ATOM   265 C  "C4'" . DG  A  1 14 ? 12.695  14.226 9.208  1.00 17.60 ? 14  DG  A "C4'" 1 
ATOM   266 O  "O4'" . DG  A  1 14 ? 11.513  14.789 9.833  1.00 16.84 ? 14  DG  A "O4'" 1 
ATOM   267 C  "C3'" . DG  A  1 14 ? 13.171  15.273 8.204  1.00 18.28 ? 14  DG  A "C3'" 1 
ATOM   268 O  "O3'" . DG  A  1 14 ? 12.636  14.935 6.939  1.00 21.47 ? 14  DG  A "O3'" 1 
ATOM   269 C  "C2'" . DG  A  1 14 ? 12.564  16.572 8.751  1.00 16.82 ? 14  DG  A "C2'" 1 
ATOM   270 C  "C1'" . DG  A  1 14 ? 11.232  16.054 9.264  1.00 15.29 ? 14  DG  A "C1'" 1 
ATOM   271 N  N9    . DG  A  1 14 ? 10.609  16.853 10.300 1.00 11.68 ? 14  DG  A N9    1 
ATOM   272 C  C8    . DG  A  1 14 ? 11.172  17.806 11.119 1.00 13.73 ? 14  DG  A C8    1 
ATOM   273 N  N7    . DG  A  1 14 ? 10.333  18.319 11.982 1.00 11.91 ? 14  DG  A N7    1 
ATOM   274 C  C5    . DG  A  1 14 ? 9.128   17.672 11.730 1.00 12.87 ? 14  DG  A C5    1 
ATOM   275 C  C6    . DG  A  1 14 ? 7.855   17.799 12.336 1.00 12.79 ? 14  DG  A C6    1 
ATOM   276 O  O6    . DG  A  1 14 ? 7.519   18.546 13.266 1.00 9.25  ? 14  DG  A O6    1 
ATOM   277 N  N1    . DG  A  1 14 ? 6.918   16.942 11.758 1.00 10.55 ? 14  DG  A N1    1 
ATOM   278 C  C2    . DG  A  1 14 ? 7.175   16.069 10.723 1.00 10.86 ? 14  DG  A C2    1 
ATOM   279 N  N2    . DG  A  1 14 ? 6.147   15.318 10.291 1.00 11.00 ? 14  DG  A N2    1 
ATOM   280 N  N3    . DG  A  1 14 ? 8.363   15.943 10.148 1.00 11.60 ? 14  DG  A N3    1 
ATOM   281 C  C4    . DG  A  1 14 ? 9.288   16.768 10.696 1.00 12.63 ? 14  DG  A C4    1 
ATOM   282 P  P     . DA  A  1 15 ? 13.229  15.574 5.597  1.00 24.74 ? 15  DA  A P     1 
ATOM   283 O  OP1   . DA  A  1 15 ? 12.765  14.737 4.470  1.00 23.21 ? 15  DA  A OP1   1 
ATOM   284 O  OP2   . DA  A  1 15 ? 14.682  15.798 5.802  1.00 24.10 ? 15  DA  A OP2   1 
ATOM   285 O  "O5'" . DA  A  1 15 ? 12.521  17.001 5.531  1.00 21.39 ? 15  DA  A "O5'" 1 
ATOM   286 C  "C5'" . DA  A  1 15 ? 11.490  17.243 4.574  1.00 20.96 ? 15  DA  A "C5'" 1 
ATOM   287 C  "C4'" . DA  A  1 15 ? 10.155  16.642 4.996  1.00 21.61 ? 15  DA  A "C4'" 1 
ATOM   288 O  "O4'" . DA  A  1 15 ? 9.882   16.964 6.383  1.00 19.86 ? 15  DA  A "O4'" 1 
ATOM   289 C  "C3'" . DA  A  1 15 ? 8.969   17.163 4.184  1.00 20.17 ? 15  DA  A "C3'" 1 
ATOM   290 O  "O3'" . DA  A  1 15 ? 8.223   16.103 3.630  1.00 22.80 ? 15  DA  A "O3'" 1 
ATOM   291 C  "C2'" . DA  A  1 15 ? 8.140   17.990 5.167  1.00 17.56 ? 15  DA  A "C2'" 1 
ATOM   292 C  "C1'" . DA  A  1 15 ? 8.561   17.453 6.523  1.00 16.81 ? 15  DA  A "C1'" 1 
ATOM   293 N  N9    . DA  A  1 15 ? 8.570   18.478 7.550  1.00 13.10 ? 15  DA  A N9    1 
ATOM   294 C  C8    . DA  A  1 15 ? 9.595   19.347 7.829  1.00 14.81 ? 15  DA  A C8    1 
ATOM   295 N  N7    . DA  A  1 15 ? 9.335   20.169 8.812  1.00 14.77 ? 15  DA  A N7    1 
ATOM   296 C  C5    . DA  A  1 15 ? 8.049   19.831 9.214  1.00 12.35 ? 15  DA  A C5    1 
ATOM   297 C  C6    . DA  A  1 15 ? 7.200   20.337 10.232 1.00 11.25 ? 15  DA  A C6    1 
ATOM   298 N  N6    . DA  A  1 15 ? 7.550   21.326 11.063 1.00 10.25 ? 15  DA  A N6    1 
ATOM   299 N  N1    . DA  A  1 15 ? 5.976   19.780 10.372 1.00 9.62  ? 15  DA  A N1    1 
ATOM   300 C  C2    . DA  A  1 15 ? 5.633   18.779 9.550  1.00 8.50  ? 15  DA  A C2    1 
ATOM   301 N  N3    . DA  A  1 15 ? 6.346   18.211 8.560  1.00 11.13 ? 15  DA  A N3    1 
ATOM   302 C  C4    . DA  A  1 15 ? 7.559   18.791 8.444  1.00 13.13 ? 15  DA  A C4    1 
ATOM   303 P  P     . DA  A  1 16 ? 7.444   16.349 2.247  1.00 22.92 ? 16  DA  A P     1 
ATOM   304 O  OP1   . DA  A  1 16 ? 7.771   15.225 1.337  1.00 24.62 ? 16  DA  A OP1   1 
ATOM   305 O  OP2   . DA  A  1 16 ? 7.712   17.744 1.841  1.00 23.45 ? 16  DA  A OP2   1 
ATOM   306 O  "O5'" . DA  A  1 16 ? 5.903   16.270 2.652  1.00 17.04 ? 16  DA  A "O5'" 1 
ATOM   307 C  "C5'" . DA  A  1 16 ? 5.233   15.032 2.652  1.00 16.39 ? 16  DA  A "C5'" 1 
ATOM   308 C  "C4'" . DA  A  1 16 ? 3.810   15.219 3.120  1.00 14.22 ? 16  DA  A "C4'" 1 
ATOM   309 O  "O4'" . DA  A  1 16 ? 3.829   15.614 4.513  1.00 13.21 ? 16  DA  A "O4'" 1 
ATOM   310 C  "C3'" . DA  A  1 16 ? 3.051   16.323 2.406  1.00 14.41 ? 16  DA  A "C3'" 1 
ATOM   311 O  "O3'" . DA  A  1 16 ? 2.405   15.806 1.243  1.00 16.75 ? 16  DA  A "O3'" 1 
ATOM   312 C  "C2'" . DA  A  1 16 ? 2.036   16.747 3.457  1.00 11.74 ? 16  DA  A "C2'" 1 
ATOM   313 C  "C1'" . DA  A  1 16 ? 2.826   16.577 4.755  1.00 11.81 ? 16  DA  A "C1'" 1 
ATOM   314 N  N9    . DA  A  1 16 ? 3.480   17.783 5.207  1.00 9.41  ? 16  DA  A N9    1 
ATOM   315 C  C8    . DA  A  1 16 ? 4.519   18.451 4.608  1.00 9.80  ? 16  DA  A C8    1 
ATOM   316 N  N7    . DA  A  1 16 ? 4.908   19.514 5.263  1.00 10.74 ? 16  DA  A N7    1 
ATOM   317 C  C5    . DA  A  1 16 ? 4.071   19.563 6.370  1.00 9.07  ? 16  DA  A C5    1 
ATOM   318 C  C6    . DA  A  1 16 ? 3.986   20.462 7.465  1.00 7.96  ? 16  DA  A C6    1 
ATOM   319 N  N6    . DA  A  1 16 ? 4.795   21.517 7.623  1.00 9.26  ? 16  DA  A N6    1 
ATOM   320 N  N1    . DA  A  1 16 ? 3.039   20.230 8.403  1.00 8.72  ? 16  DA  A N1    1 
ATOM   321 C  C2    . DA  A  1 16 ? 2.240   19.166 8.253  1.00 8.78  ? 16  DA  A C2    1 
ATOM   322 N  N3    . DA  A  1 16 ? 2.229   18.244 7.272  1.00 8.79  ? 16  DA  A N3    1 
ATOM   323 C  C4    . DA  A  1 16 ? 3.180   18.505 6.352  1.00 9.00  ? 16  DA  A C4    1 
ATOM   324 O  "O5'" . DC  B  1 1  ? 3.801   32.864 11.459 1.00 11.84 ? 1   DC  B "O5'" 1 
ATOM   325 C  "C5'" . DC  B  1 1  ? 4.738   33.187 10.443 1.00 12.13 ? 1   DC  B "C5'" 1 
ATOM   326 C  "C4'" . DC  B  1 1  ? 4.226   32.763 9.076  1.00 10.38 ? 1   DC  B "C4'" 1 
ATOM   327 O  "O4'" . DC  B  1 1  ? 3.952   31.338 9.086  1.00 11.16 ? 1   DC  B "O4'" 1 
ATOM   328 C  "C3'" . DC  B  1 1  ? 2.909   33.387 8.662  1.00 10.32 ? 1   DC  B "C3'" 1 
ATOM   329 O  "O3'" . DC  B  1 1  ? 3.130   34.672 8.097  1.00 10.57 ? 1   DC  B "O3'" 1 
ATOM   330 C  "C2'" . DC  B  1 1  ? 2.421   32.393 7.622  1.00 10.32 ? 1   DC  B "C2'" 1 
ATOM   331 C  "C1'" . DC  B  1 1  ? 2.837   31.068 8.255  1.00 10.96 ? 1   DC  B "C1'" 1 
ATOM   332 N  N1    . DC  B  1 1  ? 1.772   30.428 9.081  1.00 8.52  ? 1   DC  B N1    1 
ATOM   333 C  C2    . DC  B  1 1  ? 0.784   29.672 8.453  1.00 7.09  ? 1   DC  B C2    1 
ATOM   334 O  O2    . DC  B  1 1  ? 0.804   29.568 7.221  1.00 11.57 ? 1   DC  B O2    1 
ATOM   335 N  N3    . DC  B  1 1  ? -0.170  29.084 9.216  1.00 8.81  ? 1   DC  B N3    1 
ATOM   336 C  C4    . DC  B  1 1  ? -0.163  29.217 10.548 1.00 8.80  ? 1   DC  B C4    1 
ATOM   337 N  N4    . DC  B  1 1  ? -1.116  28.617 11.244 1.00 9.31  ? 1   DC  B N4    1 
ATOM   338 C  C5    . DC  B  1 1  ? 0.837   29.990 11.215 1.00 10.94 ? 1   DC  B C5    1 
ATOM   339 C  C6    . DC  B  1 1  ? 1.786   30.570 10.431 1.00 6.28  ? 1   DC  B C6    1 
ATOM   340 P  P     . DC  B  1 2  ? 2.329   35.942 8.659  1.00 12.33 ? 2   DC  B P     1 
ATOM   341 O  OP1   . DC  B  1 2  ? 2.718   37.111 7.841  1.00 14.85 ? 2   DC  B OP1   1 
ATOM   342 O  OP2   . DC  B  1 2  ? 2.498   35.982 10.121 1.00 15.24 ? 2   DC  B OP2   1 
ATOM   343 O  "O5'" . DC  B  1 2  ? 0.804   35.593 8.371  1.00 9.85  ? 2   DC  B "O5'" 1 
ATOM   344 C  "C5'" . DC  B  1 2  ? -0.195  36.401 8.918  1.00 11.42 ? 2   DC  B "C5'" 1 
ATOM   345 C  "C4'" . DC  B  1 2  ? -1.493  35.636 9.050  1.00 11.59 ? 2   DC  B "C4'" 1 
ATOM   346 O  "O4'" . DC  B  1 2  ? -1.907  35.115 7.764  1.00 12.24 ? 2   DC  B "O4'" 1 
ATOM   347 C  "C3'" . DC  B  1 2  ? -1.460  34.425 9.956  1.00 11.92 ? 2   DC  B "C3'" 1 
ATOM   348 O  "O3'" . DC  B  1 2  ? -2.783  34.197 10.371 1.00 12.12 ? 2   DC  B "O3'" 1 
ATOM   349 C  "C2'" . DC  B  1 2  ? -0.995  33.328 8.989  1.00 9.05  ? 2   DC  B "C2'" 1 
ATOM   350 C  "C1'" . DC  B  1 2  ? -1.829  33.697 7.778  1.00 11.08 ? 2   DC  B "C1'" 1 
ATOM   351 N  N1    . DC  B  1 2  ? -1.319  33.265 6.459  1.00 11.20 ? 2   DC  B N1    1 
ATOM   352 C  C2    . DC  B  1 2  ? -1.595  31.981 5.993  1.00 10.60 ? 2   DC  B C2    1 
ATOM   353 O  O2    . DC  B  1 2  ? -2.210  31.198 6.727  1.00 13.51 ? 2   DC  B O2    1 
ATOM   354 N  N3    . DC  B  1 2  ? -1.172  31.632 4.753  1.00 11.99 ? 2   DC  B N3    1 
ATOM   355 C  C4    . DC  B  1 2  ? -0.508  32.503 3.984  1.00 7.10  ? 2   DC  B C4    1 
ATOM   356 N  N4    . DC  B  1 2  ? -0.123  32.111 2.780  1.00 12.39 ? 2   DC  B N4    1 
ATOM   357 C  C5    . DC  B  1 2  ? -0.209  33.825 4.440  1.00 10.43 ? 2   DC  B C5    1 
ATOM   358 C  C6    . DC  B  1 2  ? -0.644  34.154 5.687  1.00 11.23 ? 2   DC  B C6    1 
ATOM   359 P  P     . DG  B  1 3  ? -3.113  33.415 11.722 1.00 12.82 ? 3   DG  B P     1 
ATOM   360 O  OP1   . DG  B  1 3  ? -2.648  34.280 12.834 1.00 12.91 ? 3   DG  B OP1   1 
ATOM   361 O  OP2   . DG  B  1 3  ? -2.594  32.033 11.623 1.00 13.44 ? 3   DG  B OP2   1 
ATOM   362 O  "O5'" . DG  B  1 3  ? -4.708  33.332 11.711 1.00 10.00 ? 3   DG  B "O5'" 1 
ATOM   363 C  "C5'" . DG  B  1 3  ? -5.470  34.497 11.918 1.00 11.80 ? 3   DG  B "C5'" 1 
ATOM   364 C  "C4'" . DG  B  1 3  ? -6.425  34.731 10.771 1.00 10.19 ? 3   DG  B "C4'" 1 
ATOM   365 O  "O4'" . DG  B  1 3  ? -5.698  34.737 9.536  1.00 12.39 ? 3   DG  B "O4'" 1 
ATOM   366 C  "C3'" . DG  B  1 3  ? -7.459  33.650 10.545 1.00 10.37 ? 3   DG  B "C3'" 1 
ATOM   367 O  "O3'" . DG  B  1 3  ? -8.541  33.809 11.436 1.00 9.27  ? 3   DG  B "O3'" 1 
ATOM   368 C  "C2'" . DG  B  1 3  ? -7.884  33.914 9.101  1.00 10.13 ? 3   DG  B "C2'" 1 
ATOM   369 C  "C1'" . DG  B  1 3  ? -6.636  34.571 8.500  1.00 9.81  ? 3   DG  B "C1'" 1 
ATOM   370 N  N9    . DG  B  1 3  ? -6.013  33.834 7.452  1.00 9.26  ? 3   DG  B N9    1 
ATOM   371 C  C8    . DG  B  1 3  ? -6.213  32.516 7.109  1.00 9.22  ? 3   DG  B C8    1 
ATOM   372 N  N7    . DG  B  1 3  ? -5.572  32.139 6.021  1.00 9.62  ? 3   DG  B N7    1 
ATOM   373 C  C5    . DG  B  1 3  ? -4.945  33.305 5.595  1.00 9.94  ? 3   DG  B C5    1 
ATOM   374 C  C6    . DG  B  1 3  ? -4.125  33.536 4.460  1.00 9.87  ? 3   DG  B C6    1 
ATOM   375 O  O6    . DG  B  1 3  ? -3.791  32.760 3.559  1.00 8.36  ? 3   DG  B O6    1 
ATOM   376 N  N1    . DG  B  1 3  ? -3.700  34.859 4.415  1.00 9.87  ? 3   DG  B N1    1 
ATOM   377 C  C2    . DG  B  1 3  ? -4.025  35.836 5.324  1.00 8.71  ? 3   DG  B C2    1 
ATOM   378 N  N2    . DG  B  1 3  ? -3.522  37.056 5.103  1.00 9.32  ? 3   DG  B N2    1 
ATOM   379 N  N3    . DG  B  1 3  ? -4.815  35.634 6.373  1.00 9.68  ? 3   DG  B N3    1 
ATOM   380 C  C4    . DG  B  1 3  ? -5.233  34.353 6.448  1.00 11.34 ? 3   DG  B C4    1 
ATOM   381 P  P     . DC  B  1 4  ? -8.790  32.657 12.523 1.00 10.87 ? 4   DC  B P     1 
ATOM   382 O  OP1   . DC  B  1 4  ? -9.983  33.138 13.304 1.00 11.11 ? 4   DC  B OP1   1 
ATOM   383 O  OP2   . DC  B  1 4  ? -7.540  32.378 13.296 1.00 11.84 ? 4   DC  B OP2   1 
ATOM   384 O  "O5'" . DC  B  1 4  ? -9.155  31.320 11.709 1.00 12.17 ? 4   DC  B "O5'" 1 
ATOM   385 C  "C5'" . DC  B  1 4  ? -10.233 31.352 10.743 1.00 9.77  ? 4   DC  B "C5'" 1 
ATOM   386 C  "C4'" . DC  B  1 4  ? -10.108 30.189 9.785  1.00 10.57 ? 4   DC  B "C4'" 1 
ATOM   387 O  "O4'" . DC  B  1 4  ? -9.025  30.403 8.852  1.00 9.56  ? 4   DC  B "O4'" 1 
ATOM   388 C  "C3'" . DC  B  1 4  ? -9.781  28.854 10.438 1.00 9.50  ? 4   DC  B "C3'" 1 
ATOM   389 O  "O3'" . DC  B  1 4  ? -10.984 28.210 10.844 1.00 10.65 ? 4   DC  B "O3'" 1 
ATOM   390 C  "C2'" . DC  B  1 4  ? -9.123  28.089 9.302  1.00 11.04 ? 4   DC  B "C2'" 1 
ATOM   391 C  "C1'" . DC  B  1 4  ? -8.402  29.175 8.526  1.00 10.15 ? 4   DC  B "C1'" 1 
ATOM   392 N  N1    . DC  B  1 4  ? -6.966  29.376 8.821  1.00 9.62  ? 4   DC  B N1    1 
ATOM   393 C  C2    . DC  B  1 4  ? -6.019  28.930 7.893  1.00 7.95  ? 4   DC  B C2    1 
ATOM   394 O  O2    . DC  B  1 4  ? -6.409  28.244 6.936  1.00 9.79  ? 4   DC  B O2    1 
ATOM   395 N  N3    . DC  B  1 4  ? -4.708  29.224 8.099  1.00 9.08  ? 4   DC  B N3    1 
ATOM   396 C  C4    . DC  B  1 4  ? -4.356  29.936 9.187  1.00 6.79  ? 4   DC  B C4    1 
ATOM   397 N  N4    . DC  B  1 4  ? -3.072  30.197 9.358  1.00 11.00 ? 4   DC  B N4    1 
ATOM   398 C  C5    . DC  B  1 4  ? -5.311  30.393 10.139 1.00 7.07  ? 4   DC  B C5    1 
ATOM   399 C  C6    . DC  B  1 4  ? -6.593  30.101 9.905  1.00 8.86  ? 4   DC  B C6    1 
ATOM   400 P  P     . DG  B  1 5  ? -10.855 26.979 11.871 1.00 12.92 ? 5   DG  B P     1 
ATOM   401 O  OP1   . DG  B  1 5  ? -12.212 26.630 12.454 1.00 14.97 ? 5   DG  B OP1   1 
ATOM   402 O  OP2   . DG  B  1 5  ? -9.780  27.190 12.885 1.00 12.50 ? 5   DG  B OP2   1 
ATOM   403 O  "O5'" . DG  B  1 5  ? -10.385 25.751 10.951 1.00 12.69 ? 5   DG  B "O5'" 1 
ATOM   404 C  "C5'" . DG  B  1 5  ? -11.186 25.326 9.838  1.00 11.56 ? 5   DG  B "C5'" 1 
ATOM   405 C  "C4'" . DG  B  1 5  ? -10.378 24.336 9.044  1.00 13.48 ? 5   DG  B "C4'" 1 
ATOM   406 O  "O4'" . DG  B  1 5  ? -9.218  25.004 8.503  1.00 10.94 ? 5   DG  B "O4'" 1 
ATOM   407 C  "C3'" . DG  B  1 5  ? -9.876  23.151 9.874  1.00 14.07 ? 5   DG  B "C3'" 1 
ATOM   408 O  "O3'" . DG  B  1 5  ? -10.269 21.942 9.240  1.00 12.96 ? 5   DG  B "O3'" 1 
ATOM   409 C  "C2'" . DG  B  1 5  ? -8.361  23.314 9.860  1.00 11.21 ? 5   DG  B "C2'" 1 
ATOM   410 C  "C1'" . DG  B  1 5  ? -8.129  24.096 8.578  1.00 9.71  ? 5   DG  B "C1'" 1 
ATOM   411 N  N9    . DG  B  1 5  ? -6.871  24.881 8.555  1.00 9.20  ? 5   DG  B N9    1 
ATOM   412 C  C8    . DG  B  1 5  ? -5.902  24.748 7.593  1.00 9.66  ? 5   DG  B C8    1 
ATOM   413 N  N7    . DG  B  1 5  ? -4.800  25.410 7.852  1.00 6.94  ? 5   DG  B N7    1 
ATOM   414 C  C5    . DG  B  1 5  ? -5.040  25.952 9.110  1.00 9.87  ? 5   DG  B C5    1 
ATOM   415 C  C6    . DG  B  1 5  ? -4.200  26.758 9.915  1.00 9.99  ? 5   DG  B C6    1 
ATOM   416 O  O6    . DG  B  1 5  ? -3.059  27.173 9.675  1.00 9.06  ? 5   DG  B O6    1 
ATOM   417 N  N1    . DG  B  1 5  ? -4.850  27.115 11.098 1.00 7.78  ? 5   DG  B N1    1 
ATOM   418 C  C2    . DG  B  1 5  ? -6.113  26.717 11.476 1.00 9.16  ? 5   DG  B C2    1 
ATOM   419 N  N2    . DG  B  1 5  ? -6.578  27.158 12.650 1.00 13.78 ? 5   DG  B N2    1 
ATOM   420 N  N3    . DG  B  1 5  ? -6.898  25.962 10.722 1.00 9.74  ? 5   DG  B N3    1 
ATOM   421 C  C4    . DG  B  1 5  ? -6.297  25.607 9.566  1.00 8.18  ? 5   DG  B C4    1 
ATOM   422 P  P     . DC  B  1 6  ? -10.118 20.602 10.116 1.00 15.51 ? 6   DC  B P     1 
ATOM   423 O  OP1   . DC  B  1 6  ? -11.026 19.565 9.532  1.00 17.42 ? 6   DC  B OP1   1 
ATOM   424 O  OP2   . DC  B  1 6  ? -10.176 20.801 11.584 1.00 16.75 ? 6   DC  B OP2   1 
ATOM   425 O  "O5'" . DC  B  1 6  ? -8.594  20.102 9.870  1.00 13.56 ? 6   DC  B "O5'" 1 
ATOM   426 C  "C5'" . DC  B  1 6  ? -8.090  19.967 8.535  1.00 11.53 ? 6   DC  B "C5'" 1 
ATOM   427 C  "C4'" . DC  B  1 6  ? -6.585  19.890 8.609  1.00 11.11 ? 6   DC  B "C4'" 1 
ATOM   428 O  "O4'" . DC  B  1 6  ? -6.052  21.185 8.982  1.00 10.35 ? 6   DC  B "O4'" 1 
ATOM   429 C  "C3'" . DC  B  1 6  ? -6.016  18.881 9.614  1.00 10.55 ? 6   DC  B "C3'" 1 
ATOM   430 O  "O3'" . DC  B  1 6  ? -4.877  18.259 9.022  1.00 10.83 ? 6   DC  B "O3'" 1 
ATOM   431 C  "C2'" . DC  B  1 6  ? -5.566  19.784 10.749 1.00 11.23 ? 6   DC  B "C2'" 1 
ATOM   432 C  "C1'" . DC  B  1 6  ? -5.031  20.943 9.916  1.00 10.94 ? 6   DC  B "C1'" 1 
ATOM   433 N  N1    . DC  B  1 6  ? -4.695  22.195 10.629 1.00 9.87  ? 6   DC  B N1    1 
ATOM   434 C  C2    . DC  B  1 6  ? -3.571  22.913 10.199 1.00 8.15  ? 6   DC  B C2    1 
ATOM   435 O  O2    . DC  B  1 6  ? -3.083  22.603 9.110  1.00 9.88  ? 6   DC  B O2    1 
ATOM   436 N  N3    . DC  B  1 6  ? -3.120  23.970 10.926 1.00 10.28 ? 6   DC  B N3    1 
ATOM   437 C  C4    . DC  B  1 6  ? -3.753  24.279 12.071 1.00 8.83  ? 6   DC  B C4    1 
ATOM   438 N  N4    . DC  B  1 6  ? -3.293  25.299 12.775 1.00 9.22  ? 6   DC  B N4    1 
ATOM   439 C  C5    . DC  B  1 6  ? -4.863  23.529 12.549 1.00 9.02  ? 6   DC  B C5    1 
ATOM   440 C  C6    . DC  B  1 6  ? -5.281  22.488 11.820 1.00 11.02 ? 6   DC  B C6    1 
ATOM   441 P  P     . DG  B  1 7  ? -4.477  16.723 9.287  1.00 11.95 ? 7   DG  B P     1 
ATOM   442 O  OP1   . DG  B  1 7  ? -5.710  15.915 9.320  1.00 15.09 ? 7   DG  B OP1   1 
ATOM   443 O  OP2   . DG  B  1 7  ? -3.541  16.680 10.435 1.00 13.69 ? 7   DG  B OP2   1 
ATOM   444 O  "O5'" . DG  B  1 7  ? -3.686  16.351 7.954  1.00 10.82 ? 7   DG  B "O5'" 1 
ATOM   445 C  "C5'" . DG  B  1 7  ? -4.375  16.442 6.730  1.00 12.12 ? 7   DG  B "C5'" 1 
ATOM   446 C  "C4'" . DG  B  1 7  ? -3.428  16.806 5.618  1.00 9.84  ? 7   DG  B "C4'" 1 
ATOM   447 O  "O4'" . DG  B  1 7  ? -2.900  18.127 5.836  1.00 9.74  ? 7   DG  B "O4'" 1 
ATOM   448 C  "C3'" . DG  B  1 7  ? -2.222  15.885 5.491  1.00 9.24  ? 7   DG  B "C3'" 1 
ATOM   449 O  "O3'" . DG  B  1 7  ? -2.235  15.371 4.207  1.00 14.93 ? 7   DG  B "O3'" 1 
ATOM   450 C  "C2'" . DG  B  1 7  ? -1.014  16.812 5.725  1.00 9.17  ? 7   DG  B "C2'" 1 
ATOM   451 C  "C1'" . DG  B  1 7  ? -1.597  18.154 5.327  1.00 10.61 ? 7   DG  B "C1'" 1 
ATOM   452 N  N9    . DG  B  1 7  ? -0.909  19.300 5.887  1.00 8.40  ? 7   DG  B N9    1 
ATOM   453 C  C8    . DG  B  1 7  ? -1.143  19.898 7.104  1.00 10.81 ? 7   DG  B C8    1 
ATOM   454 N  N7    . DG  B  1 7  ? -0.376  20.932 7.337  1.00 11.57 ? 7   DG  B N7    1 
ATOM   455 C  C5    . DG  B  1 7  ? 0.426   21.039 6.206  1.00 10.09 ? 7   DG  B C5    1 
ATOM   456 C  C6    . DG  B  1 7  ? 1.449   21.958 5.870  1.00 6.97  ? 7   DG  B C6    1 
ATOM   457 O  O6    . DG  B  1 7  ? 1.873   22.912 6.537  1.00 8.80  ? 7   DG  B O6    1 
ATOM   458 N  N1    . DG  B  1 7  ? 1.997   21.687 4.615  1.00 10.09 ? 7   DG  B N1    1 
ATOM   459 C  C2    . DG  B  1 7  ? 1.607   20.659 3.786  1.00 10.47 ? 7   DG  B C2    1 
ATOM   460 N  N2    . DG  B  1 7  ? 2.249   20.549 2.609  1.00 10.67 ? 7   DG  B N2    1 
ATOM   461 N  N3    . DG  B  1 7  ? 0.651   19.792 4.091  1.00 11.54 ? 7   DG  B N3    1 
ATOM   462 C  C4    . DG  B  1 7  ? 0.106   20.038 5.308  1.00 8.18  ? 7   DG  B C4    1 
ATOM   463 P  P     . DC  B  1 8  ? -1.998  13.811 3.937  1.00 11.89 ? 8   DC  B P     1 
ATOM   464 O  OP1   . DC  B  1 8  ? -2.916  13.374 2.864  1.00 17.20 ? 8   DC  B OP1   1 
ATOM   465 O  OP2   . DC  B  1 8  ? -1.852  13.032 5.178  1.00 10.53 ? 8   DC  B OP2   1 
ATOM   466 O  "O5'" . DC  B  1 8  ? -0.544  13.860 3.297  1.00 17.87 ? 8   DC  B "O5'" 1 
ATOM   467 C  "C5'" . DC  B  1 8  ? -0.099  12.843 2.439  1.00 11.92 ? 8   DC  B "C5'" 1 
ATOM   468 C  "C4'" . DC  B  1 8  ? 0.164   13.398 1.056  1.00 13.42 ? 8   DC  B "C4'" 1 
ATOM   469 O  "O4'" . DC  B  1 8  ? 1.209   12.617 0.429  1.00 14.32 ? 8   DC  B "O4'" 1 
ATOM   470 C  "C3'" . DC  B  1 8  ? -1.024  13.327 0.106  1.00 13.98 ? 8   DC  B "C3'" 1 
ATOM   471 O  "O3'" . DC  B  1 8  ? -0.946  14.373 -0.851 1.00 13.69 ? 8   DC  B "O3'" 1 
ATOM   472 C  "C2'" . DC  B  1 8  ? -0.828  11.970 -0.546 1.00 13.67 ? 8   DC  B "C2'" 1 
ATOM   473 C  "C1'" . DC  B  1 8  ? 0.684   11.945 -0.698 1.00 12.85 ? 8   DC  B "C1'" 1 
ATOM   474 N  N1    . DC  B  1 8  ? 1.243   10.593 -0.737 1.00 11.10 ? 8   DC  B N1    1 
ATOM   475 C  C2    . DC  B  1 8  ? 1.770   10.107 -1.931 1.00 13.56 ? 8   DC  B C2    1 
ATOM   476 O  O2    . DC  B  1 8  ? 1.747   10.831 -2.934 1.00 11.83 ? 8   DC  B O2    1 
ATOM   477 N  N3    . DC  B  1 8  ? 2.283   8.852  -1.955 1.00 9.57  ? 8   DC  B N3    1 
ATOM   478 C  C4    . DC  B  1 8  ? 2.293   8.093  -0.852 1.00 11.03 ? 8   DC  B C4    1 
ATOM   479 N  N4    . DC  B  1 8  ? 2.811   6.878  -0.930 1.00 10.64 ? 8   DC  B N4    1 
ATOM   480 C  C5    . DC  B  1 8  ? 1.754   8.568  0.385  1.00 13.02 ? 8   DC  B C5    1 
ATOM   481 C  C6    . DC  B  1 8  ? 1.246   9.831  0.386  1.00 11.47 ? 8   DC  B C6    1 
ATOM   482 P  P     . DG  B  1 9  ? -2.294  14.990 -1.461 1.00 17.62 ? 9   DG  B P     1 
ATOM   483 O  OP1   . DG  B  1 9  ? -3.107  13.894 -2.014 1.00 19.77 ? 9   DG  B OP1   1 
ATOM   484 O  OP2   . DG  B  1 9  ? -1.887  16.120 -2.328 1.00 17.48 ? 9   DG  B OP2   1 
ATOM   485 O  "O5'" . DG  B  1 9  ? -3.069  15.542 -0.179 1.00 16.75 ? 9   DG  B "O5'" 1 
ATOM   486 C  "C5'" . DG  B  1 9  ? -2.470  16.505 0.650  1.00 15.29 ? 9   DG  B "C5'" 1 
ATOM   487 C  "C4'" . DG  B  1 9  ? -3.539  17.308 1.337  1.00 13.21 ? 9   DG  B "C4'" 1 
ATOM   488 O  "O4'" . DG  B  1 9  ? -2.909  18.271 2.221  1.00 12.05 ? 9   DG  B "O4'" 1 
ATOM   489 C  "C3'" . DG  B  1 9  ? -4.425  18.119 0.382  1.00 16.36 ? 9   DG  B "C3'" 1 
ATOM   490 O  "O3'" . DG  B  1 9  ? -5.801  17.967 0.733  1.00 15.66 ? 9   DG  B "O3'" 1 
ATOM   491 C  "C2'" . DG  B  1 9  ? -3.943  19.550 0.589  1.00 12.17 ? 9   DG  B "C2'" 1 
ATOM   492 C  "C1'" . DG  B  1 9  ? -3.544  19.504 2.048  1.00 11.17 ? 9   DG  B "C1'" 1 
ATOM   493 N  N9    . DG  B  1 9  ? -2.638  20.547 2.423  1.00 9.30  ? 9   DG  B N9    1 
ATOM   494 C  C8    . DG  B  1 9  ? -1.560  21.040 1.724  1.00 11.76 ? 9   DG  B C8    1 
ATOM   495 N  N7    . DG  B  1 9  ? -0.936  22.013 2.338  1.00 8.97  ? 9   DG  B N7    1 
ATOM   496 C  C5    . DG  B  1 9  ? -1.637  22.187 3.526  1.00 9.39  ? 9   DG  B C5    1 
ATOM   497 C  C6    . DG  B  1 9  ? -1.442  23.086 4.602  1.00 9.21  ? 9   DG  B C6    1 
ATOM   498 O  O6    . DG  B  1 9  ? -0.567  23.954 4.728  1.00 10.65 ? 9   DG  B O6    1 
ATOM   499 N  N1    . DG  B  1 9  ? -2.397  22.909 5.605  1.00 8.86  ? 9   DG  B N1    1 
ATOM   500 C  C2    . DG  B  1 9  ? -3.413  21.979 5.576  1.00 8.99  ? 9   DG  B C2    1 
ATOM   501 N  N2    . DG  B  1 9  ? -4.242  21.951 6.634  1.00 9.71  ? 9   DG  B N2    1 
ATOM   502 N  N3    . DG  B  1 9  ? -3.604  21.133 4.573  1.00 7.95  ? 9   DG  B N3    1 
ATOM   503 C  C4    . DG  B  1 9  ? -2.686  21.289 3.588  1.00 9.31  ? 9   DG  B C4    1 
ATOM   504 P  P     . DC  B  1 10 ? -6.935  18.814 -0.038 1.00 18.39 ? 10  DC  B P     1 
ATOM   505 O  OP1   . DC  B  1 10 ? -8.162  18.002 0.085  1.00 17.15 ? 10  DC  B OP1   1 
ATOM   506 O  OP2   . DC  B  1 10 ? -6.441  19.263 -1.363 1.00 18.16 ? 10  DC  B OP2   1 
ATOM   507 O  "O5'" . DC  B  1 10 ? -7.097  20.133 0.856  1.00 16.18 ? 10  DC  B "O5'" 1 
ATOM   508 C  "C5'" . DC  B  1 10 ? -7.733  20.037 2.106  1.00 10.77 ? 10  DC  B "C5'" 1 
ATOM   509 C  "C4'" . DC  B  1 10 ? -7.640  21.346 2.870  1.00 11.01 ? 10  DC  B "C4'" 1 
ATOM   510 O  "O4'" . DC  B  1 10 ? -6.264  21.687 3.087  1.00 9.53  ? 10  DC  B "O4'" 1 
ATOM   511 C  "C3'" . DC  B  1 10 ? -8.188  22.567 2.162  1.00 10.52 ? 10  DC  B "C3'" 1 
ATOM   512 O  "O3'" . DC  B  1 10 ? -9.593  22.625 2.313  1.00 11.57 ? 10  DC  B "O3'" 1 
ATOM   513 C  "C2'" . DC  B  1 10 ? -7.504  23.705 2.932  1.00 9.77  ? 10  DC  B "C2'" 1 
ATOM   514 C  "C1'" . DC  B  1 10 ? -6.210  23.057 3.448  1.00 9.53  ? 10  DC  B "C1'" 1 
ATOM   515 N  N1    . DC  B  1 10 ? -4.999  23.685 2.868  1.00 9.83  ? 10  DC  B N1    1 
ATOM   516 C  C2    . DC  B  1 10 ? -4.373  24.726 3.551  1.00 7.73  ? 10  DC  B C2    1 
ATOM   517 O  O2    . DC  B  1 10 ? -4.839  25.097 4.635  1.00 9.30  ? 10  DC  B O2    1 
ATOM   518 N  N3    . DC  B  1 10 ? -3.277  25.302 2.997  1.00 9.60  ? 10  DC  B N3    1 
ATOM   519 C  C4    . DC  B  1 10 ? -2.797  24.876 1.822  1.00 8.85  ? 10  DC  B C4    1 
ATOM   520 N  N4    . DC  B  1 10 ? -1.721  25.471 1.330  1.00 9.45  ? 10  DC  B N4    1 
ATOM   521 C  C5    . DC  B  1 10 ? -3.425  23.813 1.101  1.00 8.87  ? 10  DC  B C5    1 
ATOM   522 C  C6    . DC  B  1 10 ? -4.522  23.249 1.675  1.00 10.35 ? 10  DC  B C6    1 
ATOM   523 P  P     . DC  B  1 11 ? -10.536 22.842 1.033  1.00 13.41 ? 11  DC  B P     1 
ATOM   524 O  OP1   . DC  B  1 11 ? -11.927 22.827 1.525  1.00 14.15 ? 11  DC  B OP1   1 
ATOM   525 O  OP2   . DC  B  1 11 ? -10.130 21.883 -0.009 1.00 13.95 ? 11  DC  B OP2   1 
ATOM   526 O  "O5'" . DC  B  1 11 ? -10.165 24.307 0.521  1.00 14.12 ? 11  DC  B "O5'" 1 
ATOM   527 C  "C5'" . DC  B  1 11 ? -10.818 24.865 -0.620 1.00 12.29 ? 11  DC  B "C5'" 1 
ATOM   528 C  "C4'" . DC  B  1 11 ? -10.097 26.115 -1.107 1.00 15.17 ? 11  DC  B "C4'" 1 
ATOM   529 O  "O4'" . DC  B  1 11 ? -9.983  27.057 -0.015 1.00 11.27 ? 11  DC  B "O4'" 1 
ATOM   530 C  "C3'" . DC  B  1 11 ? -8.668  25.898 -1.586 1.00 15.38 ? 11  DC  B "C3'" 1 
ATOM   531 O  "O3'" . DC  B  1 11 ? -8.291  26.952 -2.462 1.00 16.22 ? 11  DC  B "O3'" 1 
ATOM   532 C  "C2'" . DC  B  1 11 ? -7.888  25.980 -0.285 1.00 13.68 ? 11  DC  B "C2'" 1 
ATOM   533 C  "C1'" . DC  B  1 11 ? -8.646  27.087 0.448  1.00 12.36 ? 11  DC  B "C1'" 1 
ATOM   534 N  N1    . DC  B  1 11 ? -8.659  26.934 1.920  1.00 11.74 ? 11  DC  B N1    1 
ATOM   535 C  C2    . DC  B  1 11 ? -7.480  27.174 2.621  1.00 10.68 ? 11  DC  B C2    1 
ATOM   536 O  O2    . DC  B  1 11 ? -6.462  27.489 1.991  1.00 11.03 ? 11  DC  B O2    1 
ATOM   537 N  N3    . DC  B  1 11 ? -7.486  27.047 3.971  1.00 8.38  ? 11  DC  B N3    1 
ATOM   538 C  C4    . DC  B  1 11 ? -8.604  26.705 4.623  1.00 11.34 ? 11  DC  B C4    1 
ATOM   539 N  N4    . DC  B  1 11 ? -8.555  26.600 5.942  1.00 11.26 ? 11  DC  B N4    1 
ATOM   540 C  C5    . DC  B  1 11 ? -9.826  26.449 3.925  1.00 10.31 ? 11  DC  B C5    1 
ATOM   541 C  C6    . DC  B  1 11 ? -9.797  26.584 2.572  1.00 11.60 ? 11  DC  B C6    1 
ATOM   542 P  P     . DG  B  1 12 ? -7.203  26.692 -3.614 1.00 20.34 ? 12  DG  B P     1 
ATOM   543 O  OP1   . DG  B  1 12 ? -7.945  26.250 -4.812 1.00 24.65 ? 12  DG  B OP1   1 
ATOM   544 O  OP2   . DG  B  1 12 ? -6.171  25.789 -3.063 1.00 20.63 ? 12  DG  B OP2   1 
ATOM   545 O  "O5'" . DG  B  1 12 ? -6.561  28.125 -3.904 1.00 21.76 ? 12  DG  B "O5'" 1 
ATOM   546 C  "C5'" . DG  B  1 12 ? -5.912  28.849 -2.862 1.00 18.57 ? 12  DG  B "C5'" 1 
ATOM   547 C  "C4'" . DG  B  1 12 ? -6.730  30.067 -2.484 1.00 16.63 ? 12  DG  B "C4'" 1 
ATOM   548 O  "O4'" . DG  B  1 12 ? -7.443  29.810 -1.264 1.00 17.46 ? 12  DG  B "O4'" 1 
ATOM   549 C  "C3'" . DG  B  1 12 ? -5.932  31.323 -2.200 1.00 16.46 ? 12  DG  B "C3'" 1 
ATOM   550 O  "O3'" . DG  B  1 12 ? -5.694  32.005 -3.423 1.00 18.06 ? 12  DG  B "O3'" 1 
ATOM   551 C  "C2'" . DG  B  1 12 ? -6.873  32.120 -1.289 1.00 17.35 ? 12  DG  B "C2'" 1 
ATOM   552 C  "C1'" . DG  B  1 12 ? -7.735  31.036 -0.627 1.00 14.89 ? 12  DG  B "C1'" 1 
ATOM   553 N  N9    . DG  B  1 12 ? -7.480  30.871 0.782  1.00 15.33 ? 12  DG  B N9    1 
ATOM   554 C  C8    . DG  B  1 12 ? -6.282  31.031 1.441  1.00 13.85 ? 12  DG  B C8    1 
ATOM   555 N  N7    . DG  B  1 12 ? -6.354  30.799 2.727  1.00 11.79 ? 12  DG  B N7    1 
ATOM   556 C  C5    . DG  B  1 12 ? -7.684  30.461 2.950  1.00 11.69 ? 12  DG  B C5    1 
ATOM   557 C  C6    . DG  B  1 12 ? -8.372  30.106 4.136  1.00 11.70 ? 12  DG  B C6    1 
ATOM   558 O  O6    . DG  B  1 12 ? -7.920  30.015 5.286  1.00 13.53 ? 12  DG  B O6    1 
ATOM   559 N  N1    . DG  B  1 12 ? -9.720  29.842 3.894  1.00 12.70 ? 12  DG  B N1    1 
ATOM   560 C  C2    . DG  B  1 12 ? -10.333 29.910 2.662  1.00 14.25 ? 12  DG  B C2    1 
ATOM   561 N  N2    . DG  B  1 12 ? -11.645 29.621 2.617  1.00 18.16 ? 12  DG  B N2    1 
ATOM   562 N  N3    . DG  B  1 12 ? -9.698  30.241 1.545  1.00 14.27 ? 12  DG  B N3    1 
ATOM   563 C  C4    . DG  B  1 12 ? -8.385  30.502 1.759  1.00 12.50 ? 12  DG  B C4    1 
ATOM   564 P  P     . DC  B  1 13 ? -4.773  33.320 -3.470 1.00 19.32 ? 13  DC  B P     1 
ATOM   565 O  OP1   . DC  B  1 13 ? -5.431  34.403 -2.706 1.00 21.82 ? 13  DC  B OP1   1 
ATOM   566 O  OP2   . DC  B  1 13 ? -4.395  33.512 -4.890 1.00 20.49 ? 13  DC  B OP2   1 
ATOM   567 O  "O5'" . DC  B  1 13 ? -3.457  32.909 -2.674 1.00 16.73 ? 13  DC  B "O5'" 1 
ATOM   568 C  "C5'" . DC  B  1 13 ? -2.528  32.020 -3.258 1.00 15.77 ? 13  DC  B "C5'" 1 
ATOM   569 C  "C4'" . DC  B  1 13 ? -1.200  32.110 -2.538 1.00 13.65 ? 13  DC  B "C4'" 1 
ATOM   570 O  "O4'" . DC  B  1 13 ? -1.384  31.784 -1.138 1.00 13.86 ? 13  DC  B "O4'" 1 
ATOM   571 C  "C3'" . DC  B  1 13 ? -0.122  31.192 -3.088 1.00 14.03 ? 13  DC  B "C3'" 1 
ATOM   572 O  "O3'" . DC  B  1 13 ? 0.900   31.986 -3.686 1.00 15.85 ? 13  DC  B "O3'" 1 
ATOM   573 C  "C2'" . DC  B  1 13 ? 0.400   30.408 -1.871 1.00 13.01 ? 13  DC  B "C2'" 1 
ATOM   574 C  "C1'" . DC  B  1 13 ? -0.653  30.637 -0.784 1.00 12.59 ? 13  DC  B "C1'" 1 
ATOM   575 N  N1    . DC  B  1 13 ? -1.635  29.552 -0.624 1.00 12.06 ? 13  DC  B N1    1 
ATOM   576 C  C2    . DC  B  1 13 ? -2.417  29.516 0.528  1.00 11.03 ? 13  DC  B C2    1 
ATOM   577 O  O2    . DC  B  1 13 ? -2.236  30.375 1.401  1.00 8.97  ? 13  DC  B O2    1 
ATOM   578 N  N3    . DC  B  1 13 ? -3.344  28.536 0.657  1.00 11.17 ? 13  DC  B N3    1 
ATOM   579 C  C4    . DC  B  1 13 ? -3.515  27.621 -0.305 1.00 11.80 ? 13  DC  B C4    1 
ATOM   580 N  N4    . DC  B  1 13 ? -4.438  26.689 -0.129 1.00 10.54 ? 13  DC  B N4    1 
ATOM   581 C  C5    . DC  B  1 13 ? -2.722  27.634 -1.495 1.00 11.06 ? 13  DC  B C5    1 
ATOM   582 C  C6    . DC  B  1 13 ? -1.800  28.628 -1.605 1.00 12.73 ? 13  DC  B C6    1 
ATOM   583 P  P     . DG  B  1 14 ? 2.175   31.294 -4.373 1.00 20.17 ? 14  DG  B P     1 
ATOM   584 O  OP1   . DG  B  1 14 ? 2.718   32.281 -5.336 1.00 19.66 ? 14  DG  B OP1   1 
ATOM   585 O  OP2   . DG  B  1 14 ? 1.830   29.927 -4.809 1.00 16.92 ? 14  DG  B OP2   1 
ATOM   586 O  "O5'" . DG  B  1 14 ? 3.207   31.124 -3.174 1.00 17.74 ? 14  DG  B "O5'" 1 
ATOM   587 C  "C5'" . DG  B  1 14 ? 3.687   32.258 -2.499 1.00 18.14 ? 14  DG  B "C5'" 1 
ATOM   588 C  "C4'" . DG  B  1 14 ? 4.461   31.855 -1.261 1.00 17.25 ? 14  DG  B "C4'" 1 
ATOM   589 O  "O4'" . DG  B  1 14 ? 3.562   31.285 -0.278 1.00 16.64 ? 14  DG  B "O4'" 1 
ATOM   590 C  "C3'" . DG  B  1 14 ? 5.555   30.813 -1.479 1.00 17.88 ? 14  DG  B "C3'" 1 
ATOM   591 O  "O3'" . DG  B  1 14 ? 6.663   31.166 -0.674 1.00 22.00 ? 14  DG  B "O3'" 1 
ATOM   592 C  "C2'" . DG  B  1 14 ? 4.891   29.509 -1.006 1.00 15.89 ? 14  DG  B "C2'" 1 
ATOM   593 C  "C1'" . DG  B  1 14 ? 4.054   30.028 0.149  1.00 14.50 ? 14  DG  B "C1'" 1 
ATOM   594 N  N9    . DG  B  1 14 ? 2.895   29.224 0.497  1.00 11.79 ? 14  DG  B N9    1 
ATOM   595 C  C8    . DG  B  1 14 ? 2.242   28.270 -0.250 1.00 12.72 ? 14  DG  B C8    1 
ATOM   596 N  N7    . DG  B  1 14 ? 1.201   27.754 0.351  1.00 10.82 ? 14  DG  B N7    1 
ATOM   597 C  C5    . DG  B  1 14 ? 1.148   28.399 1.581  1.00 11.23 ? 14  DG  B C5    1 
ATOM   598 C  C6    . DG  B  1 14 ? 0.248   28.269 2.666  1.00 11.96 ? 14  DG  B C6    1 
ATOM   599 O  O6    . DG  B  1 14 ? -0.734  27.519 2.763  1.00 9.67  ? 14  DG  B O6    1 
ATOM   600 N  N1    . DG  B  1 14 ? 0.576   29.126 3.717  1.00 8.89  ? 14  DG  B N1    1 
ATOM   601 C  C2    . DG  B  1 14 ? 1.639   30.001 3.724  1.00 9.72  ? 14  DG  B C2    1 
ATOM   602 N  N2    . DG  B  1 14 ? 1.802   30.752 4.826  1.00 10.78 ? 14  DG  B N2    1 
ATOM   603 N  N3    . DG  B  1 14 ? 2.488   30.131 2.713  1.00 11.56 ? 14  DG  B N3    1 
ATOM   604 C  C4    . DG  B  1 14 ? 2.186   29.306 1.680  1.00 12.41 ? 14  DG  B C4    1 
ATOM   605 P  P     . DA  B  1 15 ? 8.106   30.523 -0.932 1.00 23.60 ? 15  DA  B P     1 
ATOM   606 O  OP1   . DA  B  1 15 ? 9.094   31.344 -0.198 1.00 24.53 ? 15  DA  B OP1   1 
ATOM   607 O  OP2   . DA  B  1 15 ? 8.262   30.324 -2.395 1.00 24.91 ? 15  DA  B OP2   1 
ATOM   608 O  "O5'" . DA  B  1 15 ? 7.989   29.087 -0.248 1.00 20.73 ? 15  DA  B "O5'" 1 
ATOM   609 C  "C5'" . DA  B  1 15 ? 8.668   28.820 0.975  1.00 20.05 ? 15  DA  B "C5'" 1 
ATOM   610 C  "C4'" . DA  B  1 15 ? 7.951   29.420 2.178  1.00 20.24 ? 15  DA  B "C4'" 1 
ATOM   611 O  "O4'" . DA  B  1 15 ? 6.533   29.109 2.118  1.00 19.20 ? 15  DA  B "O4'" 1 
ATOM   612 C  "C3'" . DA  B  1 15 ? 8.461   28.885 3.517  1.00 19.14 ? 15  DA  B "C3'" 1 
ATOM   613 O  "O3'" . DA  B  1 15 ? 8.815   29.937 4.395  1.00 22.10 ? 15  DA  B "O3'" 1 
ATOM   614 C  "C2'" . DA  B  1 15 ? 7.314   28.044 4.072  1.00 16.78 ? 15  DA  B "C2'" 1 
ATOM   615 C  "C1'" . DA  B  1 15 ? 6.091   28.600 3.362  1.00 16.66 ? 15  DA  B "C1'" 1 
ATOM   616 N  N9    . DA  B  1 15 ? 5.088   27.579 3.103  1.00 13.35 ? 15  DA  B N9    1 
ATOM   617 C  C8    . DA  B  1 15 ? 5.061   26.704 2.046  1.00 13.90 ? 15  DA  B C8    1 
ATOM   618 N  N7    . DA  B  1 15 ? 4.042   25.885 2.067  1.00 13.35 ? 15  DA  B N7    1 
ATOM   619 C  C5    . DA  B  1 15 ? 3.344   26.232 3.216  1.00 12.19 ? 15  DA  B C5    1 
ATOM   620 C  C6    . DA  B  1 15 ? 2.149   25.732 3.798  1.00 10.76 ? 15  DA  B C6    1 
ATOM   621 N  N6    . DA  B  1 15 ? 1.424   24.742 3.264  1.00 10.14 ? 15  DA  B N6    1 
ATOM   622 N  N1    . DA  B  1 15 ? 1.721   26.297 4.950  1.00 9.29  ? 15  DA  B N1    1 
ATOM   623 C  C2    . DA  B  1 15 ? 2.439   27.298 5.475  1.00 8.15  ? 15  DA  B C2    1 
ATOM   624 N  N3    . DA  B  1 15 ? 3.573   27.861 5.017  1.00 10.36 ? 15  DA  B N3    1 
ATOM   625 C  C4    . DA  B  1 15 ? 3.976   27.273 3.871  1.00 13.97 ? 15  DA  B C4    1 
ATOM   626 P  P     . DA  B  1 16 ? 10.000  29.696 5.455  1.00 23.14 ? 16  DA  B P     1 
ATOM   627 O  OP1   . DA  B  1 16 ? 10.967  30.811 5.325  1.00 24.45 ? 16  DA  B OP1   1 
ATOM   628 O  OP2   . DA  B  1 16 ? 10.448  28.297 5.287  1.00 24.13 ? 16  DA  B OP2   1 
ATOM   629 O  "O5'" . DA  B  1 16 ? 9.276   29.791 6.875  1.00 15.82 ? 16  DA  B "O5'" 1 
ATOM   630 C  "C5'" . DA  B  1 16 ? 9.015   31.045 7.460  1.00 16.49 ? 16  DA  B "C5'" 1 
ATOM   631 C  "C4'" . DA  B  1 16 ? 8.249   30.857 8.750  1.00 13.98 ? 16  DA  B "C4'" 1 
ATOM   632 O  "O4'" . DA  B  1 16 ? 6.895   30.449 8.431  1.00 12.98 ? 16  DA  B "O4'" 1 
ATOM   633 C  "C3'" . DA  B  1 16 ? 8.791   29.764 9.656  1.00 15.27 ? 16  DA  B "C3'" 1 
ATOM   634 O  "O3'" . DA  B  1 16 ? 9.764   30.301 10.553 1.00 17.79 ? 16  DA  B "O3'" 1 
ATOM   635 C  "C2'" . DA  B  1 16 ? 7.546   29.313 10.404 1.00 12.15 ? 16  DA  B "C2'" 1 
ATOM   636 C  "C1'" . DA  B  1 16 ? 6.450   29.479 9.352  1.00 12.16 ? 16  DA  B "C1'" 1 
ATOM   637 N  N9    . DA  B  1 16 ? 6.157   28.276 8.606  1.00 10.15 ? 16  DA  B N9    1 
ATOM   638 C  C8    . DA  B  1 16 ? 6.975   27.610 7.728  1.00 10.41 ? 16  DA  B C8    1 
ATOM   639 N  N7    . DA  B  1 16 ? 6.421   26.553 7.192  1.00 10.45 ? 16  DA  B N7    1 
ATOM   640 C  C5    . DA  B  1 16 ? 5.151   26.507 7.753  1.00 9.88  ? 16  DA  B C5    1 
ATOM   641 C  C6    . DA  B  1 16 ? 4.061   25.615 7.579  1.00 6.90  ? 16  DA  B C6    1 
ATOM   642 N  N6    . DA  B  1 16 ? 4.088   24.565 6.749  1.00 9.32  ? 16  DA  B N6    1 
ATOM   643 N  N1    . DA  B  1 16 ? 2.933   25.848 8.287  1.00 7.88  ? 16  DA  B N1    1 
ATOM   644 C  C2    . DA  B  1 16 ? 2.901   26.908 9.107  1.00 8.57  ? 16  DA  B C2    1 
ATOM   645 N  N3    . DA  B  1 16 ? 3.858   27.823 9.348  1.00 9.34  ? 16  DA  B N3    1 
ATOM   646 C  C4    . DA  B  1 16 ? 4.971   27.560 8.631  1.00 8.00  ? 16  DA  B C4    1 
HETATM 647 AG AG    . AG  C  2 .  ? 4.541   15.815 17.138 0.95 9.14  ? 101 AG  A AG    1 
HETATM 648 AG AG    . AG  D  2 .  ? 5.954   16.072 14.764 0.96 9.14  ? 102 AG  A AG    1 
HETATM 649 AG AG    . AG  E  2 .  ? 6.745   17.477 16.950 1.00 9.88  ? 103 AG  A AG    1 
HETATM 650 AG AG    . AG  F  2 .  ? 4.300   18.573 17.232 0.96 8.64  ? 104 AG  A AG    1 
HETATM 651 AG AG    . AG  G  2 .  ? 3.392   17.233 14.937 0.96 8.69  ? 105 AG  A AG    1 
HETATM 652 AG AG    . AG  H  2 .  ? 5.702   18.856 14.727 0.97 8.48  ? 106 AG  A AG    1 
HETATM 653 AG AG    . AG  I  2 .  ? 4.719   17.474 12.488 0.95 8.78  ? 107 AG  A AG    1 
HETATM 654 AG AG    . AG  J  2 .  ? 3.243   20.070 14.679 0.92 8.77  ? 108 AG  A AG    1 
HETATM 655 AG AG    . AG  K  2 .  ? 4.626   20.202 12.242 0.93 9.01  ? 109 AG  A AG    1 
HETATM 656 AG AG    . AG  L  2 .  ? 2.226   18.865 12.395 0.90 9.23  ? 110 AG  A AG    1 
HETATM 657 AG AG    . AG  M  2 .  ? 2.695   22.189 12.958 1.00 8.94  ? 111 AG  A AG    1 
HETATM 658 AG AG    . AG  N  2 .  ? 0.266   21.300 11.942 0.94 9.10  ? 112 AG  A AG    1 
HETATM 659 AG AG    . AG  O  2 .  ? 2.492   21.387 10.279 0.94 9.37  ? 113 AG  A AG    1 
HETATM 660 AG AG    . AG  P  2 .  ? 1.345   23.878 11.126 1.00 9.07  ? 114 AG  A AG    1 
HETATM 661 CL CL    . CL  Q  3 .  ? -0.205  25.855 12.263 1.00 9.82  ? 115 CL  A CL    1 
HETATM 662 AG AG    . AG  R  2 .  ? -0.096  22.188 9.288  0.99 8.94  ? 101 AG  B AG    1 
HETATM 663 AG AG    . AG  S  2 .  ? -1.151  24.765 10.143 0.92 8.81  ? 102 AG  B AG    1 
HETATM 664 AG AG    . AG  T  2 .  ? -1.563  23.882 7.544  1.00 9.09  ? 103 AG  B AG    1 
HETATM 665 AG AG    . AG  U  2 .  ? 0.991   24.678 8.368  0.95 9.67  ? 104 AG  B AG    1 
HETATM 666 AG AG    . AG  V  2 .  ? -0.414  25.859 5.831  0.98 9.79  ? 105 AG  B AG    1 
HETATM 667 AG AG    . AG  W  2 .  ? -1.131  27.199 8.132  0.89 9.19  ? 106 AG  B AG    1 
HETATM 668 AG AG    . AG  X  2 .  ? -2.925  26.030 6.550  0.92 9.93  ? 107 AG  B AG    1 
HETATM 669 AG AG    . AG  Y  2 .  ? -0.627  28.588 5.689  0.96 8.88  ? 108 AG  B AG    1 
HETATM 670 AG AG    . AG  Z  2 .  ? -2.572  27.212 4.202  0.97 8.66  ? 109 AG  B AG    1 
HETATM 671 AG AG    . AG  AA 2 .  ? -3.323  28.825 6.393  0.96 8.57  ? 110 AG  B AG    1 
HETATM 672 AG AG    . AG  BA 2 .  ? -5.340  27.488 4.966  0.97 8.68  ? 111 AG  B AG    1 
HETATM 673 AG AG    . AG  CA 2 .  ? -2.546  29.989 3.946  0.94 8.73  ? 112 AG  B AG    1 
HETATM 674 AG AG    . AG  DA 2 .  ? -4.490  28.592 2.662  1.00 9.85  ? 113 AG  B AG    1 
HETATM 675 AG AG    . AG  EA 2 .  ? -5.188  30.247 4.761  0.95 8.99  ? 114 AG  B AG    1 
HETATM 676 CL CL    . CL  FA 3 .  ? -1.564  20.201 10.516 1.00 9.61  ? 115 CL  B CL    1 
HETATM 677 O  O     . HOH GA 4 .  ? 4.404   26.583 17.209 1.00 8.93  ? 201 HOH A O     1 
HETATM 678 O  O     . HOH GA 4 .  ? -2.672  30.616 13.806 1.00 18.16 ? 202 HOH A O     1 
HETATM 679 O  O     . HOH GA 4 .  ? 8.908   13.825 8.678  1.00 19.05 ? 203 HOH A O     1 
HETATM 680 O  O     . HOH GA 4 .  ? -4.765  15.968 16.102 1.00 18.13 ? 204 HOH A O     1 
HETATM 681 O  O     . HOH GA 4 .  ? 10.572  23.820 22.307 1.00 18.47 ? 205 HOH A O     1 
HETATM 682 O  O     . HOH GA 4 .  ? 7.738   26.916 23.673 1.00 17.50 ? 206 HOH A O     1 
HETATM 683 O  O     . HOH GA 4 .  ? 9.974   22.944 12.012 1.00 13.68 ? 207 HOH A O     1 
HETATM 684 O  O     . HOH GA 4 .  ? 11.277  20.719 13.193 1.00 14.76 ? 208 HOH A O     1 
HETATM 685 O  O     . HOH GA 4 .  ? -3.314  17.267 13.726 1.00 17.82 ? 209 HOH A O     1 
HETATM 686 O  O     . HOH GA 4 .  ? 10.157  27.463 11.658 1.00 19.41 ? 210 HOH A O     1 
HETATM 687 O  O     . HOH GA 4 .  ? 5.670   15.642 7.036  1.00 16.45 ? 211 HOH A O     1 
HETATM 688 O  O     . HOH GA 4 .  ? 8.285   23.176 8.026  1.00 15.04 ? 212 HOH A O     1 
HETATM 689 O  O     . HOH GA 4 .  ? 10.422  12.375 12.008 1.00 18.54 ? 213 HOH A O     1 
HETATM 690 O  O     . HOH GA 4 .  ? 2.746   24.109 19.528 1.00 16.69 ? 214 HOH A O     1 
HETATM 691 O  O     . HOH GA 4 .  ? 13.288  31.156 11.781 1.00 19.98 ? 215 HOH A O     1 
HETATM 692 O  O     . HOH GA 4 .  ? 1.530   18.336 23.473 1.00 20.33 ? 216 HOH A O     1 
HETATM 693 O  O     . HOH GA 4 .  ? -6.176  19.829 14.465 1.00 20.88 ? 217 HOH A O     1 
HETATM 694 O  O     . HOH HA 4 .  ? -11.406 33.014 15.041 1.00 18.73 ? 201 HOH B O     1 
HETATM 695 O  O     . HOH HA 4 .  ? -6.409  30.153 13.855 1.00 19.34 ? 202 HOH B O     1 
HETATM 696 O  O     . HOH HA 4 .  ? -3.753  15.344 12.611 1.00 16.84 ? 203 HOH B O     1 
HETATM 697 O  O     . HOH HA 4 .  ? 3.866   32.362 2.437  1.00 19.71 ? 204 HOH B O     1 
HETATM 698 O  O     . HOH HA 4 .  ? -8.793  22.283 -2.334 1.00 17.87 ? 205 HOH B O     1 
HETATM 699 O  O     . HOH HA 4 .  ? -12.860 18.448 11.229 1.00 19.69 ? 206 HOH B O     1 
HETATM 700 O  O     . HOH HA 4 .  ? -10.820 19.178 0.089  1.00 17.64 ? 207 HOH B O     1 
HETATM 701 O  O     . HOH HA 4 .  ? 1.121   23.114 0.739  1.00 13.13 ? 208 HOH B O     1 
HETATM 702 O  O     . HOH HA 4 .  ? -12.800 32.596 13.294 1.00 20.93 ? 209 HOH B O     1 
HETATM 703 O  O     . HOH HA 4 .  ? 0.216   25.292 -0.782 1.00 15.86 ? 210 HOH B O     1 
HETATM 704 O  O     . HOH HA 4 .  ? -3.760  28.623 13.294 1.00 16.65 ? 211 HOH B O     1 
HETATM 705 O  O     . HOH HA 4 .  ? 1.252   18.547 0.582  1.00 20.44 ? 212 HOH B O     1 
HETATM 706 O  O     . HOH HA 4 .  ? 4.492   22.891 3.290  1.00 15.63 ? 213 HOH B O     1 
HETATM 707 O  O     . HOH HA 4 .  ? 4.905   30.532 6.028  1.00 16.41 ? 214 HOH B O     1 
HETATM 708 O  O     . HOH HA 4 .  ? -7.289  23.112 -5.221 1.00 24.87 ? 215 HOH B O     1 
HETATM 709 O  O     . HOH HA 4 .  ? 12.621  28.658 10.673 1.00 22.65 ? 216 HOH B O     1 
HETATM 710 O  O     . HOH HA 4 .  ? -4.881  26.272 15.515 1.00 20.07 ? 217 HOH B O     1 
HETATM 711 O  O     . HOH HA 4 .  ? -9.747  22.872 5.672  1.00 20.17 ? 218 HOH B O     1 
HETATM 712 O  O     . HOH HA 4 .  ? 2.088   14.740 -2.596 1.00 19.46 ? 219 HOH B O     1 
HETATM 713 O  O     . HOH HA 4 .  ? -11.994 27.938 6.234  1.00 19.70 ? 220 HOH B O     1 
HETATM 714 O  O     . HOH HA 4 .  ? 2.088   34.782 0.036  1.00 23.07 ? 221 HOH B O     1 
HETATM 715 O  O     . HOH HA 4 .  ? -9.310  33.861 -4.894 1.00 24.90 ? 222 HOH B O     1 
# 
