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- structures/1c2x.cif +0 -0
- structures/1f7g.cif +0 -0
- structures/1f9l.cif +1677 -0
- structures/1fnx.cif +0 -0
- structures/1h4s.cif +0 -0
- structures/1hnw.cif +0 -0
- structures/1ie1.cif +0 -0
- structures/1msy.cif +0 -0
- structures/1n78.cif +0 -0
- structures/1nbr.cif +0 -0
- structures/1q9a.cif +0 -0
- structures/2awq.cif +0 -0
- structures/2c50.cif +0 -0
- structures/2jse.cif +0 -0
- structures/2l1v.cif +0 -0
- structures/2pxb.cif +0 -0
- structures/2x7n.cif +0 -0
- structures/359d.cif +0 -0
- structures/3b58.cif +0 -0
- structures/3bbm.cif +0 -0
- structures/3far.cif +0 -0
- structures/3iqp.cif +0 -0
- structures/3nnc.cif +0 -0
- structures/3php.cif +0 -0
- structures/3sux.cif +0 -0
- structures/3trz.cif +0 -0
- structures/4ijs.cif +0 -0
- structures/4kr6.cif +0 -0
- structures/4lvy.cif +0 -0
- structures/4nyc.cif +0 -0
- structures/4phy.cif +0 -0
- structures/4rdx.cif +0 -0
- structures/4u7u.cif +0 -0
- structures/5axw.cif +0 -0
- structures/5ay2.cif +0 -0
- structures/5bjp.cif +0 -0
- structures/5de8.cif +0 -0
- structures/5fjc.cif +0 -0
- structures/5jea.cif +0 -0
- structures/5k78.cif +0 -0
- structures/5t83.cif +0 -0
- structures/5xbl.cif +0 -0
- structures/5xlp.cif +0 -0
- structures/5xxu.cif +0 -0
- structures/5z98.cif +0 -0
- structures/6aeg.cif +0 -0
- structures/6dcc.cif +0 -0
- structures/6dn2.cif +0 -0
- structures/6fai.cif +0 -0
- structures/6ifu.cif +0 -0
structures/1c2x.cif
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structures/1f7g.cif
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structures/1f9l.cif
ADDED
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|
| 1 |
+
data_1F9L
|
| 2 |
+
#
|
| 3 |
+
_entry.id 1F9L
|
| 4 |
+
#
|
| 5 |
+
_audit_conform.dict_name mmcif_pdbx.dic
|
| 6 |
+
_audit_conform.dict_version 5.392
|
| 7 |
+
_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic
|
| 8 |
+
#
|
| 9 |
+
loop_
|
| 10 |
+
_database_2.database_id
|
| 11 |
+
_database_2.database_code
|
| 12 |
+
_database_2.pdbx_database_accession
|
| 13 |
+
_database_2.pdbx_DOI
|
| 14 |
+
PDB 1F9L pdb_00001f9l 10.2210/pdb1f9l/pdb
|
| 15 |
+
RCSB RCSB011412 ? ?
|
| 16 |
+
WWPDB D_1000011412 ? ?
|
| 17 |
+
#
|
| 18 |
+
loop_
|
| 19 |
+
_pdbx_audit_revision_history.ordinal
|
| 20 |
+
_pdbx_audit_revision_history.data_content_type
|
| 21 |
+
_pdbx_audit_revision_history.major_revision
|
| 22 |
+
_pdbx_audit_revision_history.minor_revision
|
| 23 |
+
_pdbx_audit_revision_history.revision_date
|
| 24 |
+
1 'Structure model' 1 0 2000-07-26
|
| 25 |
+
2 'Structure model' 1 1 2008-01-08
|
| 26 |
+
3 'Structure model' 1 2 2011-07-13
|
| 27 |
+
4 'Structure model' 1 3 2022-02-23
|
| 28 |
+
5 'Structure model' 1 4 2024-05-22
|
| 29 |
+
#
|
| 30 |
+
_pdbx_audit_revision_details.ordinal 1
|
| 31 |
+
_pdbx_audit_revision_details.revision_ordinal 1
|
| 32 |
+
_pdbx_audit_revision_details.data_content_type 'Structure model'
|
| 33 |
+
_pdbx_audit_revision_details.provider repository
|
| 34 |
+
_pdbx_audit_revision_details.type 'Initial release'
|
| 35 |
+
_pdbx_audit_revision_details.description ?
|
| 36 |
+
_pdbx_audit_revision_details.details ?
|
| 37 |
+
#
|
| 38 |
+
loop_
|
| 39 |
+
_pdbx_audit_revision_group.ordinal
|
| 40 |
+
_pdbx_audit_revision_group.revision_ordinal
|
| 41 |
+
_pdbx_audit_revision_group.data_content_type
|
| 42 |
+
_pdbx_audit_revision_group.group
|
| 43 |
+
1 2 'Structure model' 'Version format compliance'
|
| 44 |
+
2 3 'Structure model' 'Version format compliance'
|
| 45 |
+
3 4 'Structure model' 'Data collection'
|
| 46 |
+
4 4 'Structure model' 'Database references'
|
| 47 |
+
5 4 'Structure model' 'Derived calculations'
|
| 48 |
+
6 5 'Structure model' 'Data collection'
|
| 49 |
+
#
|
| 50 |
+
loop_
|
| 51 |
+
_pdbx_audit_revision_category.ordinal
|
| 52 |
+
_pdbx_audit_revision_category.revision_ordinal
|
| 53 |
+
_pdbx_audit_revision_category.data_content_type
|
| 54 |
+
_pdbx_audit_revision_category.category
|
| 55 |
+
1 4 'Structure model' database_2
|
| 56 |
+
2 4 'Structure model' pdbx_nmr_software
|
| 57 |
+
3 4 'Structure model' pdbx_struct_assembly
|
| 58 |
+
4 4 'Structure model' pdbx_struct_oper_list
|
| 59 |
+
5 5 'Structure model' chem_comp_atom
|
| 60 |
+
6 5 'Structure model' chem_comp_bond
|
| 61 |
+
#
|
| 62 |
+
loop_
|
| 63 |
+
_pdbx_audit_revision_item.ordinal
|
| 64 |
+
_pdbx_audit_revision_item.revision_ordinal
|
| 65 |
+
_pdbx_audit_revision_item.data_content_type
|
| 66 |
+
_pdbx_audit_revision_item.item
|
| 67 |
+
1 4 'Structure model' '_database_2.pdbx_DOI'
|
| 68 |
+
2 4 'Structure model' '_database_2.pdbx_database_accession'
|
| 69 |
+
3 4 'Structure model' '_pdbx_nmr_software.name'
|
| 70 |
+
#
|
| 71 |
+
_pdbx_database_PDB_obs_spr.id SPRSDE
|
| 72 |
+
_pdbx_database_PDB_obs_spr.date 2009-07-28
|
| 73 |
+
_pdbx_database_PDB_obs_spr.pdb_id 1F9L
|
| 74 |
+
_pdbx_database_PDB_obs_spr.replace_pdb_id 1EOR
|
| 75 |
+
_pdbx_database_PDB_obs_spr.details ?
|
| 76 |
+
#
|
| 77 |
+
_pdbx_database_status.status_code REL
|
| 78 |
+
_pdbx_database_status.entry_id 1F9L
|
| 79 |
+
_pdbx_database_status.recvd_initial_deposition_date 2000-07-11
|
| 80 |
+
_pdbx_database_status.deposit_site RCSB
|
| 81 |
+
_pdbx_database_status.process_site RCSB
|
| 82 |
+
_pdbx_database_status.status_code_mr REL
|
| 83 |
+
_pdbx_database_status.SG_entry .
|
| 84 |
+
_pdbx_database_status.status_code_sf ?
|
| 85 |
+
_pdbx_database_status.pdb_format_compatible Y
|
| 86 |
+
_pdbx_database_status.status_code_cs ?
|
| 87 |
+
_pdbx_database_status.status_code_nmr_data ?
|
| 88 |
+
_pdbx_database_status.methods_development_category ?
|
| 89 |
+
#
|
| 90 |
+
_pdbx_database_related.db_name PDB
|
| 91 |
+
_pdbx_database_related.db_id 1EOR
|
| 92 |
+
_pdbx_database_related.details 'Solution structure of the 22-nucleotide without Cobalt(III)hexammine'
|
| 93 |
+
_pdbx_database_related.content_type unspecified
|
| 94 |
+
#
|
| 95 |
+
loop_
|
| 96 |
+
_audit_author.name
|
| 97 |
+
_audit_author.pdbx_ordinal
|
| 98 |
+
'Rudisser, S.' 1
|
| 99 |
+
'Tinoco Jr., I.' 2
|
| 100 |
+
#
|
| 101 |
+
_citation.id primary
|
| 102 |
+
_citation.title
|
| 103 |
+
'Solution structure of Cobalt(III)hexammine complexed to the GAAA tetraloop, and metal-ion binding to G.A mismatches.'
|
| 104 |
+
_citation.journal_abbrev J.Mol.Biol.
|
| 105 |
+
_citation.journal_volume 295
|
| 106 |
+
_citation.page_first 1211
|
| 107 |
+
_citation.page_last 1232
|
| 108 |
+
_citation.year 2000
|
| 109 |
+
_citation.journal_id_ASTM JMOBAK
|
| 110 |
+
_citation.country UK
|
| 111 |
+
_citation.journal_id_ISSN 0022-2836
|
| 112 |
+
_citation.journal_id_CSD 0070
|
| 113 |
+
_citation.book_publisher ?
|
| 114 |
+
_citation.pdbx_database_id_PubMed 10653698
|
| 115 |
+
_citation.pdbx_database_id_DOI 10.1006/jmbi.1999.3421
|
| 116 |
+
#
|
| 117 |
+
loop_
|
| 118 |
+
_citation_author.citation_id
|
| 119 |
+
_citation_author.name
|
| 120 |
+
_citation_author.ordinal
|
| 121 |
+
_citation_author.identifier_ORCID
|
| 122 |
+
primary 'Rudisser, S.' 1 ?
|
| 123 |
+
primary 'Tinoco Jr., I.' 2 ?
|
| 124 |
+
#
|
| 125 |
+
_entity.id 1
|
| 126 |
+
_entity.type polymer
|
| 127 |
+
_entity.src_method syn
|
| 128 |
+
_entity.pdbx_description "5'-R(*GP*GP*CP*GP*AP*AP*GP*UP*CP*GP*AP*AP*AP*GP*AP*UP*GP*GP*CP*GP*CP*CP*)-3'"
|
| 129 |
+
_entity.formula_weight 7175.371
|
| 130 |
+
_entity.pdbx_number_of_molecules 1
|
| 131 |
+
_entity.pdbx_ec ?
|
| 132 |
+
_entity.pdbx_mutation ?
|
| 133 |
+
_entity.pdbx_fragment 'P5ABC DOMAIN'
|
| 134 |
+
_entity.details ?
|
| 135 |
+
#
|
| 136 |
+
_entity_poly.entity_id 1
|
| 137 |
+
_entity_poly.type polyribonucleotide
|
| 138 |
+
_entity_poly.nstd_linkage no
|
| 139 |
+
_entity_poly.nstd_monomer no
|
| 140 |
+
_entity_poly.pdbx_seq_one_letter_code GGCGAAGUCGAAAGAUGGCGCC
|
| 141 |
+
_entity_poly.pdbx_seq_one_letter_code_can GGCGAAGUCGAAAGAUGGCGCC
|
| 142 |
+
_entity_poly.pdbx_strand_id A
|
| 143 |
+
_entity_poly.pdbx_target_identifier ?
|
| 144 |
+
#
|
| 145 |
+
loop_
|
| 146 |
+
_entity_poly_seq.entity_id
|
| 147 |
+
_entity_poly_seq.num
|
| 148 |
+
_entity_poly_seq.mon_id
|
| 149 |
+
_entity_poly_seq.hetero
|
| 150 |
+
1 1 G n
|
| 151 |
+
1 2 G n
|
| 152 |
+
1 3 C n
|
| 153 |
+
1 4 G n
|
| 154 |
+
1 5 A n
|
| 155 |
+
1 6 A n
|
| 156 |
+
1 7 G n
|
| 157 |
+
1 8 U n
|
| 158 |
+
1 9 C n
|
| 159 |
+
1 10 G n
|
| 160 |
+
1 11 A n
|
| 161 |
+
1 12 A n
|
| 162 |
+
1 13 A n
|
| 163 |
+
1 14 G n
|
| 164 |
+
1 15 A n
|
| 165 |
+
1 16 U n
|
| 166 |
+
1 17 G n
|
| 167 |
+
1 18 G n
|
| 168 |
+
1 19 C n
|
| 169 |
+
1 20 G n
|
| 170 |
+
1 21 C n
|
| 171 |
+
1 22 C n
|
| 172 |
+
#
|
| 173 |
+
_pdbx_entity_src_syn.entity_id 1
|
| 174 |
+
_pdbx_entity_src_syn.pdbx_src_id 1
|
| 175 |
+
_pdbx_entity_src_syn.pdbx_alt_source_flag sample
|
| 176 |
+
_pdbx_entity_src_syn.pdbx_beg_seq_num ?
|
| 177 |
+
_pdbx_entity_src_syn.pdbx_end_seq_num ?
|
| 178 |
+
_pdbx_entity_src_syn.organism_scientific ?
|
| 179 |
+
_pdbx_entity_src_syn.organism_common_name ?
|
| 180 |
+
_pdbx_entity_src_syn.ncbi_taxonomy_id ?
|
| 181 |
+
_pdbx_entity_src_syn.details
|
| 182 |
+
'The RNA was enzymatically synthesized from a synthetic RNA template using T7 RNA polymerase'
|
| 183 |
+
#
|
| 184 |
+
loop_
|
| 185 |
+
_chem_comp.id
|
| 186 |
+
_chem_comp.type
|
| 187 |
+
_chem_comp.mon_nstd_flag
|
| 188 |
+
_chem_comp.name
|
| 189 |
+
_chem_comp.pdbx_synonyms
|
| 190 |
+
_chem_comp.formula
|
| 191 |
+
_chem_comp.formula_weight
|
| 192 |
+
A 'RNA linking' y "ADENOSINE-5'-MONOPHOSPHATE" ? 'C10 H14 N5 O7 P' 347.221
|
| 193 |
+
C 'RNA linking' y "CYTIDINE-5'-MONOPHOSPHATE" ? 'C9 H14 N3 O8 P' 323.197
|
| 194 |
+
G 'RNA linking' y "GUANOSINE-5'-MONOPHOSPHATE" ? 'C10 H14 N5 O8 P' 363.221
|
| 195 |
+
U 'RNA linking' y "URIDINE-5'-MONOPHOSPHATE" ? 'C9 H13 N2 O9 P' 324.181
|
| 196 |
+
#
|
| 197 |
+
loop_
|
| 198 |
+
_pdbx_poly_seq_scheme.asym_id
|
| 199 |
+
_pdbx_poly_seq_scheme.entity_id
|
| 200 |
+
_pdbx_poly_seq_scheme.seq_id
|
| 201 |
+
_pdbx_poly_seq_scheme.mon_id
|
| 202 |
+
_pdbx_poly_seq_scheme.ndb_seq_num
|
| 203 |
+
_pdbx_poly_seq_scheme.pdb_seq_num
|
| 204 |
+
_pdbx_poly_seq_scheme.auth_seq_num
|
| 205 |
+
_pdbx_poly_seq_scheme.pdb_mon_id
|
| 206 |
+
_pdbx_poly_seq_scheme.auth_mon_id
|
| 207 |
+
_pdbx_poly_seq_scheme.pdb_strand_id
|
| 208 |
+
_pdbx_poly_seq_scheme.pdb_ins_code
|
| 209 |
+
_pdbx_poly_seq_scheme.hetero
|
| 210 |
+
A 1 1 G 1 1 1 G G A . n
|
| 211 |
+
A 1 2 G 2 2 2 G G A . n
|
| 212 |
+
A 1 3 C 3 3 3 C C A . n
|
| 213 |
+
A 1 4 G 4 4 4 G G A . n
|
| 214 |
+
A 1 5 A 5 5 5 A A A . n
|
| 215 |
+
A 1 6 A 6 6 6 A A A . n
|
| 216 |
+
A 1 7 G 7 7 7 G G A . n
|
| 217 |
+
A 1 8 U 8 8 8 U U A . n
|
| 218 |
+
A 1 9 C 9 9 9 C C A . n
|
| 219 |
+
A 1 10 G 10 10 10 G G A . n
|
| 220 |
+
A 1 11 A 11 11 11 A A A . n
|
| 221 |
+
A 1 12 A 12 12 12 A A A . n
|
| 222 |
+
A 1 13 A 13 13 13 A A A . n
|
| 223 |
+
A 1 14 G 14 14 14 G G A . n
|
| 224 |
+
A 1 15 A 15 15 15 A A A . n
|
| 225 |
+
A 1 16 U 16 16 16 U U A . n
|
| 226 |
+
A 1 17 G 17 17 17 G G A . n
|
| 227 |
+
A 1 18 G 18 18 18 G G A . n
|
| 228 |
+
A 1 19 C 19 19 19 C C A . n
|
| 229 |
+
A 1 20 G 20 20 20 G G A . n
|
| 230 |
+
A 1 21 C 21 21 21 C C A . n
|
| 231 |
+
A 1 22 C 22 22 22 C C A . n
|
| 232 |
+
#
|
| 233 |
+
_cell.entry_id 1F9L
|
| 234 |
+
_cell.length_a 1.000
|
| 235 |
+
_cell.length_b 1.000
|
| 236 |
+
_cell.length_c 1.000
|
| 237 |
+
_cell.angle_alpha 90.00
|
| 238 |
+
_cell.angle_beta 90.00
|
| 239 |
+
_cell.angle_gamma 90.00
|
| 240 |
+
_cell.Z_PDB 1
|
| 241 |
+
_cell.pdbx_unique_axis ?
|
| 242 |
+
#
|
| 243 |
+
_symmetry.entry_id 1F9L
|
| 244 |
+
_symmetry.space_group_name_H-M 'P 1'
|
| 245 |
+
_symmetry.pdbx_full_space_group_name_H-M ?
|
| 246 |
+
_symmetry.cell_setting ?
|
| 247 |
+
_symmetry.Int_Tables_number 1
|
| 248 |
+
#
|
| 249 |
+
_exptl.entry_id 1F9L
|
| 250 |
+
_exptl.method 'SOLUTION NMR'
|
| 251 |
+
_exptl.crystals_number ?
|
| 252 |
+
#
|
| 253 |
+
_database_PDB_matrix.entry_id 1F9L
|
| 254 |
+
_database_PDB_matrix.origx[1][1] 1.000000
|
| 255 |
+
_database_PDB_matrix.origx[1][2] 0.000000
|
| 256 |
+
_database_PDB_matrix.origx[1][3] 0.000000
|
| 257 |
+
_database_PDB_matrix.origx[2][1] 0.000000
|
| 258 |
+
_database_PDB_matrix.origx[2][2] 1.000000
|
| 259 |
+
_database_PDB_matrix.origx[2][3] 0.000000
|
| 260 |
+
_database_PDB_matrix.origx[3][1] 0.000000
|
| 261 |
+
_database_PDB_matrix.origx[3][2] 0.000000
|
| 262 |
+
_database_PDB_matrix.origx[3][3] 1.000000
|
| 263 |
+
_database_PDB_matrix.origx_vector[1] 0.00000
|
| 264 |
+
_database_PDB_matrix.origx_vector[2] 0.00000
|
| 265 |
+
_database_PDB_matrix.origx_vector[3] 0.00000
|
| 266 |
+
#
|
| 267 |
+
_struct.entry_id 1F9L
|
| 268 |
+
_struct.title
|
| 269 |
+
;Solution Structure of a 22-Nucleotide Hairpin Similar to the P5ABC Region of a Group I Ribozyme with Cobalt(III)hexammine Complexed to the GAAA Tetraloop
|
| 270 |
+
;
|
| 271 |
+
_struct.pdbx_model_details ?
|
| 272 |
+
_struct.pdbx_CASP_flag ?
|
| 273 |
+
_struct.pdbx_model_type_details 'minimized average'
|
| 274 |
+
#
|
| 275 |
+
_struct_keywords.entry_id 1F9L
|
| 276 |
+
_struct_keywords.pdbx_keywords RNA
|
| 277 |
+
_struct_keywords.text
|
| 278 |
+
'GA mismatches, GAAA tetraloop, metal-ion binding, Cobalt(III)hexammine, hairpin, P5abc, group I intron, RNA'
|
| 279 |
+
#
|
| 280 |
+
_struct_asym.id A
|
| 281 |
+
_struct_asym.pdbx_blank_PDB_chainid_flag N
|
| 282 |
+
_struct_asym.pdbx_modified N
|
| 283 |
+
_struct_asym.entity_id 1
|
| 284 |
+
_struct_asym.details ?
|
| 285 |
+
#
|
| 286 |
+
_struct_ref.id 1
|
| 287 |
+
_struct_ref.entity_id 1
|
| 288 |
+
_struct_ref.db_name PDB
|
| 289 |
+
_struct_ref.db_code 1F9L
|
| 290 |
+
_struct_ref.pdbx_db_accession 1F9L
|
| 291 |
+
_struct_ref.pdbx_db_isoform ?
|
| 292 |
+
_struct_ref.pdbx_seq_one_letter_code ?
|
| 293 |
+
_struct_ref.pdbx_align_begin ?
|
| 294 |
+
#
|
| 295 |
+
_struct_ref_seq.align_id 1
|
| 296 |
+
_struct_ref_seq.ref_id 1
|
| 297 |
+
_struct_ref_seq.pdbx_PDB_id_code 1F9L
|
| 298 |
+
_struct_ref_seq.pdbx_strand_id A
|
| 299 |
+
_struct_ref_seq.seq_align_beg 1
|
| 300 |
+
_struct_ref_seq.pdbx_seq_align_beg_ins_code ?
|
| 301 |
+
_struct_ref_seq.seq_align_end 22
|
| 302 |
+
_struct_ref_seq.pdbx_seq_align_end_ins_code ?
|
| 303 |
+
_struct_ref_seq.pdbx_db_accession 1F9L
|
| 304 |
+
_struct_ref_seq.db_align_beg 1
|
| 305 |
+
_struct_ref_seq.pdbx_db_align_beg_ins_code ?
|
| 306 |
+
_struct_ref_seq.db_align_end 22
|
| 307 |
+
_struct_ref_seq.pdbx_db_align_end_ins_code ?
|
| 308 |
+
_struct_ref_seq.pdbx_auth_seq_align_beg 1
|
| 309 |
+
_struct_ref_seq.pdbx_auth_seq_align_end 22
|
| 310 |
+
#
|
| 311 |
+
_pdbx_struct_assembly.id 1
|
| 312 |
+
_pdbx_struct_assembly.details author_defined_assembly
|
| 313 |
+
_pdbx_struct_assembly.method_details ?
|
| 314 |
+
_pdbx_struct_assembly.oligomeric_details monomeric
|
| 315 |
+
_pdbx_struct_assembly.oligomeric_count 1
|
| 316 |
+
#
|
| 317 |
+
_pdbx_struct_assembly_gen.assembly_id 1
|
| 318 |
+
_pdbx_struct_assembly_gen.oper_expression 1
|
| 319 |
+
_pdbx_struct_assembly_gen.asym_id_list A
|
| 320 |
+
#
|
| 321 |
+
_pdbx_struct_oper_list.id 1
|
| 322 |
+
_pdbx_struct_oper_list.type 'identity operation'
|
| 323 |
+
_pdbx_struct_oper_list.name 1_555
|
| 324 |
+
_pdbx_struct_oper_list.symmetry_operation x,y,z
|
| 325 |
+
_pdbx_struct_oper_list.matrix[1][1] 1.0000000000
|
| 326 |
+
_pdbx_struct_oper_list.matrix[1][2] 0.0000000000
|
| 327 |
+
_pdbx_struct_oper_list.matrix[1][3] 0.0000000000
|
| 328 |
+
_pdbx_struct_oper_list.vector[1] 0.0000000000
|
| 329 |
+
_pdbx_struct_oper_list.matrix[2][1] 0.0000000000
|
| 330 |
+
_pdbx_struct_oper_list.matrix[2][2] 1.0000000000
|
| 331 |
+
_pdbx_struct_oper_list.matrix[2][3] 0.0000000000
|
| 332 |
+
_pdbx_struct_oper_list.vector[2] 0.0000000000
|
| 333 |
+
_pdbx_struct_oper_list.matrix[3][1] 0.0000000000
|
| 334 |
+
_pdbx_struct_oper_list.matrix[3][2] 0.0000000000
|
| 335 |
+
_pdbx_struct_oper_list.matrix[3][3] 1.0000000000
|
| 336 |
+
_pdbx_struct_oper_list.vector[3] 0.0000000000
|
| 337 |
+
#
|
| 338 |
+
_struct_biol.id 1
|
| 339 |
+
#
|
| 340 |
+
loop_
|
| 341 |
+
_struct_conn.id
|
| 342 |
+
_struct_conn.conn_type_id
|
| 343 |
+
_struct_conn.pdbx_leaving_atom_flag
|
| 344 |
+
_struct_conn.pdbx_PDB_id
|
| 345 |
+
_struct_conn.ptnr1_label_asym_id
|
| 346 |
+
_struct_conn.ptnr1_label_comp_id
|
| 347 |
+
_struct_conn.ptnr1_label_seq_id
|
| 348 |
+
_struct_conn.ptnr1_label_atom_id
|
| 349 |
+
_struct_conn.pdbx_ptnr1_label_alt_id
|
| 350 |
+
_struct_conn.pdbx_ptnr1_PDB_ins_code
|
| 351 |
+
_struct_conn.pdbx_ptnr1_standard_comp_id
|
| 352 |
+
_struct_conn.ptnr1_symmetry
|
| 353 |
+
_struct_conn.ptnr2_label_asym_id
|
| 354 |
+
_struct_conn.ptnr2_label_comp_id
|
| 355 |
+
_struct_conn.ptnr2_label_seq_id
|
| 356 |
+
_struct_conn.ptnr2_label_atom_id
|
| 357 |
+
_struct_conn.pdbx_ptnr2_label_alt_id
|
| 358 |
+
_struct_conn.pdbx_ptnr2_PDB_ins_code
|
| 359 |
+
_struct_conn.ptnr1_auth_asym_id
|
| 360 |
+
_struct_conn.ptnr1_auth_comp_id
|
| 361 |
+
_struct_conn.ptnr1_auth_seq_id
|
| 362 |
+
_struct_conn.ptnr2_auth_asym_id
|
| 363 |
+
_struct_conn.ptnr2_auth_comp_id
|
| 364 |
+
_struct_conn.ptnr2_auth_seq_id
|
| 365 |
+
_struct_conn.ptnr2_symmetry
|
| 366 |
+
_struct_conn.pdbx_ptnr3_label_atom_id
|
| 367 |
+
_struct_conn.pdbx_ptnr3_label_seq_id
|
| 368 |
+
_struct_conn.pdbx_ptnr3_label_comp_id
|
| 369 |
+
_struct_conn.pdbx_ptnr3_label_asym_id
|
| 370 |
+
_struct_conn.pdbx_ptnr3_label_alt_id
|
| 371 |
+
_struct_conn.pdbx_ptnr3_PDB_ins_code
|
| 372 |
+
_struct_conn.details
|
| 373 |
+
_struct_conn.pdbx_dist_value
|
| 374 |
+
_struct_conn.pdbx_value_order
|
| 375 |
+
_struct_conn.pdbx_role
|
| 376 |
+
hydrog1 hydrog ? ? A G 1 N1 ? ? ? 1_555 A C 22 N3 ? ? A G 1 A C 22 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 377 |
+
hydrog2 hydrog ? ? A G 1 N2 ? ? ? 1_555 A C 22 O2 ? ? A G 1 A C 22 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 378 |
+
hydrog3 hydrog ? ? A G 1 O6 ? ? ? 1_555 A C 22 N4 ? ? A G 1 A C 22 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 379 |
+
hydrog4 hydrog ? ? A G 2 N1 ? ? ? 1_555 A C 21 N3 ? ? A G 2 A C 21 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 380 |
+
hydrog5 hydrog ? ? A G 2 N2 ? ? ? 1_555 A C 21 O2 ? ? A G 2 A C 21 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 381 |
+
hydrog6 hydrog ? ? A G 2 O6 ? ? ? 1_555 A C 21 N4 ? ? A G 2 A C 21 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 382 |
+
hydrog7 hydrog ? ? A C 3 N3 ? ? ? 1_555 A G 20 N1 ? ? A C 3 A G 20 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 383 |
+
hydrog8 hydrog ? ? A C 3 N4 ? ? ? 1_555 A G 20 O6 ? ? A C 3 A G 20 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 384 |
+
hydrog9 hydrog ? ? A C 3 O2 ? ? ? 1_555 A G 20 N2 ? ? A C 3 A G 20 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 385 |
+
hydrog10 hydrog ? ? A G 4 N1 ? ? ? 1_555 A C 19 N3 ? ? A G 4 A C 19 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 386 |
+
hydrog11 hydrog ? ? A G 4 N2 ? ? ? 1_555 A C 19 O2 ? ? A G 4 A C 19 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 387 |
+
hydrog12 hydrog ? ? A G 4 O6 ? ? ? 1_555 A C 19 N4 ? ? A G 4 A C 19 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 388 |
+
hydrog13 hydrog ? ? A A 5 N1 ? ? ? 1_555 A G 18 N1 ? ? A A 5 A G 18 1_555 ? ? ? ? ? ? TYPE_8_PAIR ? ? ?
|
| 389 |
+
hydrog14 hydrog ? ? A A 5 N6 ? ? ? 1_555 A G 18 O6 ? ? A A 5 A G 18 1_555 ? ? ? ? ? ? TYPE_8_PAIR ? ? ?
|
| 390 |
+
hydrog15 hydrog ? ? A A 6 N1 ? ? ? 1_555 A G 17 N1 ? ? A A 6 A G 17 1_555 ? ? ? ? ? ? TYPE_8_PAIR ? ? ?
|
| 391 |
+
hydrog16 hydrog ? ? A A 6 N6 ? ? ? 1_555 A G 17 O6 ? ? A A 6 A G 17 1_555 ? ? ? ? ? ? TYPE_8_PAIR ? ? ?
|
| 392 |
+
hydrog17 hydrog ? ? A G 7 N1 ? ? ? 1_555 A U 16 O2 ? ? A G 7 A U 16 1_555 ? ? ? ? ? ? TYPE_28_PAIR ? ? ?
|
| 393 |
+
hydrog18 hydrog ? ? A G 7 O6 ? ? ? 1_555 A U 16 N3 ? ? A G 7 A U 16 1_555 ? ? ? ? ? ? TYPE_28_PAIR ? ? ?
|
| 394 |
+
hydrog19 hydrog ? ? A U 8 N3 ? ? ? 1_555 A A 15 N1 ? ? A U 8 A A 15 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 395 |
+
hydrog20 hydrog ? ? A U 8 O4 ? ? ? 1_555 A A 15 N6 ? ? A U 8 A A 15 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 396 |
+
hydrog21 hydrog ? ? A C 9 N3 ? ? ? 1_555 A G 14 N1 ? ? A C 9 A G 14 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 397 |
+
hydrog22 hydrog ? ? A C 9 N4 ? ? ? 1_555 A G 14 O6 ? ? A C 9 A G 14 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 398 |
+
hydrog23 hydrog ? ? A C 9 O2 ? ? ? 1_555 A G 14 N2 ? ? A C 9 A G 14 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ?
|
| 399 |
+
hydrog24 hydrog ? ? A G 10 N2 ? ? ? 1_555 A A 13 N7 ? ? A G 10 A A 13 1_555 ? ? ? ? ? ? 'G-A MISPAIR' ? ? ?
|
| 400 |
+
#
|
| 401 |
+
_struct_conn_type.id hydrog
|
| 402 |
+
_struct_conn_type.criteria ?
|
| 403 |
+
_struct_conn_type.reference ?
|
| 404 |
+
#
|
| 405 |
+
loop_
|
| 406 |
+
_pdbx_validate_close_contact.id
|
| 407 |
+
_pdbx_validate_close_contact.PDB_model_num
|
| 408 |
+
_pdbx_validate_close_contact.auth_atom_id_1
|
| 409 |
+
_pdbx_validate_close_contact.auth_asym_id_1
|
| 410 |
+
_pdbx_validate_close_contact.auth_comp_id_1
|
| 411 |
+
_pdbx_validate_close_contact.auth_seq_id_1
|
| 412 |
+
_pdbx_validate_close_contact.PDB_ins_code_1
|
| 413 |
+
_pdbx_validate_close_contact.label_alt_id_1
|
| 414 |
+
_pdbx_validate_close_contact.auth_atom_id_2
|
| 415 |
+
_pdbx_validate_close_contact.auth_asym_id_2
|
| 416 |
+
_pdbx_validate_close_contact.auth_comp_id_2
|
| 417 |
+
_pdbx_validate_close_contact.auth_seq_id_2
|
| 418 |
+
_pdbx_validate_close_contact.PDB_ins_code_2
|
| 419 |
+
_pdbx_validate_close_contact.label_alt_id_2
|
| 420 |
+
_pdbx_validate_close_contact.dist
|
| 421 |
+
1 1 H61 A A 6 ? ? O6 A G 17 ? ? 1.51
|
| 422 |
+
2 1 H61 A A 5 ? ? O6 A G 18 ? ? 1.55
|
| 423 |
+
#
|
| 424 |
+
_pdbx_nmr_ensemble.entry_id 1F9L
|
| 425 |
+
_pdbx_nmr_ensemble.conformers_calculated_total_number 50
|
| 426 |
+
_pdbx_nmr_ensemble.conformers_submitted_total_number 1
|
| 427 |
+
_pdbx_nmr_ensemble.conformer_selection_criteria 'structures with the least restraint violations'
|
| 428 |
+
_pdbx_nmr_ensemble.average_constraints_per_residue ?
|
| 429 |
+
_pdbx_nmr_ensemble.average_constraint_violations_per_residue ?
|
| 430 |
+
_pdbx_nmr_ensemble.maximum_distance_constraint_violation ?
|
| 431 |
+
_pdbx_nmr_ensemble.average_distance_constraint_violation ?
|
| 432 |
+
_pdbx_nmr_ensemble.maximum_upper_distance_constraint_violation ?
|
| 433 |
+
_pdbx_nmr_ensemble.maximum_lower_distance_constraint_violation ?
|
| 434 |
+
_pdbx_nmr_ensemble.distance_constraint_violation_method ?
|
| 435 |
+
_pdbx_nmr_ensemble.maximum_torsion_angle_constraint_violation ?
|
| 436 |
+
_pdbx_nmr_ensemble.average_torsion_angle_constraint_violation ?
|
| 437 |
+
_pdbx_nmr_ensemble.torsion_angle_constraint_violation_method ?
|
| 438 |
+
#
|
| 439 |
+
_pdbx_nmr_representative.entry_id 1F9L
|
| 440 |
+
_pdbx_nmr_representative.conformer_id 1
|
| 441 |
+
_pdbx_nmr_representative.selection_criteria 'minimized average structure'
|
| 442 |
+
#
|
| 443 |
+
_pdbx_nmr_sample_details.solution_id 1
|
| 444 |
+
_pdbx_nmr_sample_details.contents
|
| 445 |
+
;2.8 mM RNA, 10 mM sodium Phosphate, 200 mM NaCl, 0.1 mM EDTA pH 5.6,
|
| 446 |
+
3.4 mM Cobalt(III)Hexammine
|
| 447 |
+
;
|
| 448 |
+
_pdbx_nmr_sample_details.solvent_system '90% H2O/10% D2O'
|
| 449 |
+
#
|
| 450 |
+
_pdbx_nmr_exptl_sample_conditions.conditions_id 1
|
| 451 |
+
_pdbx_nmr_exptl_sample_conditions.temperature 283
|
| 452 |
+
_pdbx_nmr_exptl_sample_conditions.pressure ambient
|
| 453 |
+
_pdbx_nmr_exptl_sample_conditions.pH 5.6
|
| 454 |
+
_pdbx_nmr_exptl_sample_conditions.ionic_strength '200 mM NaCl'
|
| 455 |
+
_pdbx_nmr_exptl_sample_conditions.pressure_units .
|
| 456 |
+
_pdbx_nmr_exptl_sample_conditions.temperature_units K
|
| 457 |
+
#
|
| 458 |
+
_pdbx_nmr_exptl.experiment_id 1
|
| 459 |
+
_pdbx_nmr_exptl.conditions_id 1
|
| 460 |
+
_pdbx_nmr_exptl.solution_id 1
|
| 461 |
+
_pdbx_nmr_exptl.type '2D NOESY'
|
| 462 |
+
#
|
| 463 |
+
_pdbx_nmr_details.entry_id 1F9L
|
| 464 |
+
_pdbx_nmr_details.text
|
| 465 |
+
;The structure of the complex was determined using 7 NOE constraints between Cobalt(III)Hexammine and the GAAA tetraloop.
|
| 466 |
+
In addition, the same constraints as for the 22-nucleotide hairpin without Cobalt(III)hexammine were used.
|
| 467 |
+
For RNA without Cobalt(III)Hexammine see entry 1EOR.
|
| 468 |
+
;
|
| 469 |
+
#
|
| 470 |
+
_pdbx_nmr_refine.entry_id 1F9L
|
| 471 |
+
_pdbx_nmr_refine.method 'restrained molecular dynamics,'
|
| 472 |
+
_pdbx_nmr_refine.details
|
| 473 |
+
;356 NOE constraints, 16 sugar pucker constraints, 93 torsion angle constraints, 7 constraints between Cobalt(III)Hexammine and the GAAA tetraloop
|
| 474 |
+
;
|
| 475 |
+
_pdbx_nmr_refine.software_ordinal 1
|
| 476 |
+
#
|
| 477 |
+
loop_
|
| 478 |
+
_pdbx_nmr_software.name
|
| 479 |
+
_pdbx_nmr_software.version
|
| 480 |
+
_pdbx_nmr_software.classification
|
| 481 |
+
_pdbx_nmr_software.authors
|
| 482 |
+
_pdbx_nmr_software.ordinal
|
| 483 |
+
X-PLOR 3.1 'structure solution' Brunger 1
|
| 484 |
+
Felix 95 'data analysis' MSI 2
|
| 485 |
+
X-PLOR 3.1 refinement Brunger 3
|
| 486 |
+
#
|
| 487 |
+
loop_
|
| 488 |
+
_chem_comp_atom.comp_id
|
| 489 |
+
_chem_comp_atom.atom_id
|
| 490 |
+
_chem_comp_atom.type_symbol
|
| 491 |
+
_chem_comp_atom.pdbx_aromatic_flag
|
| 492 |
+
_chem_comp_atom.pdbx_stereo_config
|
| 493 |
+
_chem_comp_atom.pdbx_ordinal
|
| 494 |
+
A OP3 O N N 1
|
| 495 |
+
A P P N N 2
|
| 496 |
+
A OP1 O N N 3
|
| 497 |
+
A OP2 O N N 4
|
| 498 |
+
A "O5'" O N N 5
|
| 499 |
+
A "C5'" C N N 6
|
| 500 |
+
A "C4'" C N R 7
|
| 501 |
+
A "O4'" O N N 8
|
| 502 |
+
A "C3'" C N S 9
|
| 503 |
+
A "O3'" O N N 10
|
| 504 |
+
A "C2'" C N R 11
|
| 505 |
+
A "O2'" O N N 12
|
| 506 |
+
A "C1'" C N R 13
|
| 507 |
+
A N9 N Y N 14
|
| 508 |
+
A C8 C Y N 15
|
| 509 |
+
A N7 N Y N 16
|
| 510 |
+
A C5 C Y N 17
|
| 511 |
+
A C6 C Y N 18
|
| 512 |
+
A N6 N N N 19
|
| 513 |
+
A N1 N Y N 20
|
| 514 |
+
A C2 C Y N 21
|
| 515 |
+
A N3 N Y N 22
|
| 516 |
+
A C4 C Y N 23
|
| 517 |
+
A HOP3 H N N 24
|
| 518 |
+
A HOP2 H N N 25
|
| 519 |
+
A "H5'" H N N 26
|
| 520 |
+
A "H5''" H N N 27
|
| 521 |
+
A "H4'" H N N 28
|
| 522 |
+
A "H3'" H N N 29
|
| 523 |
+
A "HO3'" H N N 30
|
| 524 |
+
A "H2'" H N N 31
|
| 525 |
+
A "HO2'" H N N 32
|
| 526 |
+
A "H1'" H N N 33
|
| 527 |
+
A H8 H N N 34
|
| 528 |
+
A H61 H N N 35
|
| 529 |
+
A H62 H N N 36
|
| 530 |
+
A H2 H N N 37
|
| 531 |
+
C OP3 O N N 38
|
| 532 |
+
C P P N N 39
|
| 533 |
+
C OP1 O N N 40
|
| 534 |
+
C OP2 O N N 41
|
| 535 |
+
C "O5'" O N N 42
|
| 536 |
+
C "C5'" C N N 43
|
| 537 |
+
C "C4'" C N R 44
|
| 538 |
+
C "O4'" O N N 45
|
| 539 |
+
C "C3'" C N S 46
|
| 540 |
+
C "O3'" O N N 47
|
| 541 |
+
C "C2'" C N R 48
|
| 542 |
+
C "O2'" O N N 49
|
| 543 |
+
C "C1'" C N R 50
|
| 544 |
+
C N1 N N N 51
|
| 545 |
+
C C2 C N N 52
|
| 546 |
+
C O2 O N N 53
|
| 547 |
+
C N3 N N N 54
|
| 548 |
+
C C4 C N N 55
|
| 549 |
+
C N4 N N N 56
|
| 550 |
+
C C5 C N N 57
|
| 551 |
+
C C6 C N N 58
|
| 552 |
+
C HOP3 H N N 59
|
| 553 |
+
C HOP2 H N N 60
|
| 554 |
+
C "H5'" H N N 61
|
| 555 |
+
C "H5''" H N N 62
|
| 556 |
+
C "H4'" H N N 63
|
| 557 |
+
C "H3'" H N N 64
|
| 558 |
+
C "HO3'" H N N 65
|
| 559 |
+
C "H2'" H N N 66
|
| 560 |
+
C "HO2'" H N N 67
|
| 561 |
+
C "H1'" H N N 68
|
| 562 |
+
C H41 H N N 69
|
| 563 |
+
C H42 H N N 70
|
| 564 |
+
C H5 H N N 71
|
| 565 |
+
C H6 H N N 72
|
| 566 |
+
G OP3 O N N 73
|
| 567 |
+
G P P N N 74
|
| 568 |
+
G OP1 O N N 75
|
| 569 |
+
G OP2 O N N 76
|
| 570 |
+
G "O5'" O N N 77
|
| 571 |
+
G "C5'" C N N 78
|
| 572 |
+
G "C4'" C N R 79
|
| 573 |
+
G "O4'" O N N 80
|
| 574 |
+
G "C3'" C N S 81
|
| 575 |
+
G "O3'" O N N 82
|
| 576 |
+
G "C2'" C N R 83
|
| 577 |
+
G "O2'" O N N 84
|
| 578 |
+
G "C1'" C N R 85
|
| 579 |
+
G N9 N Y N 86
|
| 580 |
+
G C8 C Y N 87
|
| 581 |
+
G N7 N Y N 88
|
| 582 |
+
G C5 C Y N 89
|
| 583 |
+
G C6 C N N 90
|
| 584 |
+
G O6 O N N 91
|
| 585 |
+
G N1 N N N 92
|
| 586 |
+
G C2 C N N 93
|
| 587 |
+
G N2 N N N 94
|
| 588 |
+
G N3 N N N 95
|
| 589 |
+
G C4 C Y N 96
|
| 590 |
+
G HOP3 H N N 97
|
| 591 |
+
G HOP2 H N N 98
|
| 592 |
+
G "H5'" H N N 99
|
| 593 |
+
G "H5''" H N N 100
|
| 594 |
+
G "H4'" H N N 101
|
| 595 |
+
G "H3'" H N N 102
|
| 596 |
+
G "HO3'" H N N 103
|
| 597 |
+
G "H2'" H N N 104
|
| 598 |
+
G "HO2'" H N N 105
|
| 599 |
+
G "H1'" H N N 106
|
| 600 |
+
G H8 H N N 107
|
| 601 |
+
G H1 H N N 108
|
| 602 |
+
G H21 H N N 109
|
| 603 |
+
G H22 H N N 110
|
| 604 |
+
U OP3 O N N 111
|
| 605 |
+
U P P N N 112
|
| 606 |
+
U OP1 O N N 113
|
| 607 |
+
U OP2 O N N 114
|
| 608 |
+
U "O5'" O N N 115
|
| 609 |
+
U "C5'" C N N 116
|
| 610 |
+
U "C4'" C N R 117
|
| 611 |
+
U "O4'" O N N 118
|
| 612 |
+
U "C3'" C N S 119
|
| 613 |
+
U "O3'" O N N 120
|
| 614 |
+
U "C2'" C N R 121
|
| 615 |
+
U "O2'" O N N 122
|
| 616 |
+
U "C1'" C N R 123
|
| 617 |
+
U N1 N N N 124
|
| 618 |
+
U C2 C N N 125
|
| 619 |
+
U O2 O N N 126
|
| 620 |
+
U N3 N N N 127
|
| 621 |
+
U C4 C N N 128
|
| 622 |
+
U O4 O N N 129
|
| 623 |
+
U C5 C N N 130
|
| 624 |
+
U C6 C N N 131
|
| 625 |
+
U HOP3 H N N 132
|
| 626 |
+
U HOP2 H N N 133
|
| 627 |
+
U "H5'" H N N 134
|
| 628 |
+
U "H5''" H N N 135
|
| 629 |
+
U "H4'" H N N 136
|
| 630 |
+
U "H3'" H N N 137
|
| 631 |
+
U "HO3'" H N N 138
|
| 632 |
+
U "H2'" H N N 139
|
| 633 |
+
U "HO2'" H N N 140
|
| 634 |
+
U "H1'" H N N 141
|
| 635 |
+
U H3 H N N 142
|
| 636 |
+
U H5 H N N 143
|
| 637 |
+
U H6 H N N 144
|
| 638 |
+
#
|
| 639 |
+
loop_
|
| 640 |
+
_chem_comp_bond.comp_id
|
| 641 |
+
_chem_comp_bond.atom_id_1
|
| 642 |
+
_chem_comp_bond.atom_id_2
|
| 643 |
+
_chem_comp_bond.value_order
|
| 644 |
+
_chem_comp_bond.pdbx_aromatic_flag
|
| 645 |
+
_chem_comp_bond.pdbx_stereo_config
|
| 646 |
+
_chem_comp_bond.pdbx_ordinal
|
| 647 |
+
A OP3 P sing N N 1
|
| 648 |
+
A OP3 HOP3 sing N N 2
|
| 649 |
+
A P OP1 doub N N 3
|
| 650 |
+
A P OP2 sing N N 4
|
| 651 |
+
A P "O5'" sing N N 5
|
| 652 |
+
A OP2 HOP2 sing N N 6
|
| 653 |
+
A "O5'" "C5'" sing N N 7
|
| 654 |
+
A "C5'" "C4'" sing N N 8
|
| 655 |
+
A "C5'" "H5'" sing N N 9
|
| 656 |
+
A "C5'" "H5''" sing N N 10
|
| 657 |
+
A "C4'" "O4'" sing N N 11
|
| 658 |
+
A "C4'" "C3'" sing N N 12
|
| 659 |
+
A "C4'" "H4'" sing N N 13
|
| 660 |
+
A "O4'" "C1'" sing N N 14
|
| 661 |
+
A "C3'" "O3'" sing N N 15
|
| 662 |
+
A "C3'" "C2'" sing N N 16
|
| 663 |
+
A "C3'" "H3'" sing N N 17
|
| 664 |
+
A "O3'" "HO3'" sing N N 18
|
| 665 |
+
A "C2'" "O2'" sing N N 19
|
| 666 |
+
A "C2'" "C1'" sing N N 20
|
| 667 |
+
A "C2'" "H2'" sing N N 21
|
| 668 |
+
A "O2'" "HO2'" sing N N 22
|
| 669 |
+
A "C1'" N9 sing N N 23
|
| 670 |
+
A "C1'" "H1'" sing N N 24
|
| 671 |
+
A N9 C8 sing Y N 25
|
| 672 |
+
A N9 C4 sing Y N 26
|
| 673 |
+
A C8 N7 doub Y N 27
|
| 674 |
+
A C8 H8 sing N N 28
|
| 675 |
+
A N7 C5 sing Y N 29
|
| 676 |
+
A C5 C6 sing Y N 30
|
| 677 |
+
A C5 C4 doub Y N 31
|
| 678 |
+
A C6 N6 sing N N 32
|
| 679 |
+
A C6 N1 doub Y N 33
|
| 680 |
+
A N6 H61 sing N N 34
|
| 681 |
+
A N6 H62 sing N N 35
|
| 682 |
+
A N1 C2 sing Y N 36
|
| 683 |
+
A C2 N3 doub Y N 37
|
| 684 |
+
A C2 H2 sing N N 38
|
| 685 |
+
A N3 C4 sing Y N 39
|
| 686 |
+
C OP3 P sing N N 40
|
| 687 |
+
C OP3 HOP3 sing N N 41
|
| 688 |
+
C P OP1 doub N N 42
|
| 689 |
+
C P OP2 sing N N 43
|
| 690 |
+
C P "O5'" sing N N 44
|
| 691 |
+
C OP2 HOP2 sing N N 45
|
| 692 |
+
C "O5'" "C5'" sing N N 46
|
| 693 |
+
C "C5'" "C4'" sing N N 47
|
| 694 |
+
C "C5'" "H5'" sing N N 48
|
| 695 |
+
C "C5'" "H5''" sing N N 49
|
| 696 |
+
C "C4'" "O4'" sing N N 50
|
| 697 |
+
C "C4'" "C3'" sing N N 51
|
| 698 |
+
C "C4'" "H4'" sing N N 52
|
| 699 |
+
C "O4'" "C1'" sing N N 53
|
| 700 |
+
C "C3'" "O3'" sing N N 54
|
| 701 |
+
C "C3'" "C2'" sing N N 55
|
| 702 |
+
C "C3'" "H3'" sing N N 56
|
| 703 |
+
C "O3'" "HO3'" sing N N 57
|
| 704 |
+
C "C2'" "O2'" sing N N 58
|
| 705 |
+
C "C2'" "C1'" sing N N 59
|
| 706 |
+
C "C2'" "H2'" sing N N 60
|
| 707 |
+
C "O2'" "HO2'" sing N N 61
|
| 708 |
+
C "C1'" N1 sing N N 62
|
| 709 |
+
C "C1'" "H1'" sing N N 63
|
| 710 |
+
C N1 C2 sing N N 64
|
| 711 |
+
C N1 C6 sing N N 65
|
| 712 |
+
C C2 O2 doub N N 66
|
| 713 |
+
C C2 N3 sing N N 67
|
| 714 |
+
C N3 C4 doub N N 68
|
| 715 |
+
C C4 N4 sing N N 69
|
| 716 |
+
C C4 C5 sing N N 70
|
| 717 |
+
C N4 H41 sing N N 71
|
| 718 |
+
C N4 H42 sing N N 72
|
| 719 |
+
C C5 C6 doub N N 73
|
| 720 |
+
C C5 H5 sing N N 74
|
| 721 |
+
C C6 H6 sing N N 75
|
| 722 |
+
G OP3 P sing N N 76
|
| 723 |
+
G OP3 HOP3 sing N N 77
|
| 724 |
+
G P OP1 doub N N 78
|
| 725 |
+
G P OP2 sing N N 79
|
| 726 |
+
G P "O5'" sing N N 80
|
| 727 |
+
G OP2 HOP2 sing N N 81
|
| 728 |
+
G "O5'" "C5'" sing N N 82
|
| 729 |
+
G "C5'" "C4'" sing N N 83
|
| 730 |
+
G "C5'" "H5'" sing N N 84
|
| 731 |
+
G "C5'" "H5''" sing N N 85
|
| 732 |
+
G "C4'" "O4'" sing N N 86
|
| 733 |
+
G "C4'" "C3'" sing N N 87
|
| 734 |
+
G "C4'" "H4'" sing N N 88
|
| 735 |
+
G "O4'" "C1'" sing N N 89
|
| 736 |
+
G "C3'" "O3'" sing N N 90
|
| 737 |
+
G "C3'" "C2'" sing N N 91
|
| 738 |
+
G "C3'" "H3'" sing N N 92
|
| 739 |
+
G "O3'" "HO3'" sing N N 93
|
| 740 |
+
G "C2'" "O2'" sing N N 94
|
| 741 |
+
G "C2'" "C1'" sing N N 95
|
| 742 |
+
G "C2'" "H2'" sing N N 96
|
| 743 |
+
G "O2'" "HO2'" sing N N 97
|
| 744 |
+
G "C1'" N9 sing N N 98
|
| 745 |
+
G "C1'" "H1'" sing N N 99
|
| 746 |
+
G N9 C8 sing Y N 100
|
| 747 |
+
G N9 C4 sing Y N 101
|
| 748 |
+
G C8 N7 doub Y N 102
|
| 749 |
+
G C8 H8 sing N N 103
|
| 750 |
+
G N7 C5 sing Y N 104
|
| 751 |
+
G C5 C6 sing N N 105
|
| 752 |
+
G C5 C4 doub Y N 106
|
| 753 |
+
G C6 O6 doub N N 107
|
| 754 |
+
G C6 N1 sing N N 108
|
| 755 |
+
G N1 C2 sing N N 109
|
| 756 |
+
G N1 H1 sing N N 110
|
| 757 |
+
G C2 N2 sing N N 111
|
| 758 |
+
G C2 N3 doub N N 112
|
| 759 |
+
G N2 H21 sing N N 113
|
| 760 |
+
G N2 H22 sing N N 114
|
| 761 |
+
G N3 C4 sing N N 115
|
| 762 |
+
U OP3 P sing N N 116
|
| 763 |
+
U OP3 HOP3 sing N N 117
|
| 764 |
+
U P OP1 doub N N 118
|
| 765 |
+
U P OP2 sing N N 119
|
| 766 |
+
U P "O5'" sing N N 120
|
| 767 |
+
U OP2 HOP2 sing N N 121
|
| 768 |
+
U "O5'" "C5'" sing N N 122
|
| 769 |
+
U "C5'" "C4'" sing N N 123
|
| 770 |
+
U "C5'" "H5'" sing N N 124
|
| 771 |
+
U "C5'" "H5''" sing N N 125
|
| 772 |
+
U "C4'" "O4'" sing N N 126
|
| 773 |
+
U "C4'" "C3'" sing N N 127
|
| 774 |
+
U "C4'" "H4'" sing N N 128
|
| 775 |
+
U "O4'" "C1'" sing N N 129
|
| 776 |
+
U "C3'" "O3'" sing N N 130
|
| 777 |
+
U "C3'" "C2'" sing N N 131
|
| 778 |
+
U "C3'" "H3'" sing N N 132
|
| 779 |
+
U "O3'" "HO3'" sing N N 133
|
| 780 |
+
U "C2'" "O2'" sing N N 134
|
| 781 |
+
U "C2'" "C1'" sing N N 135
|
| 782 |
+
U "C2'" "H2'" sing N N 136
|
| 783 |
+
U "O2'" "HO2'" sing N N 137
|
| 784 |
+
U "C1'" N1 sing N N 138
|
| 785 |
+
U "C1'" "H1'" sing N N 139
|
| 786 |
+
U N1 C2 sing N N 140
|
| 787 |
+
U N1 C6 sing N N 141
|
| 788 |
+
U C2 O2 doub N N 142
|
| 789 |
+
U C2 N3 sing N N 143
|
| 790 |
+
U N3 C4 sing N N 144
|
| 791 |
+
U N3 H3 sing N N 145
|
| 792 |
+
U C4 O4 doub N N 146
|
| 793 |
+
U C4 C5 sing N N 147
|
| 794 |
+
U C5 C6 doub N N 148
|
| 795 |
+
U C5 H5 sing N N 149
|
| 796 |
+
U C6 H6 sing N N 150
|
| 797 |
+
#
|
| 798 |
+
loop_
|
| 799 |
+
_ndb_struct_conf_na.entry_id
|
| 800 |
+
_ndb_struct_conf_na.feature
|
| 801 |
+
1F9L 'double helix'
|
| 802 |
+
1F9L 'a-form double helix'
|
| 803 |
+
1F9L tetraloop
|
| 804 |
+
1F9L 'mismatched base pair'
|
| 805 |
+
#
|
| 806 |
+
loop_
|
| 807 |
+
_ndb_struct_na_base_pair.model_number
|
| 808 |
+
_ndb_struct_na_base_pair.i_label_asym_id
|
| 809 |
+
_ndb_struct_na_base_pair.i_label_comp_id
|
| 810 |
+
_ndb_struct_na_base_pair.i_label_seq_id
|
| 811 |
+
_ndb_struct_na_base_pair.i_symmetry
|
| 812 |
+
_ndb_struct_na_base_pair.j_label_asym_id
|
| 813 |
+
_ndb_struct_na_base_pair.j_label_comp_id
|
| 814 |
+
_ndb_struct_na_base_pair.j_label_seq_id
|
| 815 |
+
_ndb_struct_na_base_pair.j_symmetry
|
| 816 |
+
_ndb_struct_na_base_pair.shear
|
| 817 |
+
_ndb_struct_na_base_pair.stretch
|
| 818 |
+
_ndb_struct_na_base_pair.stagger
|
| 819 |
+
_ndb_struct_na_base_pair.buckle
|
| 820 |
+
_ndb_struct_na_base_pair.propeller
|
| 821 |
+
_ndb_struct_na_base_pair.opening
|
| 822 |
+
_ndb_struct_na_base_pair.pair_number
|
| 823 |
+
_ndb_struct_na_base_pair.pair_name
|
| 824 |
+
_ndb_struct_na_base_pair.i_auth_asym_id
|
| 825 |
+
_ndb_struct_na_base_pair.i_auth_seq_id
|
| 826 |
+
_ndb_struct_na_base_pair.i_PDB_ins_code
|
| 827 |
+
_ndb_struct_na_base_pair.j_auth_asym_id
|
| 828 |
+
_ndb_struct_na_base_pair.j_auth_seq_id
|
| 829 |
+
_ndb_struct_na_base_pair.j_PDB_ins_code
|
| 830 |
+
_ndb_struct_na_base_pair.hbond_type_28
|
| 831 |
+
_ndb_struct_na_base_pair.hbond_type_12
|
| 832 |
+
1 A G 1 1_555 A C 22 1_555 -0.014 -0.146 -0.317 29.668 20.355 -5.981 1 A_G1:C22_A A 1 ? A 22 ? 19 1
|
| 833 |
+
1 A G 2 1_555 A C 21 1_555 -0.430 -0.396 0.676 2.523 26.162 7.136 2 A_G2:C21_A A 2 ? A 21 ? 19 1
|
| 834 |
+
1 A C 3 1_555 A G 20 1_555 0.197 -0.282 -0.837 10.066 -17.715 3.509 3 A_C3:G20_A A 3 ? A 20 ? 19 1
|
| 835 |
+
1 A G 4 1_555 A C 19 1_555 0.382 -0.427 0.881 -3.547 -17.763 -18.929 4 A_G4:C19_A A 4 ? A 19 ? 19 1
|
| 836 |
+
1 A A 5 1_555 A G 18 1_555 0.043 1.123 -0.872 -6.105 0.510 -23.184 5 A_A5:G18_A A 5 ? A 18 ? 8 ?
|
| 837 |
+
1 A A 6 1_555 A G 17 1_555 0.107 1.247 -0.538 1.811 -5.291 -22.412 6 A_A6:G17_A A 6 ? A 17 ? 8 ?
|
| 838 |
+
1 A G 7 1_555 A U 16 1_555 -2.147 -0.370 -0.501 -4.341 -9.111 -5.401 7 A_G7:U16_A A 7 ? A 16 ? 28 ?
|
| 839 |
+
1 A U 8 1_555 A A 15 1_555 0.097 -0.044 -0.353 2.072 -0.802 -6.032 8 A_U8:A15_A A 8 ? A 15 ? 20 1
|
| 840 |
+
1 A C 9 1_555 A G 14 1_555 0.064 -0.172 0.008 20.290 -5.584 -3.456 9 A_C9:G14_A A 9 ? A 14 ? 19 1
|
| 841 |
+
1 A G 10 1_555 A A 13 1_555 7.104 -5.355 -1.176 31.387 7.842 -63.956 10 A_G10:A13_A A 10 ? A 13 ? ? ?
|
| 842 |
+
#
|
| 843 |
+
loop_
|
| 844 |
+
_ndb_struct_na_base_pair_step.model_number
|
| 845 |
+
_ndb_struct_na_base_pair_step.i_label_asym_id_1
|
| 846 |
+
_ndb_struct_na_base_pair_step.i_label_comp_id_1
|
| 847 |
+
_ndb_struct_na_base_pair_step.i_label_seq_id_1
|
| 848 |
+
_ndb_struct_na_base_pair_step.i_symmetry_1
|
| 849 |
+
_ndb_struct_na_base_pair_step.j_label_asym_id_1
|
| 850 |
+
_ndb_struct_na_base_pair_step.j_label_comp_id_1
|
| 851 |
+
_ndb_struct_na_base_pair_step.j_label_seq_id_1
|
| 852 |
+
_ndb_struct_na_base_pair_step.j_symmetry_1
|
| 853 |
+
_ndb_struct_na_base_pair_step.i_label_asym_id_2
|
| 854 |
+
_ndb_struct_na_base_pair_step.i_label_comp_id_2
|
| 855 |
+
_ndb_struct_na_base_pair_step.i_label_seq_id_2
|
| 856 |
+
_ndb_struct_na_base_pair_step.i_symmetry_2
|
| 857 |
+
_ndb_struct_na_base_pair_step.j_label_asym_id_2
|
| 858 |
+
_ndb_struct_na_base_pair_step.j_label_comp_id_2
|
| 859 |
+
_ndb_struct_na_base_pair_step.j_label_seq_id_2
|
| 860 |
+
_ndb_struct_na_base_pair_step.j_symmetry_2
|
| 861 |
+
_ndb_struct_na_base_pair_step.shift
|
| 862 |
+
_ndb_struct_na_base_pair_step.slide
|
| 863 |
+
_ndb_struct_na_base_pair_step.rise
|
| 864 |
+
_ndb_struct_na_base_pair_step.tilt
|
| 865 |
+
_ndb_struct_na_base_pair_step.roll
|
| 866 |
+
_ndb_struct_na_base_pair_step.twist
|
| 867 |
+
_ndb_struct_na_base_pair_step.x_displacement
|
| 868 |
+
_ndb_struct_na_base_pair_step.y_displacement
|
| 869 |
+
_ndb_struct_na_base_pair_step.helical_rise
|
| 870 |
+
_ndb_struct_na_base_pair_step.inclination
|
| 871 |
+
_ndb_struct_na_base_pair_step.tip
|
| 872 |
+
_ndb_struct_na_base_pair_step.helical_twist
|
| 873 |
+
_ndb_struct_na_base_pair_step.step_number
|
| 874 |
+
_ndb_struct_na_base_pair_step.step_name
|
| 875 |
+
_ndb_struct_na_base_pair_step.i_auth_asym_id_1
|
| 876 |
+
_ndb_struct_na_base_pair_step.i_auth_seq_id_1
|
| 877 |
+
_ndb_struct_na_base_pair_step.i_PDB_ins_code_1
|
| 878 |
+
_ndb_struct_na_base_pair_step.j_auth_asym_id_1
|
| 879 |
+
_ndb_struct_na_base_pair_step.j_auth_seq_id_1
|
| 880 |
+
_ndb_struct_na_base_pair_step.j_PDB_ins_code_1
|
| 881 |
+
_ndb_struct_na_base_pair_step.i_auth_asym_id_2
|
| 882 |
+
_ndb_struct_na_base_pair_step.i_auth_seq_id_2
|
| 883 |
+
_ndb_struct_na_base_pair_step.i_PDB_ins_code_2
|
| 884 |
+
_ndb_struct_na_base_pair_step.j_auth_asym_id_2
|
| 885 |
+
_ndb_struct_na_base_pair_step.j_auth_seq_id_2
|
| 886 |
+
_ndb_struct_na_base_pair_step.j_PDB_ins_code_2
|
| 887 |
+
1 A G 1 1_555 A C 22 1_555 A G 2 1_555 A C 21 1_555 1.065 -0.598 6.124 -9.796 -6.023 22.761 1.811 -7.569 5.217 -14.160 23.029
|
| 888 |
+
25.467 1 AA_G1G2:C21C22_AA A 1 ? A 22 ? A 2 ? A 21 ?
|
| 889 |
+
1 A G 2 1_555 A C 21 1_555 A C 3 1_555 A G 20 1_555 0.743 -2.087 2.908 12.339 16.037 34.855 -4.503 0.044 1.951 24.399 -18.774
|
| 890 |
+
40.145 2 AA_G2C3:G20C21_AA A 2 ? A 21 ? A 3 ? A 20 ?
|
| 891 |
+
1 A C 3 1_555 A G 20 1_555 A G 4 1_555 A C 19 1_555 -2.712 -1.585 3.945 -8.779 -0.888 32.183 -2.567 2.797 4.548 -1.565 15.477
|
| 892 |
+
33.340 3 AA_C3G4:C19G20_AA A 3 ? A 20 ? A 4 ? A 19 ?
|
| 893 |
+
1 A G 4 1_555 A C 19 1_555 A A 5 1_555 A G 18 1_555 0.983 -2.023 3.555 10.529 -5.245 25.609 -2.676 0.958 3.973 -11.115 -22.315
|
| 894 |
+
28.140 4 AA_G4A5:G18C19_AA A 4 ? A 19 ? A 5 ? A 18 ?
|
| 895 |
+
1 A A 5 1_555 A G 18 1_555 A A 6 1_555 A G 17 1_555 -0.188 -2.046 3.154 -0.764 7.862 25.806 -6.144 0.232 2.439 17.100 1.663
|
| 896 |
+
26.968 5 AA_A5A6:G17G18_AA A 5 ? A 18 ? A 6 ? A 17 ?
|
| 897 |
+
1 A A 6 1_555 A G 17 1_555 A G 7 1_555 A U 16 1_555 1.859 -0.705 3.763 -0.917 10.676 29.918 -3.462 -3.586 3.268 19.893 1.709
|
| 898 |
+
31.738 6 AA_A6G7:U16G17_AA A 6 ? A 17 ? A 7 ? A 16 ?
|
| 899 |
+
1 A G 7 1_555 A U 16 1_555 A U 8 1_555 A A 15 1_555 -1.236 -2.032 3.088 -2.931 10.754 34.844 -4.535 1.620 2.467 17.416 4.747
|
| 900 |
+
36.531 7 AA_G7U8:A15U16_AA A 7 ? A 16 ? A 8 ? A 15 ?
|
| 901 |
+
1 A U 8 1_555 A A 15 1_555 A C 9 1_555 A G 14 1_555 0.224 -0.932 3.623 -2.490 -18.192 27.515 2.063 -0.902 3.523 -33.885 4.638
|
| 902 |
+
32.981 8 AA_U8C9:G14A15_AA A 8 ? A 15 ? A 9 ? A 14 ?
|
| 903 |
+
1 A C 9 1_555 A G 14 1_555 A G 10 1_555 A A 13 1_555 -3.903 -1.230 4.196 13.186 13.447 64.530 -1.722 4.134 3.156 12.322 -12.084
|
| 904 |
+
66.936 9 AA_C9G10:A13G14_AA A 9 ? A 14 ? A 10 ? A 13 ?
|
| 905 |
+
#
|
| 906 |
+
loop_
|
| 907 |
+
_pdbx_nmr_spectrometer.spectrometer_id
|
| 908 |
+
_pdbx_nmr_spectrometer.type
|
| 909 |
+
_pdbx_nmr_spectrometer.manufacturer
|
| 910 |
+
_pdbx_nmr_spectrometer.model
|
| 911 |
+
_pdbx_nmr_spectrometer.field_strength
|
| 912 |
+
1 ? Bruker AMX 600
|
| 913 |
+
2 ? Bruker DRX 500
|
| 914 |
+
#
|
| 915 |
+
_atom_sites.entry_id 1F9L
|
| 916 |
+
_atom_sites.fract_transf_matrix[1][1] 1.000000
|
| 917 |
+
_atom_sites.fract_transf_matrix[1][2] 0.000000
|
| 918 |
+
_atom_sites.fract_transf_matrix[1][3] 0.000000
|
| 919 |
+
_atom_sites.fract_transf_matrix[2][1] 0.000000
|
| 920 |
+
_atom_sites.fract_transf_matrix[2][2] 1.000000
|
| 921 |
+
_atom_sites.fract_transf_matrix[2][3] 0.000000
|
| 922 |
+
_atom_sites.fract_transf_matrix[3][1] 0.000000
|
| 923 |
+
_atom_sites.fract_transf_matrix[3][2] 0.000000
|
| 924 |
+
_atom_sites.fract_transf_matrix[3][3] 1.000000
|
| 925 |
+
_atom_sites.fract_transf_vector[1] 0.00000
|
| 926 |
+
_atom_sites.fract_transf_vector[2] 0.00000
|
| 927 |
+
_atom_sites.fract_transf_vector[3] 0.00000
|
| 928 |
+
#
|
| 929 |
+
loop_
|
| 930 |
+
_atom_type.symbol
|
| 931 |
+
C
|
| 932 |
+
H
|
| 933 |
+
N
|
| 934 |
+
O
|
| 935 |
+
P
|
| 936 |
+
#
|
| 937 |
+
loop_
|
| 938 |
+
_atom_site.group_PDB
|
| 939 |
+
_atom_site.id
|
| 940 |
+
_atom_site.type_symbol
|
| 941 |
+
_atom_site.label_atom_id
|
| 942 |
+
_atom_site.label_alt_id
|
| 943 |
+
_atom_site.label_comp_id
|
| 944 |
+
_atom_site.label_asym_id
|
| 945 |
+
_atom_site.label_entity_id
|
| 946 |
+
_atom_site.label_seq_id
|
| 947 |
+
_atom_site.pdbx_PDB_ins_code
|
| 948 |
+
_atom_site.Cartn_x
|
| 949 |
+
_atom_site.Cartn_y
|
| 950 |
+
_atom_site.Cartn_z
|
| 951 |
+
_atom_site.occupancy
|
| 952 |
+
_atom_site.B_iso_or_equiv
|
| 953 |
+
_atom_site.pdbx_formal_charge
|
| 954 |
+
_atom_site.auth_seq_id
|
| 955 |
+
_atom_site.auth_comp_id
|
| 956 |
+
_atom_site.auth_asym_id
|
| 957 |
+
_atom_site.auth_atom_id
|
| 958 |
+
_atom_site.pdbx_PDB_model_num
|
| 959 |
+
ATOM 1 O "O5'" . G A 1 1 ? 14.388 3.385 24.965 1.00 0.00 ? 1 G A "O5'" 1
|
| 960 |
+
ATOM 2 C "C5'" . G A 1 1 ? 13.478 4.418 24.580 1.00 0.00 ? 1 G A "C5'" 1
|
| 961 |
+
ATOM 3 C "C4'" . G A 1 1 ? 13.435 4.590 23.065 1.00 0.00 ? 1 G A "C4'" 1
|
| 962 |
+
ATOM 4 O "O4'" . G A 1 1 ? 14.736 4.947 22.595 1.00 0.00 ? 1 G A "O4'" 1
|
| 963 |
+
ATOM 5 C "C3'" . G A 1 1 ? 13.089 3.329 22.295 1.00 0.00 ? 1 G A "C3'" 1
|
| 964 |
+
ATOM 6 O "O3'" . G A 1 1 ? 11.678 3.378 22.045 1.00 0.00 ? 1 G A "O3'" 1
|
| 965 |
+
ATOM 7 C "C2'" . G A 1 1 ? 13.777 3.520 20.953 1.00 0.00 ? 1 G A "C2'" 1
|
| 966 |
+
ATOM 8 O "O2'" . G A 1 1 ? 12.906 4.180 20.035 1.00 0.00 ? 1 G A "O2'" 1
|
| 967 |
+
ATOM 9 C "C1'" . G A 1 1 ? 14.968 4.415 21.282 1.00 0.00 ? 1 G A "C1'" 1
|
| 968 |
+
ATOM 10 N N9 . G A 1 1 ? 16.249 3.679 21.271 1.00 0.00 ? 1 G A N9 1
|
| 969 |
+
ATOM 11 C C8 . G A 1 1 ? 16.584 2.527 21.934 1.00 0.00 ? 1 G A C8 1
|
| 970 |
+
ATOM 12 N N7 . G A 1 1 ? 17.800 2.118 21.690 1.00 0.00 ? 1 G A N7 1
|
| 971 |
+
ATOM 13 C C5 . G A 1 1 ? 18.303 3.064 20.802 1.00 0.00 ? 1 G A C5 1
|
| 972 |
+
ATOM 14 C C6 . G A 1 1 ? 19.581 3.147 20.182 1.00 0.00 ? 1 G A C6 1
|
| 973 |
+
ATOM 15 O O6 . G A 1 1 ? 20.535 2.380 20.294 1.00 0.00 ? 1 G A O6 1
|
| 974 |
+
ATOM 16 N N1 . G A 1 1 ? 19.678 4.258 19.358 1.00 0.00 ? 1 G A N1 1
|
| 975 |
+
ATOM 17 C C2 . G A 1 1 ? 18.675 5.178 19.153 1.00 0.00 ? 1 G A C2 1
|
| 976 |
+
ATOM 18 N N2 . G A 1 1 ? 18.940 6.190 18.327 1.00 0.00 ? 1 G A N2 1
|
| 977 |
+
ATOM 19 N N3 . G A 1 1 ? 17.473 5.108 19.730 1.00 0.00 ? 1 G A N3 1
|
| 978 |
+
ATOM 20 C C4 . G A 1 1 ? 17.360 4.027 20.539 1.00 0.00 ? 1 G A C4 1
|
| 979 |
+
ATOM 21 H "H5'" . G A 1 1 ? 13.792 5.358 25.038 1.00 0.00 ? 1 G A "H5'" 1
|
| 980 |
+
ATOM 22 H "H5''" . G A 1 1 ? 12.480 4.164 24.937 1.00 0.00 ? 1 G A "H5''" 1
|
| 981 |
+
ATOM 23 H "H4'" . G A 1 1 ? 12.738 5.391 22.820 1.00 0.00 ? 1 G A "H4'" 1
|
| 982 |
+
ATOM 24 H "H3'" . G A 1 1 ? 13.381 2.412 22.806 1.00 0.00 ? 1 G A "H3'" 1
|
| 983 |
+
ATOM 25 H "H2'" . G A 1 1 ? 14.119 2.564 20.558 1.00 0.00 ? 1 G A "H2'" 1
|
| 984 |
+
ATOM 26 H "HO2'" . G A 1 1 ? 12.041 4.234 20.449 1.00 0.00 ? 1 G A "HO2'" 1
|
| 985 |
+
ATOM 27 H "H1'" . G A 1 1 ? 15.025 5.237 20.571 1.00 0.00 ? 1 G A "H1'" 1
|
| 986 |
+
ATOM 28 H H8 . G A 1 1 ? 15.900 2.001 22.599 1.00 0.00 ? 1 G A H8 1
|
| 987 |
+
ATOM 29 H H1 . G A 1 1 ? 20.554 4.395 18.871 1.00 0.00 ? 1 G A H1 1
|
| 988 |
+
ATOM 30 H H21 . G A 1 1 ? 19.867 6.299 17.943 1.00 0.00 ? 1 G A H21 1
|
| 989 |
+
ATOM 31 H H22 . G A 1 1 ? 18.213 6.849 18.087 1.00 0.00 ? 1 G A H22 1
|
| 990 |
+
ATOM 32 H "HO5'" . G A 1 1 ? 14.685 2.952 24.161 1.00 0.00 ? 1 G A "HO5'" 1
|
| 991 |
+
ATOM 33 P P . G A 1 2 ? 10.950 2.241 21.163 1.00 0.00 ? 2 G A P 1
|
| 992 |
+
ATOM 34 O OP1 . G A 1 2 ? 9.527 2.182 21.569 1.00 0.00 ? 2 G A OP1 1
|
| 993 |
+
ATOM 35 O OP2 . G A 1 2 ? 11.780 1.017 21.210 1.00 0.00 ? 2 G A OP2 1
|
| 994 |
+
ATOM 36 O "O5'" . G A 1 2 ? 11.021 2.840 19.667 1.00 0.00 ? 2 G A "O5'" 1
|
| 995 |
+
ATOM 37 C "C5'" . G A 1 2 ? 10.073 3.814 19.216 1.00 0.00 ? 2 G A "C5'" 1
|
| 996 |
+
ATOM 38 C "C4'" . G A 1 2 ? 10.520 4.464 17.908 1.00 0.00 ? 2 G A "C4'" 1
|
| 997 |
+
ATOM 39 O "O4'" . G A 1 2 ? 11.932 4.699 17.970 1.00 0.00 ? 2 G A "O4'" 1
|
| 998 |
+
ATOM 40 C "C3'" . G A 1 2 ? 10.343 3.593 16.672 1.00 0.00 ? 2 G A "C3'" 1
|
| 999 |
+
ATOM 41 O "O3'" . G A 1 2 ? 9.094 3.937 16.071 1.00 0.00 ? 2 G A "O3'" 1
|
| 1000 |
+
ATOM 42 C "C2'" . G A 1 2 ? 11.435 4.093 15.745 1.00 0.00 ? 2 G A "C2'" 1
|
| 1001 |
+
ATOM 43 O "O2'" . G A 1 2 ? 11.036 5.309 15.108 1.00 0.00 ? 2 G A "O2'" 1
|
| 1002 |
+
ATOM 44 C "C1'" . G A 1 2 ? 12.568 4.350 16.730 1.00 0.00 ? 2 G A "C1'" 1
|
| 1003 |
+
ATOM 45 N N9 . G A 1 2 ? 13.368 3.135 16.962 1.00 0.00 ? 2 G A N9 1
|
| 1004 |
+
ATOM 46 C C8 . G A 1 2 ? 13.293 2.265 18.016 1.00 0.00 ? 2 G A C8 1
|
| 1005 |
+
ATOM 47 N N7 . G A 1 2 ? 14.100 1.246 17.916 1.00 0.00 ? 2 G A N7 1
|
| 1006 |
+
ATOM 48 C C5 . G A 1 2 ? 14.757 1.456 16.709 1.00 0.00 ? 2 G A C5 1
|
| 1007 |
+
ATOM 49 C C6 . G A 1 2 ? 15.756 0.674 16.065 1.00 0.00 ? 2 G A C6 1
|
| 1008 |
+
ATOM 50 O O6 . G A 1 2 ? 16.265 -0.382 16.441 1.00 0.00 ? 2 G A O6 1
|
| 1009 |
+
ATOM 51 N N1 . G A 1 2 ? 16.148 1.241 14.864 1.00 0.00 ? 2 G A N1 1
|
| 1010 |
+
ATOM 52 C C2 . G A 1 2 ? 15.651 2.413 14.341 1.00 0.00 ? 2 G A C2 1
|
| 1011 |
+
ATOM 53 N N2 . G A 1 2 ? 16.149 2.811 13.170 1.00 0.00 ? 2 G A N2 1
|
| 1012 |
+
ATOM 54 N N3 . G A 1 2 ? 14.715 3.156 14.937 1.00 0.00 ? 2 G A N3 1
|
| 1013 |
+
ATOM 55 C C4 . G A 1 2 ? 14.316 2.616 16.114 1.00 0.00 ? 2 G A C4 1
|
| 1014 |
+
ATOM 56 H "H5'" . G A 1 2 ? 9.964 4.585 19.979 1.00 0.00 ? 2 G A "H5'" 1
|
| 1015 |
+
ATOM 57 H "H5''" . G A 1 2 ? 9.110 3.328 19.060 1.00 0.00 ? 2 G A "H5''" 1
|
| 1016 |
+
ATOM 58 H "H4'" . G A 1 2 ? 10.004 5.416 17.786 1.00 0.00 ? 2 G A "H4'" 1
|
| 1017 |
+
ATOM 59 H "H3'" . G A 1 2 ? 10.411 2.525 16.883 1.00 0.00 ? 2 G A "H3'" 1
|
| 1018 |
+
ATOM 60 H "H2'" . G A 1 2 ? 11.711 3.336 15.016 1.00 0.00 ? 2 G A "H2'" 1
|
| 1019 |
+
ATOM 61 H "HO2'" . G A 1 2 ? 11.041 5.998 15.777 1.00 0.00 ? 2 G A "HO2'" 1
|
| 1020 |
+
ATOM 62 H "H1'" . G A 1 2 ? 13.214 5.164 16.400 1.00 0.00 ? 2 G A "H1'" 1
|
| 1021 |
+
ATOM 63 H H8 . G A 1 2 ? 12.614 2.411 18.856 1.00 0.00 ? 2 G A H8 1
|
| 1022 |
+
ATOM 64 H H1 . G A 1 2 ? 16.845 0.744 14.332 1.00 0.00 ? 2 G A H1 1
|
| 1023 |
+
ATOM 65 H H21 . G A 1 2 ? 16.908 2.299 12.743 1.00 0.00 ? 2 G A H21 1
|
| 1024 |
+
ATOM 66 H H22 . G A 1 2 ? 15.768 3.625 12.709 1.00 0.00 ? 2 G A H22 1
|
| 1025 |
+
ATOM 67 P P . C A 1 3 ? 8.507 3.049 14.861 1.00 0.00 ? 3 C A P 1
|
| 1026 |
+
ATOM 68 O OP1 . C A 1 3 ? 7.477 3.847 14.160 1.00 0.00 ? 3 C A OP1 1
|
| 1027 |
+
ATOM 69 O OP2 . C A 1 3 ? 8.168 1.710 15.393 1.00 0.00 ? 3 C A OP2 1
|
| 1028 |
+
ATOM 70 O "O5'" . C A 1 3 ? 9.779 2.896 13.882 1.00 0.00 ? 3 C A "O5'" 1
|
| 1029 |
+
ATOM 71 C "C5'" . C A 1 3 ? 9.861 3.677 12.688 1.00 0.00 ? 3 C A "C5'" 1
|
| 1030 |
+
ATOM 72 C "C4'" . C A 1 3 ? 11.106 3.342 11.863 1.00 0.00 ? 3 C A "C4'" 1
|
| 1031 |
+
ATOM 73 O "O4'" . C A 1 3 ? 12.193 3.013 12.727 1.00 0.00 ? 3 C A "O4'" 1
|
| 1032 |
+
ATOM 74 C "C3'" . C A 1 3 ? 10.984 2.122 10.977 1.00 0.00 ? 3 C A "C3'" 1
|
| 1033 |
+
ATOM 75 O "O3'" . C A 1 3 ? 10.446 2.563 9.728 1.00 0.00 ? 3 C A "O3'" 1
|
| 1034 |
+
ATOM 76 C "C2'" . C A 1 3 ? 12.438 1.739 10.731 1.00 0.00 ? 3 C A "C2'" 1
|
| 1035 |
+
ATOM 77 O "O2'" . C A 1 3 ? 12.979 2.503 9.650 1.00 0.00 ? 3 C A "O2'" 1
|
| 1036 |
+
ATOM 78 C "C1'" . C A 1 3 ? 13.112 2.133 12.053 1.00 0.00 ? 3 C A "C1'" 1
|
| 1037 |
+
ATOM 79 N N1 . C A 1 3 ? 13.392 0.965 12.920 1.00 0.00 ? 3 C A N1 1
|
| 1038 |
+
ATOM 80 C C2 . C A 1 3 ? 14.549 0.238 12.670 1.00 0.00 ? 3 C A C2 1
|
| 1039 |
+
ATOM 81 O O2 . C A 1 3 ? 15.290 0.559 11.743 1.00 0.00 ? 3 C A O2 1
|
| 1040 |
+
ATOM 82 N N3 . C A 1 3 ? 14.840 -0.826 13.467 1.00 0.00 ? 3 C A N3 1
|
| 1041 |
+
ATOM 83 C C4 . C A 1 3 ? 14.027 -1.168 14.473 1.00 0.00 ? 3 C A C4 1
|
| 1042 |
+
ATOM 84 N N4 . C A 1 3 ? 14.366 -2.221 15.216 1.00 0.00 ? 3 C A N4 1
|
| 1043 |
+
ATOM 85 C C5 . C A 1 3 ? 12.833 -0.427 14.737 1.00 0.00 ? 3 C A C5 1
|
| 1044 |
+
ATOM 86 C C6 . C A 1 3 ? 12.554 0.624 13.941 1.00 0.00 ? 3 C A C6 1
|
| 1045 |
+
ATOM 87 H "H5'" . C A 1 3 ? 9.886 4.733 12.960 1.00 0.00 ? 3 C A "H5'" 1
|
| 1046 |
+
ATOM 88 H "H5''" . C A 1 3 ? 8.975 3.490 12.081 1.00 0.00 ? 3 C A "H5''" 1
|
| 1047 |
+
ATOM 89 H "H4'" . C A 1 3 ? 11.381 4.215 11.269 1.00 0.00 ? 3 C A "H4'" 1
|
| 1048 |
+
ATOM 90 H "H3'" . C A 1 3 ? 10.391 1.320 11.418 1.00 0.00 ? 3 C A "H3'" 1
|
| 1049 |
+
ATOM 91 H "H2'" . C A 1 3 ? 12.537 0.669 10.544 1.00 0.00 ? 3 C A "H2'" 1
|
| 1050 |
+
ATOM 92 H "HO2'" . C A 1 3 ? 12.917 1.962 8.860 1.00 0.00 ? 3 C A "HO2'" 1
|
| 1051 |
+
ATOM 93 H "H1'" . C A 1 3 ? 14.042 2.672 11.862 1.00 0.00 ? 3 C A "H1'" 1
|
| 1052 |
+
ATOM 94 H H41 . C A 1 3 ? 15.172 -2.777 14.967 1.00 0.00 ? 3 C A H41 1
|
| 1053 |
+
ATOM 95 H H42 . C A 1 3 ? 13.816 -2.464 16.028 1.00 0.00 ? 3 C A H42 1
|
| 1054 |
+
ATOM 96 H H5 . C A 1 3 ? 12.168 -0.692 15.557 1.00 0.00 ? 3 C A H5 1
|
| 1055 |
+
ATOM 97 H H6 . C A 1 3 ? 11.645 1.199 14.108 1.00 0.00 ? 3 C A H6 1
|
| 1056 |
+
ATOM 98 P P . G A 1 4 ? 9.741 1.520 8.725 1.00 0.00 ? 4 G A P 1
|
| 1057 |
+
ATOM 99 O OP1 . G A 1 4 ? 8.783 2.267 7.879 1.00 0.00 ? 4 G A OP1 1
|
| 1058 |
+
ATOM 100 O OP2 . G A 1 4 ? 9.277 0.358 9.516 1.00 0.00 ? 4 G A OP2 1
|
| 1059 |
+
ATOM 101 O "O5'" . G A 1 4 ? 10.966 1.042 7.798 1.00 0.00 ? 4 G A "O5'" 1
|
| 1060 |
+
ATOM 102 C "C5'" . G A 1 4 ? 11.563 1.941 6.859 1.00 0.00 ? 4 G A "C5'" 1
|
| 1061 |
+
ATOM 103 C "C4'" . G A 1 4 ? 12.689 1.268 6.084 1.00 0.00 ? 4 G A "C4'" 1
|
| 1062 |
+
ATOM 104 O "O4'" . G A 1 4 ? 13.643 0.743 7.010 1.00 0.00 ? 4 G A "O4'" 1
|
| 1063 |
+
ATOM 105 C "C3'" . G A 1 4 ? 12.255 0.069 5.258 1.00 0.00 ? 4 G A "C3'" 1
|
| 1064 |
+
ATOM 106 O "O3'" . G A 1 4 ? 12.043 0.537 3.922 1.00 0.00 ? 4 G A "O3'" 1
|
| 1065 |
+
ATOM 107 C "C2'" . G A 1 4 ? 13.489 -0.820 5.226 1.00 0.00 ? 4 G A "C2'" 1
|
| 1066 |
+
ATOM 108 O "O2'" . G A 1 4 ? 14.346 -0.446 4.144 1.00 0.00 ? 4 G A "O2'" 1
|
| 1067 |
+
ATOM 109 C "C1'" . G A 1 4 ? 14.161 -0.521 6.567 1.00 0.00 ? 4 G A "C1'" 1
|
| 1068 |
+
ATOM 110 N N9 . G A 1 4 ? 13.860 -1.540 7.591 1.00 0.00 ? 4 G A N9 1
|
| 1069 |
+
ATOM 111 C C8 . G A 1 4 ? 12.878 -1.523 8.548 1.00 0.00 ? 4 G A C8 1
|
| 1070 |
+
ATOM 112 N N7 . G A 1 4 ? 12.879 -2.573 9.319 1.00 0.00 ? 4 G A N7 1
|
| 1071 |
+
ATOM 113 C C5 . G A 1 4 ? 13.934 -3.342 8.841 1.00 0.00 ? 4 G A C5 1
|
| 1072 |
+
ATOM 114 C C6 . G A 1 4 ? 14.417 -4.601 9.288 1.00 0.00 ? 4 G A C6 1
|
| 1073 |
+
ATOM 115 O O6 . G A 1 4 ? 13.987 -5.297 10.205 1.00 0.00 ? 4 G A O6 1
|
| 1074 |
+
ATOM 116 N N1 . G A 1 4 ? 15.499 -5.033 8.537 1.00 0.00 ? 4 G A N1 1
|
| 1075 |
+
ATOM 117 C C2 . G A 1 4 ? 16.054 -4.343 7.483 1.00 0.00 ? 4 G A C2 1
|
| 1076 |
+
ATOM 118 N N2 . G A 1 4 ? 17.099 -4.909 6.870 1.00 0.00 ? 4 G A N2 1
|
| 1077 |
+
ATOM 119 N N3 . G A 1 4 ? 15.607 -3.157 7.052 1.00 0.00 ? 4 G A N3 1
|
| 1078 |
+
ATOM 120 C C4 . G A 1 4 ? 14.546 -2.720 7.780 1.00 0.00 ? 4 G A C4 1
|
| 1079 |
+
ATOM 121 H "H5'" . G A 1 4 ? 11.963 2.802 7.395 1.00 0.00 ? 4 G A "H5'" 1
|
| 1080 |
+
ATOM 122 H "H5''" . G A 1 4 ? 10.800 2.280 6.158 1.00 0.00 ? 4 G A "H5''" 1
|
| 1081 |
+
ATOM 123 H "H4'" . G A 1 4 ? 13.177 2.011 5.454 1.00 0.00 ? 4 G A "H4'" 1
|
| 1082 |
+
ATOM 124 H "H3'" . G A 1 4 ? 11.372 -0.432 5.656 1.00 0.00 ? 4 G A "H3'" 1
|
| 1083 |
+
ATOM 125 H "H2'" . G A 1 4 ? 13.207 -1.867 5.159 1.00 0.00 ? 4 G A "H2'" 1
|
| 1084 |
+
ATOM 126 H "HO2'" . G A 1 4 ? 14.263 0.503 4.028 1.00 0.00 ? 4 G A "HO2'" 1
|
| 1085 |
+
ATOM 127 H "H1'" . G A 1 4 ? 15.238 -0.446 6.450 1.00 0.00 ? 4 G A "H1'" 1
|
| 1086 |
+
ATOM 128 H H8 . G A 1 4 ? 12.167 -0.704 8.658 1.00 0.00 ? 4 G A H8 1
|
| 1087 |
+
ATOM 129 H H1 . G A 1 4 ? 15.907 -5.922 8.789 1.00 0.00 ? 4 G A H1 1
|
| 1088 |
+
ATOM 130 H H21 . G A 1 4 ? 17.400 -5.841 7.132 1.00 0.00 ? 4 G A H21 1
|
| 1089 |
+
ATOM 131 H H22 . G A 1 4 ? 17.589 -4.408 6.143 1.00 0.00 ? 4 G A H22 1
|
| 1090 |
+
ATOM 132 P P . A A 1 5 ? 11.076 -0.270 2.918 1.00 0.00 ? 5 A A P 1
|
| 1091 |
+
ATOM 133 O OP1 . A A 1 5 ? 11.902 -0.831 1.825 1.00 0.00 ? 5 A A OP1 1
|
| 1092 |
+
ATOM 134 O OP2 . A A 1 5 ? 9.916 0.592 2.599 1.00 0.00 ? 5 A A OP2 1
|
| 1093 |
+
ATOM 135 O "O5'" . A A 1 5 ? 10.561 -1.485 3.837 1.00 0.00 ? 5 A A "O5'" 1
|
| 1094 |
+
ATOM 136 C "C5'" . A A 1 5 ? 10.507 -2.822 3.330 1.00 0.00 ? 5 A A "C5'" 1
|
| 1095 |
+
ATOM 137 C "C4'" . A A 1 5 ? 11.916 -3.342 2.970 1.00 0.00 ? 5 A A "C4'" 1
|
| 1096 |
+
ATOM 138 O "O4'" . A A 1 5 ? 12.770 -3.175 4.106 1.00 0.00 ? 5 A A "O4'" 1
|
| 1097 |
+
ATOM 139 C "C3'" . A A 1 5 ? 12.036 -4.826 2.565 1.00 0.00 ? 5 A A "C3'" 1
|
| 1098 |
+
ATOM 140 O "O3'" . A A 1 5 ? 12.380 -4.829 1.174 1.00 0.00 ? 5 A A "O3'" 1
|
| 1099 |
+
ATOM 141 C "C2'" . A A 1 5 ? 13.261 -5.357 3.304 1.00 0.00 ? 5 A A "C2'" 1
|
| 1100 |
+
ATOM 142 O "O2'" . A A 1 5 ? 14.404 -5.345 2.445 1.00 0.00 ? 5 A A "O2'" 1
|
| 1101 |
+
ATOM 143 C "C1'" . A A 1 5 ? 13.455 -4.381 4.456 1.00 0.00 ? 5 A A "C1'" 1
|
| 1102 |
+
ATOM 144 N N9 . A A 1 5 ? 12.891 -4.881 5.720 1.00 0.00 ? 5 A A N9 1
|
| 1103 |
+
ATOM 145 C C8 . A A 1 5 ? 11.811 -4.405 6.407 1.00 0.00 ? 5 A A C8 1
|
| 1104 |
+
ATOM 146 N N7 . A A 1 5 ? 11.552 -5.062 7.502 1.00 0.00 ? 5 A A N7 1
|
| 1105 |
+
ATOM 147 C C5 . A A 1 5 ? 12.536 -6.040 7.541 1.00 0.00 ? 5 A A C5 1
|
| 1106 |
+
ATOM 148 C C6 . A A 1 5 ? 12.820 -7.065 8.455 1.00 0.00 ? 5 A A C6 1
|
| 1107 |
+
ATOM 149 N N6 . A A 1 5 ? 12.107 -7.283 9.560 1.00 0.00 ? 5 A A N6 1
|
| 1108 |
+
ATOM 150 N N1 . A A 1 5 ? 13.870 -7.859 8.197 1.00 0.00 ? 5 A A N1 1
|
| 1109 |
+
ATOM 151 C C2 . A A 1 5 ? 14.588 -7.644 7.101 1.00 0.00 ? 5 A A C2 1
|
| 1110 |
+
ATOM 152 N N3 . A A 1 5 ? 14.425 -6.720 6.165 1.00 0.00 ? 5 A A N3 1
|
| 1111 |
+
ATOM 153 C C4 . A A 1 5 ? 13.362 -5.941 6.458 1.00 0.00 ? 5 A A C4 1
|
| 1112 |
+
ATOM 154 H "H5'" . A A 1 5 ? 9.880 -2.832 2.437 1.00 0.00 ? 5 A A "H5'" 1
|
| 1113 |
+
ATOM 155 H "H5''" . A A 1 5 ? 10.053 -3.452 4.095 1.00 0.00 ? 5 A A "H5''" 1
|
| 1114 |
+
ATOM 156 H "H4'" . A A 1 5 ? 12.304 -2.716 2.166 1.00 0.00 ? 5 A A "H4'" 1
|
| 1115 |
+
ATOM 157 H "H3'" . A A 1 5 ? 11.147 -5.429 2.748 1.00 0.00 ? 5 A A "H3'" 1
|
| 1116 |
+
ATOM 158 H "H2'" . A A 1 5 ? 13.072 -6.358 3.688 1.00 0.00 ? 5 A A "H2'" 1
|
| 1117 |
+
ATOM 159 H "HO2'" . A A 1 5 ? 14.912 -4.558 2.655 1.00 0.00 ? 5 A A "HO2'" 1
|
| 1118 |
+
ATOM 160 H "H1'" . A A 1 5 ? 14.512 -4.162 4.599 1.00 0.00 ? 5 A A "H1'" 1
|
| 1119 |
+
ATOM 161 H H8 . A A 1 5 ? 11.237 -3.546 6.077 1.00 0.00 ? 5 A A H8 1
|
| 1120 |
+
ATOM 162 H H61 . A A 1 5 ? 12.329 -8.067 10.157 1.00 0.00 ? 5 A A H61 1
|
| 1121 |
+
ATOM 163 H H62 . A A 1 5 ? 11.344 -6.666 9.799 1.00 0.00 ? 5 A A H62 1
|
| 1122 |
+
ATOM 164 H H2 . A A 1 5 ? 15.432 -8.317 6.955 1.00 0.00 ? 5 A A H2 1
|
| 1123 |
+
ATOM 165 P P . A A 1 6 ? 11.530 -5.694 0.115 1.00 0.00 ? 6 A A P 1
|
| 1124 |
+
ATOM 166 O OP1 . A A 1 6 ? 11.717 -5.097 -1.227 1.00 0.00 ? 6 A A OP1 1
|
| 1125 |
+
ATOM 167 O OP2 . A A 1 6 ? 10.166 -5.881 0.657 1.00 0.00 ? 6 A A OP2 1
|
| 1126 |
+
ATOM 168 O "O5'" . A A 1 6 ? 12.283 -7.116 0.141 1.00 0.00 ? 6 A A "O5'" 1
|
| 1127 |
+
ATOM 169 C "C5'" . A A 1 6 ? 11.711 -8.228 0.835 1.00 0.00 ? 6 A A "C5'" 1
|
| 1128 |
+
ATOM 170 C "C4'" . A A 1 6 ? 12.784 -9.193 1.324 1.00 0.00 ? 6 A A "C4'" 1
|
| 1129 |
+
ATOM 171 O "O4'" . A A 1 6 ? 13.327 -8.716 2.561 1.00 0.00 ? 6 A A "O4'" 1
|
| 1130 |
+
ATOM 172 C "C3'" . A A 1 6 ? 12.281 -10.585 1.656 1.00 0.00 ? 6 A A "C3'" 1
|
| 1131 |
+
ATOM 173 O "O3'" . A A 1 6 ? 12.421 -11.376 0.473 1.00 0.00 ? 6 A A "O3'" 1
|
| 1132 |
+
ATOM 174 C "C2'" . A A 1 6 ? 13.307 -11.082 2.659 1.00 0.00 ? 6 A A "C2'" 1
|
| 1133 |
+
ATOM 175 O "O2'" . A A 1 6 ? 14.487 -11.537 1.992 1.00 0.00 ? 6 A A "O2'" 1
|
| 1134 |
+
ATOM 176 C "C1'" . A A 1 6 ? 13.596 -9.810 3.456 1.00 0.00 ? 6 A A "C1'" 1
|
| 1135 |
+
ATOM 177 N N9 . A A 1 6 ? 12.720 -9.681 4.636 1.00 0.00 ? 6 A A N9 1
|
| 1136 |
+
ATOM 178 C C8 . A A 1 6 ? 11.713 -8.778 4.863 1.00 0.00 ? 6 A A C8 1
|
| 1137 |
+
ATOM 179 N N7 . A A 1 6 ? 11.115 -8.939 6.011 1.00 0.00 ? 6 A A N7 1
|
| 1138 |
+
ATOM 180 C C5 . A A 1 6 ? 11.774 -10.022 6.580 1.00 0.00 ? 6 A A C5 1
|
| 1139 |
+
ATOM 181 C C6 . A A 1 6 ? 11.617 -10.696 7.802 1.00 0.00 ? 6 A A C6 1
|
| 1140 |
+
ATOM 182 N N6 . A A 1 6 ? 10.708 -10.360 8.718 1.00 0.00 ? 6 A A N6 1
|
| 1141 |
+
ATOM 183 N N1 . A A 1 6 ? 12.436 -11.730 8.055 1.00 0.00 ? 6 A A N1 1
|
| 1142 |
+
ATOM 184 C C2 . A A 1 6 ? 13.349 -12.066 7.151 1.00 0.00 ? 6 A A C2 1
|
| 1143 |
+
ATOM 185 N N3 . A A 1 6 ? 13.596 -11.516 5.972 1.00 0.00 ? 6 A A N3 1
|
| 1144 |
+
ATOM 186 C C4 . A A 1 6 ? 12.756 -10.483 5.751 1.00 0.00 ? 6 A A C4 1
|
| 1145 |
+
ATOM 187 H "H5'" . A A 1 6 ? 11.036 -8.758 0.162 1.00 0.00 ? 6 A A "H5'" 1
|
| 1146 |
+
ATOM 188 H "H5''" . A A 1 6 ? 11.144 -7.862 1.691 1.00 0.00 ? 6 A A "H5''" 1
|
| 1147 |
+
ATOM 189 H "H4'" . A A 1 6 ? 13.580 -9.241 0.582 1.00 0.00 ? 6 A A "H4'" 1
|
| 1148 |
+
ATOM 190 H "H3'" . A A 1 6 ? 11.260 -10.597 2.038 1.00 0.00 ? 6 A A "H3'" 1
|
| 1149 |
+
ATOM 191 H "H2'" . A A 1 6 ? 12.887 -11.859 3.298 1.00 0.00 ? 6 A A "H2'" 1
|
| 1150 |
+
ATOM 192 H "HO2'" . A A 1 6 ? 14.318 -11.488 1.048 1.00 0.00 ? 6 A A "HO2'" 1
|
| 1151 |
+
ATOM 193 H "H1'" . A A 1 6 ? 14.639 -9.774 3.772 1.00 0.00 ? 6 A A "H1'" 1
|
| 1152 |
+
ATOM 194 H H8 . A A 1 6 ? 11.439 -7.999 4.152 1.00 0.00 ? 6 A A H8 1
|
| 1153 |
+
ATOM 195 H H61 . A A 1 6 ? 10.604 -10.917 9.553 1.00 0.00 ? 6 A A H61 1
|
| 1154 |
+
ATOM 196 H H62 . A A 1 6 ? 10.125 -9.547 8.576 1.00 0.00 ? 6 A A H62 1
|
| 1155 |
+
ATOM 197 H H2 . A A 1 6 ? 13.983 -12.912 7.417 1.00 0.00 ? 6 A A H2 1
|
| 1156 |
+
ATOM 198 P P . G A 1 7 ? 11.152 -12.148 -0.148 1.00 0.00 ? 7 G A P 1
|
| 1157 |
+
ATOM 199 O OP1 . G A 1 7 ? 11.477 -12.531 -1.540 1.00 0.00 ? 7 G A OP1 1
|
| 1158 |
+
ATOM 200 O OP2 . G A 1 7 ? 9.939 -11.347 0.134 1.00 0.00 ? 7 G A OP2 1
|
| 1159 |
+
ATOM 201 O "O5'" . G A 1 7 ? 11.089 -13.486 0.742 1.00 0.00 ? 7 G A "O5'" 1
|
| 1160 |
+
ATOM 202 C "C5'" . G A 1 7 ? 12.122 -14.468 0.639 1.00 0.00 ? 7 G A "C5'" 1
|
| 1161 |
+
ATOM 203 C "C4'" . G A 1 7 ? 12.231 -15.306 1.907 1.00 0.00 ? 7 G A "C4'" 1
|
| 1162 |
+
ATOM 204 O "O4'" . G A 1 7 ? 12.380 -14.449 3.040 1.00 0.00 ? 7 G A "O4'" 1
|
| 1163 |
+
ATOM 205 C "C3'" . G A 1 7 ? 10.999 -16.118 2.245 1.00 0.00 ? 7 G A "C3'" 1
|
| 1164 |
+
ATOM 206 O "O3'" . G A 1 7 ? 11.125 -17.381 1.588 1.00 0.00 ? 7 G A "O3'" 1
|
| 1165 |
+
ATOM 207 C "C2'" . G A 1 7 ? 11.163 -16.368 3.736 1.00 0.00 ? 7 G A "C2'" 1
|
| 1166 |
+
ATOM 208 O "O2'" . G A 1 7 ? 12.022 -17.487 3.967 1.00 0.00 ? 7 G A "O2'" 1
|
| 1167 |
+
ATOM 209 C "C1'" . G A 1 7 ? 11.825 -15.073 4.213 1.00 0.00 ? 7 G A "C1'" 1
|
| 1168 |
+
ATOM 210 N N9 . G A 1 7 ? 10.850 -14.156 4.833 1.00 0.00 ? 7 G A N9 1
|
| 1169 |
+
ATOM 211 C C8 . G A 1 7 ? 10.352 -12.977 4.344 1.00 0.00 ? 7 G A C8 1
|
| 1170 |
+
ATOM 212 N N7 . G A 1 7 ? 9.485 -12.406 5.134 1.00 0.00 ? 7 G A N7 1
|
| 1171 |
+
ATOM 213 C C5 . G A 1 7 ? 9.403 -13.268 6.222 1.00 0.00 ? 7 G A C5 1
|
| 1172 |
+
ATOM 214 C C6 . G A 1 7 ? 8.617 -13.174 7.405 1.00 0.00 ? 7 G A C6 1
|
| 1173 |
+
ATOM 215 O O6 . G A 1 7 ? 7.825 -12.289 7.725 1.00 0.00 ? 7 G A O6 1
|
| 1174 |
+
ATOM 216 N N1 . G A 1 7 ? 8.829 -14.253 8.248 1.00 0.00 ? 7 G A N1 1
|
| 1175 |
+
ATOM 217 C C2 . G A 1 7 ? 9.690 -15.297 7.993 1.00 0.00 ? 7 G A C2 1
|
| 1176 |
+
ATOM 218 N N2 . G A 1 7 ? 9.771 -16.255 8.916 1.00 0.00 ? 7 G A N2 1
|
| 1177 |
+
ATOM 219 N N3 . G A 1 7 ? 10.433 -15.395 6.886 1.00 0.00 ? 7 G A N3 1
|
| 1178 |
+
ATOM 220 C C4 . G A 1 7 ? 10.236 -14.347 6.048 1.00 0.00 ? 7 G A C4 1
|
| 1179 |
+
ATOM 221 H "H5'" . G A 1 7 ? 13.073 -13.966 0.461 1.00 0.00 ? 7 G A "H5'" 1
|
| 1180 |
+
ATOM 222 H "H5''" . G A 1 7 ? 11.904 -15.125 -0.203 1.00 0.00 ? 7 G A "H5''" 1
|
| 1181 |
+
ATOM 223 H "H4'" . G A 1 7 ? 13.107 -15.951 1.831 1.00 0.00 ? 7 G A "H4'" 1
|
| 1182 |
+
ATOM 224 H "H3'" . G A 1 7 ? 10.066 -15.617 1.989 1.00 0.00 ? 7 G A "H3'" 1
|
| 1183 |
+
ATOM 225 H "H2'" . G A 1 7 ? 10.196 -16.505 4.215 1.00 0.00 ? 7 G A "H2'" 1
|
| 1184 |
+
ATOM 226 H "HO2'" . G A 1 7 ? 12.859 -17.143 4.289 1.00 0.00 ? 7 G A "HO2'" 1
|
| 1185 |
+
ATOM 227 H "H1'" . G A 1 7 ? 12.625 -15.283 4.923 1.00 0.00 ? 7 G A "H1'" 1
|
| 1186 |
+
ATOM 228 H H8 . G A 1 7 ? 10.649 -12.560 3.383 1.00 0.00 ? 7 G A H8 1
|
| 1187 |
+
ATOM 229 H H1 . G A 1 7 ? 8.308 -14.269 9.115 1.00 0.00 ? 7 G A H1 1
|
| 1188 |
+
ATOM 230 H H21 . G A 1 7 ? 9.213 -16.195 9.756 1.00 0.00 ? 7 G A H21 1
|
| 1189 |
+
ATOM 231 H H22 . G A 1 7 ? 10.391 -17.040 8.776 1.00 0.00 ? 7 G A H22 1
|
| 1190 |
+
ATOM 232 P P . U A 1 8 ? 9.820 -18.279 1.299 1.00 0.00 ? 8 U A P 1
|
| 1191 |
+
ATOM 233 O OP1 . U A 1 8 ? 10.264 -19.587 0.768 1.00 0.00 ? 8 U A OP1 1
|
| 1192 |
+
ATOM 234 O OP2 . U A 1 8 ? 8.854 -17.459 0.533 1.00 0.00 ? 8 U A OP2 1
|
| 1193 |
+
ATOM 235 O "O5'" . U A 1 8 ? 9.221 -18.510 2.775 1.00 0.00 ? 8 U A "O5'" 1
|
| 1194 |
+
ATOM 236 C "C5'" . U A 1 8 ? 9.795 -19.487 3.647 1.00 0.00 ? 8 U A "C5'" 1
|
| 1195 |
+
ATOM 237 C "C4'" . U A 1 8 ? 8.785 -19.974 4.682 1.00 0.00 ? 8 U A "C4'" 1
|
| 1196 |
+
ATOM 238 O "O4'" . U A 1 8 ? 8.755 -19.055 5.776 1.00 0.00 ? 8 U A "O4'" 1
|
| 1197 |
+
ATOM 239 C "C3'" . U A 1 8 ? 7.347 -20.010 4.200 1.00 0.00 ? 8 U A "C3'" 1
|
| 1198 |
+
ATOM 240 O "O3'" . U A 1 8 ? 7.089 -21.328 3.706 1.00 0.00 ? 8 U A "O3'" 1
|
| 1199 |
+
ATOM 241 C "C2'" . U A 1 8 ? 6.543 -19.861 5.479 1.00 0.00 ? 8 U A "C2'" 1
|
| 1200 |
+
ATOM 242 O "O2'" . U A 1 8 ? 6.330 -21.136 6.088 1.00 0.00 ? 8 U A "O2'" 1
|
| 1201 |
+
ATOM 243 C "C1'" . U A 1 8 ? 7.443 -19.002 6.360 1.00 0.00 ? 8 U A "C1'" 1
|
| 1202 |
+
ATOM 244 N N1 . U A 1 8 ? 6.989 -17.590 6.402 1.00 0.00 ? 8 U A N1 1
|
| 1203 |
+
ATOM 245 C C2 . U A 1 8 ? 6.187 -17.196 7.465 1.00 0.00 ? 8 U A C2 1
|
| 1204 |
+
ATOM 246 O O2 . U A 1 8 ? 5.869 -17.964 8.371 1.00 0.00 ? 8 U A O2 1
|
| 1205 |
+
ATOM 247 N N3 . U A 1 8 ? 5.764 -15.883 7.450 1.00 0.00 ? 8 U A N3 1
|
| 1206 |
+
ATOM 248 C C4 . U A 1 8 ? 6.066 -14.941 6.485 1.00 0.00 ? 8 U A C4 1
|
| 1207 |
+
ATOM 249 O O4 . U A 1 8 ? 5.624 -13.798 6.580 1.00 0.00 ? 8 U A O4 1
|
| 1208 |
+
ATOM 250 C C5 . U A 1 8 ? 6.906 -15.425 5.412 1.00 0.00 ? 8 U A C5 1
|
| 1209 |
+
ATOM 251 C C6 . U A 1 8 ? 7.332 -16.714 5.407 1.00 0.00 ? 8 U A C6 1
|
| 1210 |
+
ATOM 252 H "H5'" . U A 1 8 ? 10.648 -19.045 4.164 1.00 0.00 ? 8 U A "H5'" 1
|
| 1211 |
+
ATOM 253 H "H5''" . U A 1 8 ? 10.138 -20.335 3.054 1.00 0.00 ? 8 U A "H5''" 1
|
| 1212 |
+
ATOM 254 H "H4'" . U A 1 8 ? 9.093 -20.953 5.049 1.00 0.00 ? 8 U A "H4'" 1
|
| 1213 |
+
ATOM 255 H "H3'" . U A 1 8 ? 7.121 -19.247 3.455 1.00 0.00 ? 8 U A "H3'" 1
|
| 1214 |
+
ATOM 256 H "H2'" . U A 1 8 ? 5.604 -19.353 5.284 1.00 0.00 ? 8 U A "H2'" 1
|
| 1215 |
+
ATOM 257 H "HO2'" . U A 1 8 ? 6.866 -21.165 6.884 1.00 0.00 ? 8 U A "HO2'" 1
|
| 1216 |
+
ATOM 258 H "H1'" . U A 1 8 ? 7.485 -19.411 7.371 1.00 0.00 ? 8 U A "H1'" 1
|
| 1217 |
+
ATOM 259 H H3 . U A 1 8 ? 5.177 -15.583 8.217 1.00 0.00 ? 8 U A H3 1
|
| 1218 |
+
ATOM 260 H H5 . U A 1 8 ? 7.198 -14.753 4.605 1.00 0.00 ? 8 U A H5 1
|
| 1219 |
+
ATOM 261 H H6 . U A 1 8 ? 7.960 -17.061 4.588 1.00 0.00 ? 8 U A H6 1
|
| 1220 |
+
ATOM 262 P P . C A 1 9 ? 5.625 -21.721 3.154 1.00 0.00 ? 9 C A P 1
|
| 1221 |
+
ATOM 263 O OP1 . C A 1 9 ? 5.692 -23.092 2.601 1.00 0.00 ? 9 C A OP1 1
|
| 1222 |
+
ATOM 264 O OP2 . C A 1 9 ? 5.136 -20.609 2.308 1.00 0.00 ? 9 C A OP2 1
|
| 1223 |
+
ATOM 265 O "O5'" . C A 1 9 ? 4.730 -21.764 4.495 1.00 0.00 ? 9 C A "O5'" 1
|
| 1224 |
+
ATOM 266 C "C5'" . C A 1 9 ? 4.609 -22.975 5.249 1.00 0.00 ? 9 C A "C5'" 1
|
| 1225 |
+
ATOM 267 C "C4'" . C A 1 9 ? 3.882 -22.753 6.577 1.00 0.00 ? 9 C A "C4'" 1
|
| 1226 |
+
ATOM 268 O "O4'" . C A 1 9 ? 4.234 -21.471 7.112 1.00 0.00 ? 9 C A "O4'" 1
|
| 1227 |
+
ATOM 269 C "C3'" . C A 1 9 ? 2.368 -22.698 6.479 1.00 0.00 ? 9 C A "C3'" 1
|
| 1228 |
+
ATOM 270 O "O3'" . C A 1 9 ? 1.883 -24.030 6.658 1.00 0.00 ? 9 C A "O3'" 1
|
| 1229 |
+
ATOM 271 C "C2'" . C A 1 9 ? 1.986 -21.906 7.718 1.00 0.00 ? 9 C A "C2'" 1
|
| 1230 |
+
ATOM 272 O "O2'" . C A 1 9 ? 2.014 -22.741 8.878 1.00 0.00 ? 9 C A "O2'" 1
|
| 1231 |
+
ATOM 273 C "C1'" . C A 1 9 ? 3.106 -20.867 7.775 1.00 0.00 ? 9 C A "C1'" 1
|
| 1232 |
+
ATOM 274 N N1 . C A 1 9 ? 2.749 -19.625 7.054 1.00 0.00 ? 9 C A N1 1
|
| 1233 |
+
ATOM 275 C C2 . C A 1 9 ? 2.126 -18.607 7.765 1.00 0.00 ? 9 C A C2 1
|
| 1234 |
+
ATOM 276 O O2 . C A 1 9 ? 1.895 -18.744 8.965 1.00 0.00 ? 9 C A O2 1
|
| 1235 |
+
ATOM 277 N N3 . C A 1 9 ? 1.784 -17.465 7.107 1.00 0.00 ? 9 C A N3 1
|
| 1236 |
+
ATOM 278 C C4 . C A 1 9 ? 2.043 -17.327 5.801 1.00 0.00 ? 9 C A C4 1
|
| 1237 |
+
ATOM 279 N N4 . C A 1 9 ? 1.685 -16.186 5.211 1.00 0.00 ? 9 C A N4 1
|
| 1238 |
+
ATOM 280 C C5 . C A 1 9 ? 2.684 -18.371 5.064 1.00 0.00 ? 9 C A C5 1
|
| 1239 |
+
ATOM 281 C C6 . C A 1 9 ? 3.017 -19.494 5.726 1.00 0.00 ? 9 C A C6 1
|
| 1240 |
+
ATOM 282 H "H5'" . C A 1 9 ? 5.608 -23.366 5.449 1.00 0.00 ? 9 C A "H5'" 1
|
| 1241 |
+
ATOM 283 H "H5''" . C A 1 9 ? 4.055 -23.705 4.659 1.00 0.00 ? 9 C A "H5''" 1
|
| 1242 |
+
ATOM 284 H "H4'" . C A 1 9 ? 4.188 -23.526 7.283 1.00 0.00 ? 9 C A "H4'" 1
|
| 1243 |
+
ATOM 285 H "H3'" . C A 1 9 ? 2.008 -22.254 5.551 1.00 0.00 ? 9 C A "H3'" 1
|
| 1244 |
+
ATOM 286 H "H2'" . C A 1 9 ? 1.013 -21.429 7.595 1.00 0.00 ? 9 C A "H2'" 1
|
| 1245 |
+
ATOM 287 H "HO2'" . C A 1 9 ? 2.936 -22.923 9.077 1.00 0.00 ? 9 C A "HO2'" 1
|
| 1246 |
+
ATOM 288 H "H1'" . C A 1 9 ? 3.376 -20.636 8.808 1.00 0.00 ? 9 C A "H1'" 1
|
| 1247 |
+
ATOM 289 H H41 . C A 1 9 ? 1.207 -15.471 5.742 1.00 0.00 ? 9 C A H41 1
|
| 1248 |
+
ATOM 290 H H42 . C A 1 9 ? 1.890 -16.037 4.234 1.00 0.00 ? 9 C A H42 1
|
| 1249 |
+
ATOM 291 H H5 . C A 1 9 ? 2.898 -18.271 3.999 1.00 0.00 ? 9 C A H5 1
|
| 1250 |
+
ATOM 292 H H6 . C A 1 9 ? 3.515 -20.306 5.198 1.00 0.00 ? 9 C A H6 1
|
| 1251 |
+
ATOM 293 P P . G A 1 10 ? 0.675 -24.586 5.750 1.00 0.00 ? 10 G A P 1
|
| 1252 |
+
ATOM 294 O OP1 . G A 1 10 ? 0.421 -25.995 6.128 1.00 0.00 ? 10 G A OP1 1
|
| 1253 |
+
ATOM 295 O OP2 . G A 1 10 ? 0.957 -24.240 4.339 1.00 0.00 ? 10 G A OP2 1
|
| 1254 |
+
ATOM 296 O "O5'" . G A 1 10 ? -0.574 -23.699 6.247 1.00 0.00 ? 10 G A "O5'" 1
|
| 1255 |
+
ATOM 297 C "C5'" . G A 1 10 ? -1.516 -24.236 7.178 1.00 0.00 ? 10 G A "C5'" 1
|
| 1256 |
+
ATOM 298 C "C4'" . G A 1 10 ? -2.687 -23.285 7.403 1.00 0.00 ? 10 G A "C4'" 1
|
| 1257 |
+
ATOM 299 O "O4'" . G A 1 10 ? -2.185 -21.995 7.755 1.00 0.00 ? 10 G A "O4'" 1
|
| 1258 |
+
ATOM 300 C "C3'" . G A 1 10 ? -3.542 -23.019 6.178 1.00 0.00 ? 10 G A "C3'" 1
|
| 1259 |
+
ATOM 301 O "O3'" . G A 1 10 ? -4.604 -23.979 6.188 1.00 0.00 ? 10 G A "O3'" 1
|
| 1260 |
+
ATOM 302 C "C2'" . G A 1 10 ? -4.164 -21.663 6.476 1.00 0.00 ? 10 G A "C2'" 1
|
| 1261 |
+
ATOM 303 O "O2'" . G A 1 10 ? -5.351 -21.819 7.259 1.00 0.00 ? 10 G A "O2'" 1
|
| 1262 |
+
ATOM 304 C "C1'" . G A 1 10 ? -3.072 -20.963 7.293 1.00 0.00 ? 10 G A "C1'" 1
|
| 1263 |
+
ATOM 305 N N9 . G A 1 10 ? -2.299 -20.001 6.484 1.00 0.00 ? 10 G A N9 1
|
| 1264 |
+
ATOM 306 C C8 . G A 1 10 ? -1.297 -20.249 5.580 1.00 0.00 ? 10 G A C8 1
|
| 1265 |
+
ATOM 307 N N7 . G A 1 10 ? -0.822 -19.175 5.016 1.00 0.00 ? 10 G A N7 1
|
| 1266 |
+
ATOM 308 C C5 . G A 1 10 ? -1.559 -18.142 5.584 1.00 0.00 ? 10 G A C5 1
|
| 1267 |
+
ATOM 309 C C6 . G A 1 10 ? -1.488 -16.739 5.359 1.00 0.00 ? 10 G A C6 1
|
| 1268 |
+
ATOM 310 O O6 . G A 1 10 ? -0.745 -16.126 4.595 1.00 0.00 ? 10 G A O6 1
|
| 1269 |
+
ATOM 311 N N1 . G A 1 10 ? -2.405 -16.050 6.136 1.00 0.00 ? 10 G A N1 1
|
| 1270 |
+
ATOM 312 C C2 . G A 1 10 ? -3.284 -16.631 7.021 1.00 0.00 ? 10 G A C2 1
|
| 1271 |
+
ATOM 313 N N2 . G A 1 10 ? -4.098 -15.813 7.689 1.00 0.00 ? 10 G A N2 1
|
| 1272 |
+
ATOM 314 N N3 . G A 1 10 ? -3.360 -17.946 7.241 1.00 0.00 ? 10 G A N3 1
|
| 1273 |
+
ATOM 315 C C4 . G A 1 10 ? -2.468 -18.637 6.488 1.00 0.00 ? 10 G A C4 1
|
| 1274 |
+
ATOM 316 H "H5'" . G A 1 10 ? -1.014 -24.413 8.129 1.00 0.00 ? 10 G A "H5'" 1
|
| 1275 |
+
ATOM 317 H "H5''" . G A 1 10 ? -1.896 -25.183 6.794 1.00 0.00 ? 10 G A "H5''" 1
|
| 1276 |
+
ATOM 318 H "H4'" . G A 1 10 ? -3.299 -23.665 8.222 1.00 0.00 ? 10 G A "H4'" 1
|
| 1277 |
+
ATOM 319 H "H3'" . G A 1 10 ? -2.980 -23.043 5.245 1.00 0.00 ? 10 G A "H3'" 1
|
| 1278 |
+
ATOM 320 H "H2'" . G A 1 10 ? -4.371 -21.119 5.554 1.00 0.00 ? 10 G A "H2'" 1
|
| 1279 |
+
ATOM 321 H "HO2'" . G A 1 10 ? -5.180 -21.423 8.116 1.00 0.00 ? 10 G A "HO2'" 1
|
| 1280 |
+
ATOM 322 H "H1'" . G A 1 10 ? -3.501 -20.446 8.151 1.00 0.00 ? 10 G A "H1'" 1
|
| 1281 |
+
ATOM 323 H H8 . G A 1 10 ? -0.932 -21.252 5.356 1.00 0.00 ? 10 G A H8 1
|
| 1282 |
+
ATOM 324 H H1 . G A 1 10 ? -2.426 -15.045 6.039 1.00 0.00 ? 10 G A H1 1
|
| 1283 |
+
ATOM 325 H H21 . G A 1 10 ? -4.055 -14.816 7.529 1.00 0.00 ? 10 G A H21 1
|
| 1284 |
+
ATOM 326 H H22 . G A 1 10 ? -4.757 -16.189 8.355 1.00 0.00 ? 10 G A H22 1
|
| 1285 |
+
ATOM 327 P P . A A 1 11 ? -5.008 -24.768 4.843 1.00 0.00 ? 11 A A P 1
|
| 1286 |
+
ATOM 328 O OP1 . A A 1 11 ? -5.669 -26.035 5.232 1.00 0.00 ? 11 A A OP1 1
|
| 1287 |
+
ATOM 329 O OP2 . A A 1 11 ? -3.829 -24.795 3.951 1.00 0.00 ? 11 A A OP2 1
|
| 1288 |
+
ATOM 330 O "O5'" . A A 1 11 ? -6.118 -23.803 4.184 1.00 0.00 ? 11 A A "O5'" 1
|
| 1289 |
+
ATOM 331 C "C5'" . A A 1 11 ? -6.262 -23.730 2.761 1.00 0.00 ? 11 A A "C5'" 1
|
| 1290 |
+
ATOM 332 C "C4'" . A A 1 11 ? -7.359 -22.750 2.352 1.00 0.00 ? 11 A A "C4'" 1
|
| 1291 |
+
ATOM 333 O "O4'" . A A 1 11 ? -8.545 -23.021 3.111 1.00 0.00 ? 11 A A "O4'" 1
|
| 1292 |
+
ATOM 334 C "C3'" . A A 1 11 ? -7.046 -21.291 2.641 1.00 0.00 ? 11 A A "C3'" 1
|
| 1293 |
+
ATOM 335 O "O3'" . A A 1 11 ? -6.517 -20.731 1.437 1.00 0.00 ? 11 A A "O3'" 1
|
| 1294 |
+
ATOM 336 C "C2'" . A A 1 11 ? -8.415 -20.670 2.856 1.00 0.00 ? 11 A A "C2'" 1
|
| 1295 |
+
ATOM 337 O "O2'" . A A 1 11 ? -9.023 -20.347 1.602 1.00 0.00 ? 11 A A "O2'" 1
|
| 1296 |
+
ATOM 338 C "C1'" . A A 1 11 ? -9.170 -21.802 3.547 1.00 0.00 ? 11 A A "C1'" 1
|
| 1297 |
+
ATOM 339 N N9 . A A 1 11 ? -9.071 -21.721 5.016 1.00 0.00 ? 11 A A N9 1
|
| 1298 |
+
ATOM 340 C C8 . A A 1 11 ? -8.110 -22.248 5.840 1.00 0.00 ? 11 A A C8 1
|
| 1299 |
+
ATOM 341 N N7 . A A 1 11 ? -8.308 -21.996 7.104 1.00 0.00 ? 11 A A N7 1
|
| 1300 |
+
ATOM 342 C C5 . A A 1 11 ? -9.482 -21.250 7.114 1.00 0.00 ? 11 A A C5 1
|
| 1301 |
+
ATOM 343 C C6 . A A 1 11 ? -10.232 -20.671 8.149 1.00 0.00 ? 11 A A C6 1
|
| 1302 |
+
ATOM 344 N N6 . A A 1 11 ? -9.901 -20.753 9.437 1.00 0.00 ? 11 A A N6 1
|
| 1303 |
+
ATOM 345 N N1 . A A 1 11 ? -11.345 -19.999 7.813 1.00 0.00 ? 11 A A N1 1
|
| 1304 |
+
ATOM 346 C C2 . A A 1 11 ? -11.684 -19.911 6.533 1.00 0.00 ? 11 A A C2 1
|
| 1305 |
+
ATOM 347 N N3 . A A 1 11 ? -11.068 -20.408 5.472 1.00 0.00 ? 11 A A N3 1
|
| 1306 |
+
ATOM 348 C C4 . A A 1 11 ? -9.956 -21.076 5.845 1.00 0.00 ? 11 A A C4 1
|
| 1307 |
+
ATOM 349 H "H5'" . A A 1 11 ? -6.509 -24.719 2.377 1.00 0.00 ? 11 A A "H5'" 1
|
| 1308 |
+
ATOM 350 H "H5''" . A A 1 11 ? -5.317 -23.405 2.325 1.00 0.00 ? 11 A A "H5''" 1
|
| 1309 |
+
ATOM 351 H "H4'" . A A 1 11 ? -7.579 -22.890 1.294 1.00 0.00 ? 11 A A "H4'" 1
|
| 1310 |
+
ATOM 352 H "H3'" . A A 1 11 ? -6.370 -21.152 3.484 1.00 0.00 ? 11 A A "H3'" 1
|
| 1311 |
+
ATOM 353 H "H2'" . A A 1 11 ? -8.350 -19.793 3.500 1.00 0.00 ? 11 A A "H2'" 1
|
| 1312 |
+
ATOM 354 H "HO2'" . A A 1 11 ? -8.609 -19.542 1.284 1.00 0.00 ? 11 A A "HO2'" 1
|
| 1313 |
+
ATOM 355 H "H1'" . A A 1 11 ? -10.220 -21.808 3.254 1.00 0.00 ? 11 A A "H1'" 1
|
| 1314 |
+
ATOM 356 H H8 . A A 1 11 ? -7.260 -22.823 5.472 1.00 0.00 ? 11 A A H8 1
|
| 1315 |
+
ATOM 357 H H61 . A A 1 11 ? -10.472 -20.298 10.135 1.00 0.00 ? 11 A A H61 1
|
| 1316 |
+
ATOM 358 H H62 . A A 1 11 ? -9.078 -21.269 9.716 1.00 0.00 ? 11 A A H62 1
|
| 1317 |
+
ATOM 359 H H2 . A A 1 11 ? -12.596 -19.351 6.326 1.00 0.00 ? 11 A A H2 1
|
| 1318 |
+
ATOM 360 P P . A A 1 12 ? -5.705 -19.343 1.475 1.00 0.00 ? 12 A A P 1
|
| 1319 |
+
ATOM 361 O OP1 . A A 1 12 ? -5.124 -19.111 0.134 1.00 0.00 ? 12 A A OP1 1
|
| 1320 |
+
ATOM 362 O OP2 . A A 1 12 ? -4.829 -19.353 2.668 1.00 0.00 ? 12 A A OP2 1
|
| 1321 |
+
ATOM 363 O "O5'" . A A 1 12 ? -6.872 -18.260 1.714 1.00 0.00 ? 12 A A "O5'" 1
|
| 1322 |
+
ATOM 364 C "C5'" . A A 1 12 ? -6.649 -17.126 2.556 1.00 0.00 ? 12 A A "C5'" 1
|
| 1323 |
+
ATOM 365 C "C4'" . A A 1 12 ? -7.963 -16.524 3.046 1.00 0.00 ? 12 A A "C4'" 1
|
| 1324 |
+
ATOM 366 O "O4'" . A A 1 12 ? -8.573 -17.417 3.968 1.00 0.00 ? 12 A A "O4'" 1
|
| 1325 |
+
ATOM 367 C "C3'" . A A 1 12 ? -7.820 -15.238 3.838 1.00 0.00 ? 12 A A "C3'" 1
|
| 1326 |
+
ATOM 368 O "O3'" . A A 1 12 ? -7.971 -14.159 2.910 1.00 0.00 ? 12 A A "O3'" 1
|
| 1327 |
+
ATOM 369 C "C2'" . A A 1 12 ? -9.051 -15.220 4.744 1.00 0.00 ? 12 A A "C2'" 1
|
| 1328 |
+
ATOM 370 O "O2'" . A A 1 12 ? -10.099 -14.456 4.141 1.00 0.00 ? 12 A A "O2'" 1
|
| 1329 |
+
ATOM 371 C "C1'" . A A 1 12 ? -9.456 -16.698 4.836 1.00 0.00 ? 12 A A "C1'" 1
|
| 1330 |
+
ATOM 372 N N9 . A A 1 12 ? -9.308 -17.230 6.202 1.00 0.00 ? 12 A A N9 1
|
| 1331 |
+
ATOM 373 C C8 . A A 1 12 ? -8.439 -18.186 6.662 1.00 0.00 ? 12 A A C8 1
|
| 1332 |
+
ATOM 374 N N7 . A A 1 12 ? -8.559 -18.432 7.937 1.00 0.00 ? 12 A A N7 1
|
| 1333 |
+
ATOM 375 C C5 . A A 1 12 ? -9.578 -17.579 8.346 1.00 0.00 ? 12 A A C5 1
|
| 1334 |
+
ATOM 376 C C6 . A A 1 12 ? -10.187 -17.351 9.591 1.00 0.00 ? 12 A A C6 1
|
| 1335 |
+
ATOM 377 N N6 . A A 1 12 ? -9.842 -17.990 10.708 1.00 0.00 ? 12 A A N6 1
|
| 1336 |
+
ATOM 378 N N1 . A A 1 12 ? -11.168 -16.436 9.648 1.00 0.00 ? 12 A A N1 1
|
| 1337 |
+
ATOM 379 C C2 . A A 1 12 ? -11.516 -15.793 8.541 1.00 0.00 ? 12 A A C2 1
|
| 1338 |
+
ATOM 380 N N3 . A A 1 12 ? -11.025 -15.915 7.317 1.00 0.00 ? 12 A A N3 1
|
| 1339 |
+
ATOM 381 C C4 . A A 1 12 ? -10.043 -16.841 7.296 1.00 0.00 ? 12 A A C4 1
|
| 1340 |
+
ATOM 382 H "H5'" . A A 1 12 ? -6.098 -16.370 1.997 1.00 0.00 ? 12 A A "H5'" 1
|
| 1341 |
+
ATOM 383 H "H5''" . A A 1 12 ? -6.056 -17.434 3.418 1.00 0.00 ? 12 A A "H5''" 1
|
| 1342 |
+
ATOM 384 H "H4'" . A A 1 12 ? -8.628 -16.381 2.194 1.00 0.00 ? 12 A A "H4'" 1
|
| 1343 |
+
ATOM 385 H "H3'" . A A 1 12 ? -6.881 -15.172 4.387 1.00 0.00 ? 12 A A "H3'" 1
|
| 1344 |
+
ATOM 386 H "H2'" . A A 1 12 ? -8.799 -14.827 5.729 1.00 0.00 ? 12 A A "H2'" 1
|
| 1345 |
+
ATOM 387 H "HO2'" . A A 1 12 ? -10.838 -14.451 4.754 1.00 0.00 ? 12 A A "HO2'" 1
|
| 1346 |
+
ATOM 388 H "H1'" . A A 1 12 ? -10.484 -16.841 4.503 1.00 0.00 ? 12 A A "H1'" 1
|
| 1347 |
+
ATOM 389 H H8 . A A 1 12 ? -7.717 -18.692 6.022 1.00 0.00 ? 12 A A H8 1
|
| 1348 |
+
ATOM 390 H H61 . A A 1 12 ? -10.295 -17.759 11.581 1.00 0.00 ? 12 A A H61 1
|
| 1349 |
+
ATOM 391 H H62 . A A 1 12 ? -9.128 -18.703 10.683 1.00 0.00 ? 12 A A H62 1
|
| 1350 |
+
ATOM 392 H H2 . A A 1 12 ? -12.317 -15.063 8.655 1.00 0.00 ? 12 A A H2 1
|
| 1351 |
+
ATOM 393 P P . A A 1 13 ? -6.841 -13.019 2.782 1.00 0.00 ? 13 A A P 1
|
| 1352 |
+
ATOM 394 O OP1 . A A 1 13 ? -6.988 -12.368 1.460 1.00 0.00 ? 13 A A OP1 1
|
| 1353 |
+
ATOM 395 O OP2 . A A 1 13 ? -5.542 -13.608 3.176 1.00 0.00 ? 13 A A OP2 1
|
| 1354 |
+
ATOM 396 O "O5'" . A A 1 13 ? -7.278 -11.961 3.916 1.00 0.00 ? 13 A A "O5'" 1
|
| 1355 |
+
ATOM 397 C "C5'" . A A 1 13 ? -6.506 -11.806 5.113 1.00 0.00 ? 13 A A "C5'" 1
|
| 1356 |
+
ATOM 398 C "C4'" . A A 1 13 ? -7.401 -11.686 6.341 1.00 0.00 ? 13 A A "C4'" 1
|
| 1357 |
+
ATOM 399 O "O4'" . A A 1 13 ? -7.967 -12.960 6.639 1.00 0.00 ? 13 A A "O4'" 1
|
| 1358 |
+
ATOM 400 C "C3'" . A A 1 13 ? -6.680 -11.307 7.618 1.00 0.00 ? 13 A A "C3'" 1
|
| 1359 |
+
ATOM 401 O "O3'" . A A 1 13 ? -6.726 -9.882 7.715 1.00 0.00 ? 13 A A "O3'" 1
|
| 1360 |
+
ATOM 402 C "C2'" . A A 1 13 ? -7.583 -11.859 8.715 1.00 0.00 ? 13 A A "C2'" 1
|
| 1361 |
+
ATOM 403 O "O2'" . A A 1 13 ? -8.572 -10.893 9.080 1.00 0.00 ? 13 A A "O2'" 1
|
| 1362 |
+
ATOM 404 C "C1'" . A A 1 13 ? -8.241 -13.070 8.044 1.00 0.00 ? 13 A A "C1'" 1
|
| 1363 |
+
ATOM 405 N N9 . A A 1 13 ? -7.687 -14.347 8.533 1.00 0.00 ? 13 A A N9 1
|
| 1364 |
+
ATOM 406 C C8 . A A 1 13 ? -6.865 -15.231 7.881 1.00 0.00 ? 13 A A C8 1
|
| 1365 |
+
ATOM 407 N N7 . A A 1 13 ? -6.555 -16.279 8.594 1.00 0.00 ? 13 A A N7 1
|
| 1366 |
+
ATOM 408 C C5 . A A 1 13 ? -7.219 -16.071 9.798 1.00 0.00 ? 13 A A C5 1
|
| 1367 |
+
ATOM 409 C C6 . A A 1 13 ? -7.298 -16.820 10.982 1.00 0.00 ? 13 A A C6 1
|
| 1368 |
+
ATOM 410 N N6 . A A 1 13 ? -6.680 -17.988 11.158 1.00 0.00 ? 13 A A N6 1
|
| 1369 |
+
ATOM 411 N N1 . A A 1 13 ? -8.043 -16.327 11.985 1.00 0.00 ? 13 A A N1 1
|
| 1370 |
+
ATOM 412 C C2 . A A 1 13 ? -8.664 -15.166 11.817 1.00 0.00 ? 13 A A C2 1
|
| 1371 |
+
ATOM 413 N N3 . A A 1 13 ? -8.669 -14.370 10.759 1.00 0.00 ? 13 A A N3 1
|
| 1372 |
+
ATOM 414 C C4 . A A 1 13 ? -7.912 -14.895 9.772 1.00 0.00 ? 13 A A C4 1
|
| 1373 |
+
ATOM 415 H "H5'" . A A 1 13 ? -5.896 -10.906 5.028 1.00 0.00 ? 13 A A "H5'" 1
|
| 1374 |
+
ATOM 416 H "H5''" . A A 1 13 ? -5.852 -12.670 5.234 1.00 0.00 ? 13 A A "H5''" 1
|
| 1375 |
+
ATOM 417 H "H4'" . A A 1 13 ? -8.204 -10.980 6.128 1.00 0.00 ? 13 A A "H4'" 1
|
| 1376 |
+
ATOM 418 H "H3'" . A A 1 13 ? -5.659 -11.684 7.667 1.00 0.00 ? 13 A A "H3'" 1
|
| 1377 |
+
ATOM 419 H "H2'" . A A 1 13 ? -6.997 -12.167 9.581 1.00 0.00 ? 13 A A "H2'" 1
|
| 1378 |
+
ATOM 420 H "HO2'" . A A 1 13 ? -8.398 -10.100 8.568 1.00 0.00 ? 13 A A "HO2'" 1
|
| 1379 |
+
ATOM 421 H "H1'" . A A 1 13 ? -9.319 -13.062 8.202 1.00 0.00 ? 13 A A "H1'" 1
|
| 1380 |
+
ATOM 422 H H8 . A A 1 13 ? -6.505 -15.072 6.865 1.00 0.00 ? 13 A A H8 1
|
| 1381 |
+
ATOM 423 H H61 . A A 1 13 ? -6.789 -18.491 12.028 1.00 0.00 ? 13 A A H61 1
|
| 1382 |
+
ATOM 424 H H62 . A A 1 13 ? -6.104 -18.371 10.423 1.00 0.00 ? 13 A A H62 1
|
| 1383 |
+
ATOM 425 H H2 . A A 1 13 ? -9.251 -14.821 12.668 1.00 0.00 ? 13 A A H2 1
|
| 1384 |
+
ATOM 426 P P . G A 1 14 ? -5.579 -9.077 8.505 1.00 0.00 ? 14 G A P 1
|
| 1385 |
+
ATOM 427 O OP1 . G A 1 14 ? -6.229 -8.011 9.300 1.00 0.00 ? 14 G A OP1 1
|
| 1386 |
+
ATOM 428 O OP2 . G A 1 14 ? -4.508 -8.733 7.543 1.00 0.00 ? 14 G A OP2 1
|
| 1387 |
+
ATOM 429 O "O5'" . G A 1 14 ? -5.007 -10.186 9.523 1.00 0.00 ? 14 G A "O5'" 1
|
| 1388 |
+
ATOM 430 C "C5'" . G A 1 14 ? -5.418 -10.192 10.892 1.00 0.00 ? 14 G A "C5'" 1
|
| 1389 |
+
ATOM 431 C "C4'" . G A 1 14 ? -4.747 -11.316 11.675 1.00 0.00 ? 14 G A "C4'" 1
|
| 1390 |
+
ATOM 432 O "O4'" . G A 1 14 ? -4.663 -12.483 10.851 1.00 0.00 ? 14 G A "O4'" 1
|
| 1391 |
+
ATOM 433 C "C3'" . G A 1 14 ? -3.310 -11.042 12.077 1.00 0.00 ? 14 G A "C3'" 1
|
| 1392 |
+
ATOM 434 O "O3'" . G A 1 14 ? -3.341 -10.471 13.387 1.00 0.00 ? 14 G A "O3'" 1
|
| 1393 |
+
ATOM 435 C "C2'" . G A 1 14 ? -2.722 -12.436 12.208 1.00 0.00 ? 14 G A "C2'" 1
|
| 1394 |
+
ATOM 436 O "O2'" . G A 1 14 ? -3.066 -13.009 13.472 1.00 0.00 ? 14 G A "O2'" 1
|
| 1395 |
+
ATOM 437 C "C1'" . G A 1 14 ? -3.425 -13.180 11.074 1.00 0.00 ? 14 G A "C1'" 1
|
| 1396 |
+
ATOM 438 N N9 . G A 1 14 ? -2.643 -13.167 9.823 1.00 0.00 ? 14 G A N9 1
|
| 1397 |
+
ATOM 439 C C8 . G A 1 14 ? -2.753 -12.316 8.754 1.00 0.00 ? 14 G A C8 1
|
| 1398 |
+
ATOM 440 N N7 . G A 1 14 ? -1.919 -12.579 7.786 1.00 0.00 ? 14 G A N7 1
|
| 1399 |
+
ATOM 441 C C5 . G A 1 14 ? -1.206 -13.681 8.247 1.00 0.00 ? 14 G A C5 1
|
| 1400 |
+
ATOM 442 C C6 . G A 1 14 ? -0.159 -14.415 7.625 1.00 0.00 ? 14 G A C6 1
|
| 1401 |
+
ATOM 443 O O6 . G A 1 14 ? 0.349 -14.230 6.521 1.00 0.00 ? 14 G A O6 1
|
| 1402 |
+
ATOM 444 N N1 . G A 1 14 ? 0.285 -15.453 8.429 1.00 0.00 ? 14 G A N1 1
|
| 1403 |
+
ATOM 445 C C2 . G A 1 14 ? -0.212 -15.753 9.677 1.00 0.00 ? 14 G A C2 1
|
| 1404 |
+
ATOM 446 N N2 . G A 1 14 ? 0.336 -16.788 10.315 1.00 0.00 ? 14 G A N2 1
|
| 1405 |
+
ATOM 447 N N3 . G A 1 14 ? -1.195 -15.071 10.270 1.00 0.00 ? 14 G A N3 1
|
| 1406 |
+
ATOM 448 C C4 . G A 1 14 ? -1.642 -14.051 9.497 1.00 0.00 ? 14 G A C4 1
|
| 1407 |
+
ATOM 449 H "H5'" . G A 1 14 ? -6.500 -10.320 10.938 1.00 0.00 ? 14 G A "H5'" 1
|
| 1408 |
+
ATOM 450 H "H5''" . G A 1 14 ? -5.154 -9.236 11.347 1.00 0.00 ? 14 G A "H5''" 1
|
| 1409 |
+
ATOM 451 H "H4'" . G A 1 14 ? -5.351 -11.547 12.554 1.00 0.00 ? 14 G A "H4'" 1
|
| 1410 |
+
ATOM 452 H "H3'" . G A 1 14 ? -2.775 -10.410 11.369 1.00 0.00 ? 14 G A "H3'" 1
|
| 1411 |
+
ATOM 453 H "H2'" . G A 1 14 ? -1.642 -12.422 12.060 1.00 0.00 ? 14 G A "H2'" 1
|
| 1412 |
+
ATOM 454 H "HO2'" . G A 1 14 ? -3.266 -13.935 13.321 1.00 0.00 ? 14 G A "HO2'" 1
|
| 1413 |
+
ATOM 455 H "H1'" . G A 1 14 ? -3.637 -14.211 11.356 1.00 0.00 ? 14 G A "H1'" 1
|
| 1414 |
+
ATOM 456 H H8 . G A 1 14 ? -3.470 -11.496 8.716 1.00 0.00 ? 14 G A H8 1
|
| 1415 |
+
ATOM 457 H H1 . G A 1 14 ? 1.028 -16.030 8.064 1.00 0.00 ? 14 G A H1 1
|
| 1416 |
+
ATOM 458 H H21 . G A 1 14 ? 1.115 -17.281 9.902 1.00 0.00 ? 14 G A H21 1
|
| 1417 |
+
ATOM 459 H H22 . G A 1 14 ? -0.027 -17.078 11.211 1.00 0.00 ? 14 G A H22 1
|
| 1418 |
+
ATOM 460 P P . A A 1 15 ? -2.021 -9.803 14.017 1.00 0.00 ? 15 A A P 1
|
| 1419 |
+
ATOM 461 O OP1 . A A 1 15 ? -2.383 -9.203 15.321 1.00 0.00 ? 15 A A OP1 1
|
| 1420 |
+
ATOM 462 O OP2 . A A 1 15 ? -1.379 -8.971 12.974 1.00 0.00 ? 15 A A OP2 1
|
| 1421 |
+
ATOM 463 O "O5'" . A A 1 15 ? -1.082 -11.081 14.294 1.00 0.00 ? 15 A A "O5'" 1
|
| 1422 |
+
ATOM 464 C "C5'" . A A 1 15 ? -1.444 -12.041 15.288 1.00 0.00 ? 15 A A "C5'" 1
|
| 1423 |
+
ATOM 465 C "C4'" . A A 1 15 ? -0.573 -13.290 15.209 1.00 0.00 ? 15 A A "C4'" 1
|
| 1424 |
+
ATOM 466 O "O4'" . A A 1 15 ? -0.575 -13.797 13.870 1.00 0.00 ? 15 A A "O4'" 1
|
| 1425 |
+
ATOM 467 C "C3'" . A A 1 15 ? 0.896 -13.062 15.485 1.00 0.00 ? 15 A A "C3'" 1
|
| 1426 |
+
ATOM 468 O "O3'" . A A 1 15 ? 1.101 -13.162 16.899 1.00 0.00 ? 15 A A "O3'" 1
|
| 1427 |
+
ATOM 469 C "C2'" . A A 1 15 ? 1.533 -14.282 14.839 1.00 0.00 ? 15 A A "C2'" 1
|
| 1428 |
+
ATOM 470 O "O2'" . A A 1 15 ? 1.410 -15.423 15.691 1.00 0.00 ? 15 A A "O2'" 1
|
| 1429 |
+
ATOM 471 C "C1'" . A A 1 15 ? 0.677 -14.452 13.584 1.00 0.00 ? 15 A A "C1'" 1
|
| 1430 |
+
ATOM 472 N N9 . A A 1 15 ? 1.294 -13.820 12.399 1.00 0.00 ? 15 A A N9 1
|
| 1431 |
+
ATOM 473 C C8 . A A 1 15 ? 1.167 -12.529 11.948 1.00 0.00 ? 15 A A C8 1
|
| 1432 |
+
ATOM 474 N N7 . A A 1 15 ? 1.839 -12.289 10.855 1.00 0.00 ? 15 A A N7 1
|
| 1433 |
+
ATOM 475 C C5 . A A 1 15 ? 2.453 -13.502 10.567 1.00 0.00 ? 15 A A C5 1
|
| 1434 |
+
ATOM 476 C C6 . A A 1 15 ? 3.308 -13.912 9.532 1.00 0.00 ? 15 A A C6 1
|
| 1435 |
+
ATOM 477 N N6 . A A 1 15 ? 3.707 -13.114 8.543 1.00 0.00 ? 15 A A N6 1
|
| 1436 |
+
ATOM 478 N N1 . A A 1 15 ? 3.737 -15.183 9.543 1.00 0.00 ? 15 A A N1 1
|
| 1437 |
+
ATOM 479 C C2 . A A 1 15 ? 3.341 -15.989 10.518 1.00 0.00 ? 15 A A C2 1
|
| 1438 |
+
ATOM 480 N N3 . A A 1 15 ? 2.541 -15.729 11.543 1.00 0.00 ? 15 A A N3 1
|
| 1439 |
+
ATOM 481 C C4 . A A 1 15 ? 2.129 -14.444 11.501 1.00 0.00 ? 15 A A C4 1
|
| 1440 |
+
ATOM 482 H "H5'" . A A 1 15 ? -2.487 -12.326 15.145 1.00 0.00 ? 15 A A "H5'" 1
|
| 1441 |
+
ATOM 483 H "H5''" . A A 1 15 ? -1.330 -11.592 16.275 1.00 0.00 ? 15 A A "H5''" 1
|
| 1442 |
+
ATOM 484 H "H4'" . A A 1 15 ? -0.978 -14.049 15.878 1.00 0.00 ? 15 A A "H4'" 1
|
| 1443 |
+
ATOM 485 H "H3'" . A A 1 15 ? 1.269 -12.118 15.086 1.00 0.00 ? 15 A A "H3'" 1
|
| 1444 |
+
ATOM 486 H "H2'" . A A 1 15 ? 2.575 -14.091 14.582 1.00 0.00 ? 15 A A "H2'" 1
|
| 1445 |
+
ATOM 487 H "HO2'" . A A 1 15 ? 2.265 -15.566 16.104 1.00 0.00 ? 15 A A "HO2'" 1
|
| 1446 |
+
ATOM 488 H "H1'" . A A 1 15 ? 0.494 -15.506 13.376 1.00 0.00 ? 15 A A "H1'" 1
|
| 1447 |
+
ATOM 489 H H8 . A A 1 15 ? 0.575 -11.772 12.461 1.00 0.00 ? 15 A A H8 1
|
| 1448 |
+
ATOM 490 H H61 . A A 1 15 ? 4.349 -13.459 7.843 1.00 0.00 ? 15 A A H61 1
|
| 1449 |
+
ATOM 491 H H62 . A A 1 15 ? 3.367 -12.164 8.492 1.00 0.00 ? 15 A A H62 1
|
| 1450 |
+
ATOM 492 H H2 . A A 1 15 ? 3.734 -17.003 10.474 1.00 0.00 ? 15 A A H2 1
|
| 1451 |
+
ATOM 493 P P . U A 1 16 ? 2.559 -12.865 17.515 1.00 0.00 ? 16 U A P 1
|
| 1452 |
+
ATOM 494 O OP1 . U A 1 16 ? 2.813 -13.831 18.607 1.00 0.00 ? 16 U A OP1 1
|
| 1453 |
+
ATOM 495 O OP2 . U A 1 16 ? 2.671 -11.411 17.769 1.00 0.00 ? 16 U A OP2 1
|
| 1454 |
+
ATOM 496 O "O5'" . U A 1 16 ? 3.509 -13.239 16.274 1.00 0.00 ? 16 U A "O5'" 1
|
| 1455 |
+
ATOM 497 C "C5'" . U A 1 16 ? 4.924 -13.327 16.407 1.00 0.00 ? 16 U A "C5'" 1
|
| 1456 |
+
ATOM 498 C "C4'" . U A 1 16 ? 5.482 -14.381 15.455 1.00 0.00 ? 16 U A "C4'" 1
|
| 1457 |
+
ATOM 499 O "O4'" . U A 1 16 ? 4.772 -14.312 14.218 1.00 0.00 ? 16 U A "O4'" 1
|
| 1458 |
+
ATOM 500 C "C3'" . U A 1 16 ? 6.941 -14.201 15.080 1.00 0.00 ? 16 U A "C3'" 1
|
| 1459 |
+
ATOM 501 O "O3'" . U A 1 16 ? 7.689 -15.055 15.949 1.00 0.00 ? 16 U A "O3'" 1
|
| 1460 |
+
ATOM 502 C "C2'" . U A 1 16 ? 7.036 -14.800 13.680 1.00 0.00 ? 16 U A "C2'" 1
|
| 1461 |
+
ATOM 503 O "O2'" . U A 1 16 ? 7.304 -16.202 13.754 1.00 0.00 ? 16 U A "O2'" 1
|
| 1462 |
+
ATOM 504 C "C1'" . U A 1 16 ? 5.641 -14.555 13.101 1.00 0.00 ? 16 U A "C1'" 1
|
| 1463 |
+
ATOM 505 N N1 . U A 1 16 ? 5.598 -13.381 12.202 1.00 0.00 ? 16 U A N1 1
|
| 1464 |
+
ATOM 506 C C2 . U A 1 16 ? 6.231 -13.490 10.978 1.00 0.00 ? 16 U A C2 1
|
| 1465 |
+
ATOM 507 O O2 . U A 1 16 ? 6.838 -14.503 10.635 1.00 0.00 ? 16 U A O2 1
|
| 1466 |
+
ATOM 508 N N3 . U A 1 16 ? 6.147 -12.385 10.153 1.00 0.00 ? 16 U A N3 1
|
| 1467 |
+
ATOM 509 C C4 . U A 1 16 ? 5.494 -11.200 10.441 1.00 0.00 ? 16 U A C4 1
|
| 1468 |
+
ATOM 510 O O4 . U A 1 16 ? 5.489 -10.285 9.621 1.00 0.00 ? 16 U A O4 1
|
| 1469 |
+
ATOM 511 C C5 . U A 1 16 ? 4.859 -11.163 11.739 1.00 0.00 ? 16 U A C5 1
|
| 1470 |
+
ATOM 512 C C6 . U A 1 16 ? 4.932 -12.237 12.563 1.00 0.00 ? 16 U A C6 1
|
| 1471 |
+
ATOM 513 H "H5'" . U A 1 16 ? 5.173 -13.600 17.432 1.00 0.00 ? 16 U A "H5'" 1
|
| 1472 |
+
ATOM 514 H "H5''" . U A 1 16 ? 5.366 -12.359 16.174 1.00 0.00 ? 16 U A "H5''" 1
|
| 1473 |
+
ATOM 515 H "H4'" . U A 1 16 ? 5.324 -15.365 15.895 1.00 0.00 ? 16 U A "H4'" 1
|
| 1474 |
+
ATOM 516 H "H3'" . U A 1 16 ? 7.282 -13.167 15.133 1.00 0.00 ? 16 U A "H3'" 1
|
| 1475 |
+
ATOM 517 H "H2'" . U A 1 16 ? 7.792 -14.287 13.087 1.00 0.00 ? 16 U A "H2'" 1
|
| 1476 |
+
ATOM 518 H "HO2'" . U A 1 16 ? 8.100 -16.368 13.242 1.00 0.00 ? 16 U A "HO2'" 1
|
| 1477 |
+
ATOM 519 H "H1'" . U A 1 16 ? 5.287 -15.432 12.556 1.00 0.00 ? 16 U A "H1'" 1
|
| 1478 |
+
ATOM 520 H H3 . U A 1 16 ? 6.602 -12.450 9.254 1.00 0.00 ? 16 U A H3 1
|
| 1479 |
+
ATOM 521 H H5 . U A 1 16 ? 4.309 -10.275 12.052 1.00 0.00 ? 16 U A H5 1
|
| 1480 |
+
ATOM 522 H H6 . U A 1 16 ? 4.458 -12.189 13.542 1.00 0.00 ? 16 U A H6 1
|
| 1481 |
+
ATOM 523 P P . G A 1 17 ? 8.416 -14.470 17.261 1.00 0.00 ? 17 G A P 1
|
| 1482 |
+
ATOM 524 O OP1 . G A 1 17 ? 7.795 -15.089 18.454 1.00 0.00 ? 17 G A OP1 1
|
| 1483 |
+
ATOM 525 O OP2 . G A 1 17 ? 8.480 -12.996 17.140 1.00 0.00 ? 17 G A OP2 1
|
| 1484 |
+
ATOM 526 O "O5'" . G A 1 17 ? 9.907 -15.058 17.103 1.00 0.00 ? 17 G A "O5'" 1
|
| 1485 |
+
ATOM 527 C "C5'" . G A 1 17 ? 10.156 -16.455 17.283 1.00 0.00 ? 17 G A "C5'" 1
|
| 1486 |
+
ATOM 528 C "C4'" . G A 1 17 ? 11.302 -16.944 16.401 1.00 0.00 ? 17 G A "C4'" 1
|
| 1487 |
+
ATOM 529 O "O4'" . G A 1 17 ? 10.825 -17.110 15.058 1.00 0.00 ? 17 G A "O4'" 1
|
| 1488 |
+
ATOM 530 C "C3'" . G A 1 17 ? 12.470 -15.978 16.274 1.00 0.00 ? 17 G A "C3'" 1
|
| 1489 |
+
ATOM 531 O "O3'" . G A 1 17 ? 13.451 -16.375 17.235 1.00 0.00 ? 17 G A "O3'" 1
|
| 1490 |
+
ATOM 532 C "C2'" . G A 1 17 ? 13.035 -16.298 14.900 1.00 0.00 ? 17 G A "C2'" 1
|
| 1491 |
+
ATOM 533 O "O2'" . G A 1 17 ? 13.865 -17.460 14.956 1.00 0.00 ? 17 G A "O2'" 1
|
| 1492 |
+
ATOM 534 C "C1'" . G A 1 17 ? 11.765 -16.582 14.107 1.00 0.00 ? 17 G A "C1'" 1
|
| 1493 |
+
ATOM 535 N N9 . G A 1 17 ? 11.194 -15.363 13.504 1.00 0.00 ? 17 G A N9 1
|
| 1494 |
+
ATOM 536 C C8 . G A 1 17 ? 10.242 -14.523 14.017 1.00 0.00 ? 17 G A C8 1
|
| 1495 |
+
ATOM 537 N N7 . G A 1 17 ? 9.946 -13.523 13.237 1.00 0.00 ? 17 G A N7 1
|
| 1496 |
+
ATOM 538 C C5 . G A 1 17 ? 10.757 -13.713 12.126 1.00 0.00 ? 17 G A C5 1
|
| 1497 |
+
ATOM 539 C C6 . G A 1 17 ? 10.872 -12.937 10.942 1.00 0.00 ? 17 G A C6 1
|
| 1498 |
+
ATOM 540 O O6 . G A 1 17 ? 10.266 -11.911 10.642 1.00 0.00 ? 17 G A O6 1
|
| 1499 |
+
ATOM 541 N N1 . G A 1 17 ? 11.805 -13.473 10.071 1.00 0.00 ? 17 G A N1 1
|
| 1500 |
+
ATOM 542 C C2 . G A 1 17 ? 12.539 -14.613 10.302 1.00 0.00 ? 17 G A C2 1
|
| 1501 |
+
ATOM 543 N N2 . G A 1 17 ? 13.395 -14.983 9.350 1.00 0.00 ? 17 G A N2 1
|
| 1502 |
+
ATOM 544 N N3 . G A 1 17 ? 12.439 -15.351 11.412 1.00 0.00 ? 17 G A N3 1
|
| 1503 |
+
ATOM 545 C C4 . G A 1 17 ? 11.529 -14.840 12.277 1.00 0.00 ? 17 G A C4 1
|
| 1504 |
+
ATOM 546 H "H5'" . G A 1 17 ? 9.253 -17.013 17.032 1.00 0.00 ? 17 G A "H5'" 1
|
| 1505 |
+
ATOM 547 H "H5''" . G A 1 17 ? 10.409 -16.639 18.327 1.00 0.00 ? 17 G A "H5''" 1
|
| 1506 |
+
ATOM 548 H "H4'" . G A 1 17 ? 11.645 -17.908 16.775 1.00 0.00 ? 17 G A "H4'" 1
|
| 1507 |
+
ATOM 549 H "H3'" . G A 1 17 ? 12.183 -14.932 16.392 1.00 0.00 ? 17 G A "H3'" 1
|
| 1508 |
+
ATOM 550 H "H2'" . G A 1 17 ? 13.574 -15.446 14.487 1.00 0.00 ? 17 G A "H2'" 1
|
| 1509 |
+
ATOM 551 H "HO2'" . G A 1 17 ? 14.691 -17.243 14.518 1.00 0.00 ? 17 G A "HO2'" 1
|
| 1510 |
+
ATOM 552 H "H1'" . G A 1 17 ? 11.947 -17.322 13.327 1.00 0.00 ? 17 G A "H1'" 1
|
| 1511 |
+
ATOM 553 H H8 . G A 1 17 ? 9.770 -14.680 14.983 1.00 0.00 ? 17 G A H8 1
|
| 1512 |
+
ATOM 554 H H1 . G A 1 17 ? 11.951 -12.985 9.199 1.00 0.00 ? 17 G A H1 1
|
| 1513 |
+
ATOM 555 H H21 . G A 1 17 ? 13.435 -14.471 8.481 1.00 0.00 ? 17 G A H21 1
|
| 1514 |
+
ATOM 556 H H22 . G A 1 17 ? 14.003 -15.776 9.498 1.00 0.00 ? 17 G A H22 1
|
| 1515 |
+
ATOM 557 P P . G A 1 18 ? 14.527 -15.313 17.790 1.00 0.00 ? 18 G A P 1
|
| 1516 |
+
ATOM 558 O OP1 . G A 1 18 ? 15.184 -15.898 18.981 1.00 0.00 ? 18 G A OP1 1
|
| 1517 |
+
ATOM 559 O OP2 . G A 1 18 ? 13.867 -13.992 17.885 1.00 0.00 ? 18 G A OP2 1
|
| 1518 |
+
ATOM 560 O "O5'" . G A 1 18 ? 15.608 -15.252 16.598 1.00 0.00 ? 18 G A "O5'" 1
|
| 1519 |
+
ATOM 561 C "C5'" . G A 1 18 ? 16.069 -13.994 16.098 1.00 0.00 ? 18 G A "C5'" 1
|
| 1520 |
+
ATOM 562 C "C4'" . G A 1 18 ? 16.765 -14.150 14.751 1.00 0.00 ? 18 G A "C4'" 1
|
| 1521 |
+
ATOM 563 O "O4'" . G A 1 18 ? 15.792 -14.502 13.757 1.00 0.00 ? 18 G A "O4'" 1
|
| 1522 |
+
ATOM 564 C "C3'" . G A 1 18 ? 17.411 -12.882 14.213 1.00 0.00 ? 18 G A "C3'" 1
|
| 1523 |
+
ATOM 565 O "O3'" . G A 1 18 ? 18.787 -12.904 14.604 1.00 0.00 ? 18 G A "O3'" 1
|
| 1524 |
+
ATOM 566 C "C2'" . G A 1 18 ? 17.369 -13.092 12.710 1.00 0.00 ? 18 G A "C2'" 1
|
| 1525 |
+
ATOM 567 O "O2'" . G A 1 18 ? 18.425 -13.961 12.293 1.00 0.00 ? 18 G A "O2'" 1
|
| 1526 |
+
ATOM 568 C "C1'" . G A 1 18 ? 16.015 -13.770 12.539 1.00 0.00 ? 18 G A "C1'" 1
|
| 1527 |
+
ATOM 569 N N9 . G A 1 18 ? 14.923 -12.794 12.364 1.00 0.00 ? 18 G A N9 1
|
| 1528 |
+
ATOM 570 C C8 . G A 1 18 ? 13.889 -12.503 13.217 1.00 0.00 ? 18 G A C8 1
|
| 1529 |
+
ATOM 571 N N7 . G A 1 18 ? 13.089 -11.575 12.773 1.00 0.00 ? 18 G A N7 1
|
| 1530 |
+
ATOM 572 C C5 . G A 1 18 ? 13.629 -11.226 11.541 1.00 0.00 ? 18 G A C5 1
|
| 1531 |
+
ATOM 573 C C6 . G A 1 18 ? 13.187 -10.264 10.592 1.00 0.00 ? 18 G A C6 1
|
| 1532 |
+
ATOM 574 O O6 . G A 1 18 ? 12.209 -9.524 10.658 1.00 0.00 ? 18 G A O6 1
|
| 1533 |
+
ATOM 575 N N1 . G A 1 18 ? 14.015 -10.224 9.481 1.00 0.00 ? 18 G A N1 1
|
| 1534 |
+
ATOM 576 C C2 . G A 1 18 ? 15.130 -11.010 9.298 1.00 0.00 ? 18 G A C2 1
|
| 1535 |
+
ATOM 577 N N2 . G A 1 18 ? 15.802 -10.847 8.158 1.00 0.00 ? 18 G A N2 1
|
| 1536 |
+
ATOM 578 N N3 . G A 1 18 ? 15.555 -11.916 10.183 1.00 0.00 ? 18 G A N3 1
|
| 1537 |
+
ATOM 579 C C4 . G A 1 18 ? 14.756 -11.968 11.278 1.00 0.00 ? 18 G A C4 1
|
| 1538 |
+
ATOM 580 H "H5'" . G A 1 18 ? 16.769 -13.562 16.813 1.00 0.00 ? 18 G A "H5'" 1
|
| 1539 |
+
ATOM 581 H "H5''" . G A 1 18 ? 15.217 -13.323 15.984 1.00 0.00 ? 18 G A "H5''" 1
|
| 1540 |
+
ATOM 582 H "H4'" . G A 1 18 ? 17.500 -14.952 14.825 1.00 0.00 ? 18 G A "H4'" 1
|
| 1541 |
+
ATOM 583 H "H3'" . G A 1 18 ? 16.911 -11.970 14.537 1.00 0.00 ? 18 G A "H3'" 1
|
| 1542 |
+
ATOM 584 H "H2'" . G A 1 18 ? 17.402 -12.143 12.179 1.00 0.00 ? 18 G A "H2'" 1
|
| 1543 |
+
ATOM 585 H "HO2'" . G A 1 18 ? 18.078 -14.855 12.299 1.00 0.00 ? 18 G A "HO2'" 1
|
| 1544 |
+
ATOM 586 H "H1'" . G A 1 18 ? 16.024 -14.460 11.696 1.00 0.00 ? 18 G A "H1'" 1
|
| 1545 |
+
ATOM 587 H H8 . G A 1 18 ? 13.750 -12.999 14.177 1.00 0.00 ? 18 G A H8 1
|
| 1546 |
+
ATOM 588 H H1 . G A 1 18 ? 13.784 -9.556 8.760 1.00 0.00 ? 18 G A H1 1
|
| 1547 |
+
ATOM 589 H H21 . G A 1 18 ? 15.476 -10.184 7.470 1.00 0.00 ? 18 G A H21 1
|
| 1548 |
+
ATOM 590 H H22 . G A 1 18 ? 16.635 -11.389 7.982 1.00 0.00 ? 18 G A H22 1
|
| 1549 |
+
ATOM 591 P P . C A 1 19 ? 19.654 -11.546 14.614 1.00 0.00 ? 19 C A P 1
|
| 1550 |
+
ATOM 592 O OP1 . C A 1 19 ? 21.024 -11.875 15.064 1.00 0.00 ? 19 C A OP1 1
|
| 1551 |
+
ATOM 593 O OP2 . C A 1 19 ? 18.875 -10.505 15.322 1.00 0.00 ? 19 C A OP2 1
|
| 1552 |
+
ATOM 594 O "O5'" . C A 1 19 ? 19.716 -11.154 13.053 1.00 0.00 ? 19 C A "O5'" 1
|
| 1553 |
+
ATOM 595 C "C5'" . C A 1 19 ? 20.458 -11.962 12.136 1.00 0.00 ? 19 C A "C5'" 1
|
| 1554 |
+
ATOM 596 C "C4'" . C A 1 19 ? 20.676 -11.253 10.802 1.00 0.00 ? 19 C A "C4'" 1
|
| 1555 |
+
ATOM 597 O "O4'" . C A 1 19 ? 19.416 -11.076 10.140 1.00 0.00 ? 19 C A "O4'" 1
|
| 1556 |
+
ATOM 598 C "C3'" . C A 1 19 ? 21.217 -9.841 10.901 1.00 0.00 ? 19 C A "C3'" 1
|
| 1557 |
+
ATOM 599 O "O3'" . C A 1 19 ? 22.643 -9.913 10.923 1.00 0.00 ? 19 C A "O3'" 1
|
| 1558 |
+
ATOM 600 C "C2'" . C A 1 19 ? 20.811 -9.256 9.562 1.00 0.00 ? 19 C A "C2'" 1
|
| 1559 |
+
ATOM 601 O "O2'" . C A 1 19 ? 21.666 -9.733 8.520 1.00 0.00 ? 19 C A "O2'" 1
|
| 1560 |
+
ATOM 602 C "C1'" . C A 1 19 ? 19.404 -9.830 9.412 1.00 0.00 ? 19 C A "C1'" 1
|
| 1561 |
+
ATOM 603 N N1 . C A 1 19 ? 18.397 -8.932 10.010 1.00 0.00 ? 19 C A N1 1
|
| 1562 |
+
ATOM 604 C C2 . C A 1 19 ? 17.991 -7.834 9.265 1.00 0.00 ? 19 C A C2 1
|
| 1563 |
+
ATOM 605 O O2 . C A 1 19 ? 18.403 -7.670 8.117 1.00 0.00 ? 19 C A O2 1
|
| 1564 |
+
ATOM 606 N N3 . C A 1 19 ? 17.131 -6.950 9.829 1.00 0.00 ? 19 C A N3 1
|
| 1565 |
+
ATOM 607 C C4 . C A 1 19 ? 16.679 -7.131 11.071 1.00 0.00 ? 19 C A C4 1
|
| 1566 |
+
ATOM 608 N N4 . C A 1 19 ? 15.863 -6.207 11.562 1.00 0.00 ? 19 C A N4 1
|
| 1567 |
+
ATOM 609 C C5 . C A 1 19 ? 17.080 -8.264 11.844 1.00 0.00 ? 19 C A C5 1
|
| 1568 |
+
ATOM 610 C C6 . C A 1 19 ? 17.936 -9.134 11.279 1.00 0.00 ? 19 C A C6 1
|
| 1569 |
+
ATOM 611 H "H5'" . C A 1 19 ? 19.913 -12.890 11.960 1.00 0.00 ? 19 C A "H5'" 1
|
| 1570 |
+
ATOM 612 H "H5''" . C A 1 19 ? 21.427 -12.197 12.575 1.00 0.00 ? 19 C A "H5''" 1
|
| 1571 |
+
ATOM 613 H "H4'" . C A 1 19 ? 21.322 -11.869 10.176 1.00 0.00 ? 19 C A "H4'" 1
|
| 1572 |
+
ATOM 614 H "H3'" . C A 1 19 ? 20.824 -9.285 11.753 1.00 0.00 ? 19 C A "H3'" 1
|
| 1573 |
+
ATOM 615 H "H2'" . C A 1 19 ? 20.790 -8.168 9.596 1.00 0.00 ? 19 C A "H2'" 1
|
| 1574 |
+
ATOM 616 H "HO2'" . C A 1 19 ? 21.734 -9.034 7.865 1.00 0.00 ? 19 C A "HO2'" 1
|
| 1575 |
+
ATOM 617 H "H1'" . C A 1 19 ? 19.160 -10.019 8.366 1.00 0.00 ? 19 C A "H1'" 1
|
| 1576 |
+
ATOM 618 H H41 . C A 1 19 ? 15.688 -5.362 11.031 1.00 0.00 ? 19 C A H41 1
|
| 1577 |
+
ATOM 619 H H42 . C A 1 19 ? 15.442 -6.332 12.471 1.00 0.00 ? 19 C A H42 1
|
| 1578 |
+
ATOM 620 H H5 . C A 1 19 ? 16.710 -8.425 12.857 1.00 0.00 ? 19 C A H5 1
|
| 1579 |
+
ATOM 621 H H6 . C A 1 19 ? 18.270 -10.005 11.841 1.00 0.00 ? 19 C A H6 1
|
| 1580 |
+
ATOM 622 P P . G A 1 20 ? 23.495 -8.803 11.722 1.00 0.00 ? 20 G A P 1
|
| 1581 |
+
ATOM 623 O OP1 . G A 1 20 ? 24.891 -8.851 11.233 1.00 0.00 ? 20 G A OP1 1
|
| 1582 |
+
ATOM 624 O OP2 . G A 1 20 ? 23.214 -8.956 13.167 1.00 0.00 ? 20 G A OP2 1
|
| 1583 |
+
ATOM 625 O "O5'" . G A 1 20 ? 22.832 -7.420 11.223 1.00 0.00 ? 20 G A "O5'" 1
|
| 1584 |
+
ATOM 626 C "C5'" . G A 1 20 ? 23.277 -6.809 10.009 1.00 0.00 ? 20 G A "C5'" 1
|
| 1585 |
+
ATOM 627 C "C4'" . G A 1 20 ? 22.192 -5.938 9.369 1.00 0.00 ? 20 G A "C4'" 1
|
| 1586 |
+
ATOM 628 O "O4'" . G A 1 20 ? 20.898 -6.450 9.698 1.00 0.00 ? 20 G A "O4'" 1
|
| 1587 |
+
ATOM 629 C "C3'" . G A 1 20 ? 22.119 -4.510 9.868 1.00 0.00 ? 20 G A "C3'" 1
|
| 1588 |
+
ATOM 630 O "O3'" . G A 1 20 ? 23.049 -3.739 9.101 1.00 0.00 ? 20 G A "O3'" 1
|
| 1589 |
+
ATOM 631 C "C2'" . G A 1 20 ? 20.719 -4.097 9.435 1.00 0.00 ? 20 G A "C2'" 1
|
| 1590 |
+
ATOM 632 O "O2'" . G A 1 20 ? 20.707 -3.738 8.050 1.00 0.00 ? 20 G A "O2'" 1
|
| 1591 |
+
ATOM 633 C "C1'" . G A 1 20 ? 19.930 -5.383 9.665 1.00 0.00 ? 20 G A "C1'" 1
|
| 1592 |
+
ATOM 634 N N9 . G A 1 20 ? 19.203 -5.327 10.945 1.00 0.00 ? 20 G A N9 1
|
| 1593 |
+
ATOM 635 C C8 . G A 1 20 ? 19.362 -6.095 12.071 1.00 0.00 ? 20 G A C8 1
|
| 1594 |
+
ATOM 636 N N7 . G A 1 20 ? 18.590 -5.736 13.062 1.00 0.00 ? 20 G A N7 1
|
| 1595 |
+
ATOM 637 C C5 . G A 1 20 ? 17.870 -4.657 12.554 1.00 0.00 ? 20 G A C5 1
|
| 1596 |
+
ATOM 638 C C6 . G A 1 20 ? 16.871 -3.849 13.168 1.00 0.00 ? 20 G A C6 1
|
| 1597 |
+
ATOM 639 O O6 . G A 1 20 ? 16.418 -3.929 14.309 1.00 0.00 ? 20 G A O6 1
|
| 1598 |
+
ATOM 640 N N1 . G A 1 20 ? 16.401 -2.871 12.303 1.00 0.00 ? 20 G A N1 1
|
| 1599 |
+
ATOM 641 C C2 . G A 1 20 ? 16.834 -2.689 11.008 1.00 0.00 ? 20 G A C2 1
|
| 1600 |
+
ATOM 642 N N2 . G A 1 20 ? 16.274 -1.699 10.311 1.00 0.00 ? 20 G A N2 1
|
| 1601 |
+
ATOM 643 N N3 . G A 1 20 ? 17.768 -3.441 10.425 1.00 0.00 ? 20 G A N3 1
|
| 1602 |
+
ATOM 644 C C4 . G A 1 20 ? 18.238 -4.402 11.256 1.00 0.00 ? 20 G A C4 1
|
| 1603 |
+
ATOM 645 H "H5'" . G A 1 20 ? 23.569 -7.593 9.309 1.00 0.00 ? 20 G A "H5'" 1
|
| 1604 |
+
ATOM 646 H "H5''" . G A 1 20 ? 24.146 -6.187 10.225 1.00 0.00 ? 20 G A "H5''" 1
|
| 1605 |
+
ATOM 647 H "H4'" . G A 1 20 ? 22.313 -5.955 8.284 1.00 0.00 ? 20 G A "H4'" 1
|
| 1606 |
+
ATOM 648 H "H3'" . G A 1 20 ? 22.289 -4.413 10.941 1.00 0.00 ? 20 G A "H3'" 1
|
| 1607 |
+
ATOM 649 H "H2'" . G A 1 20 ? 20.327 -3.293 10.059 1.00 0.00 ? 20 G A "H2'" 1
|
| 1608 |
+
ATOM 650 H "HO2'" . G A 1 20 ? 19.963 -3.146 7.916 1.00 0.00 ? 20 G A "HO2'" 1
|
| 1609 |
+
ATOM 651 H "H1'" . G A 1 20 ? 19.225 -5.555 8.852 1.00 0.00 ? 20 G A "H1'" 1
|
| 1610 |
+
ATOM 652 H H8 . G A 1 20 ? 20.065 -6.925 12.132 1.00 0.00 ? 20 G A H8 1
|
| 1611 |
+
ATOM 653 H H1 . G A 1 20 ? 15.688 -2.249 12.655 1.00 0.00 ? 20 G A H1 1
|
| 1612 |
+
ATOM 654 H H21 . G A 1 20 ? 15.511 -1.171 10.706 1.00 0.00 ? 20 G A H21 1
|
| 1613 |
+
ATOM 655 H H22 . G A 1 20 ? 16.612 -1.480 9.385 1.00 0.00 ? 20 G A H22 1
|
| 1614 |
+
ATOM 656 P P . C A 1 21 ? 24.157 -2.829 9.835 1.00 0.00 ? 21 C A P 1
|
| 1615 |
+
ATOM 657 O OP1 . C A 1 21 ? 25.191 -2.465 8.841 1.00 0.00 ? 21 C A OP1 1
|
| 1616 |
+
ATOM 658 O OP2 . C A 1 21 ? 24.548 -3.502 11.094 1.00 0.00 ? 21 C A OP2 1
|
| 1617 |
+
ATOM 659 O "O5'" . C A 1 21 ? 23.329 -1.500 10.210 1.00 0.00 ? 21 C A "O5'" 1
|
| 1618 |
+
ATOM 660 C "C5'" . C A 1 21 ? 23.199 -0.435 9.266 1.00 0.00 ? 21 C A "C5'" 1
|
| 1619 |
+
ATOM 661 C "C4'" . C A 1 21 ? 22.589 0.810 9.902 1.00 0.00 ? 21 C A "C4'" 1
|
| 1620 |
+
ATOM 662 O "O4'" . C A 1 21 ? 21.194 0.598 10.114 1.00 0.00 ? 21 C A "O4'" 1
|
| 1621 |
+
ATOM 663 C "C3'" . C A 1 21 ? 23.114 1.147 11.280 1.00 0.00 ? 21 C A "C3'" 1
|
| 1622 |
+
ATOM 664 O "O3'" . C A 1 21 ? 24.228 2.026 11.103 1.00 0.00 ? 21 C A "O3'" 1
|
| 1623 |
+
ATOM 665 C "C2'" . C A 1 21 ? 21.986 1.971 11.886 1.00 0.00 ? 21 C A "C2'" 1
|
| 1624 |
+
ATOM 666 O "O2'" . C A 1 21 ? 22.106 3.343 11.503 1.00 0.00 ? 21 C A "O2'" 1
|
| 1625 |
+
ATOM 667 C "C1'" . C A 1 21 ? 20.739 1.346 11.253 1.00 0.00 ? 21 C A "C1'" 1
|
| 1626 |
+
ATOM 668 N N1 . C A 1 21 ? 20.041 0.429 12.182 1.00 0.00 ? 21 C A N1 1
|
| 1627 |
+
ATOM 669 C C2 . C A 1 21 ? 19.167 0.989 13.105 1.00 0.00 ? 21 C A C2 1
|
| 1628 |
+
ATOM 670 O O2 . C A 1 21 ? 18.986 2.205 13.126 1.00 0.00 ? 21 C A O2 1
|
| 1629 |
+
ATOM 671 N N3 . C A 1 21 ? 18.519 0.167 13.974 1.00 0.00 ? 21 C A N3 1
|
| 1630 |
+
ATOM 672 C C4 . C A 1 21 ? 18.719 -1.156 13.942 1.00 0.00 ? 21 C A C4 1
|
| 1631 |
+
ATOM 673 N N4 . C A 1 21 ? 18.054 -1.906 14.822 1.00 0.00 ? 21 C A N4 1
|
| 1632 |
+
ATOM 674 C C5 . C A 1 21 ? 19.618 -1.742 12.995 1.00 0.00 ? 21 C A C5 1
|
| 1633 |
+
ATOM 675 C C6 . C A 1 21 ? 20.254 -0.918 12.139 1.00 0.00 ? 21 C A C6 1
|
| 1634 |
+
ATOM 676 H "H5'" . C A 1 21 ? 22.561 -0.764 8.445 1.00 0.00 ? 21 C A "H5'" 1
|
| 1635 |
+
ATOM 677 H "H5''" . C A 1 21 ? 24.185 -0.186 8.872 1.00 0.00 ? 21 C A "H5''" 1
|
| 1636 |
+
ATOM 678 H "H4'" . C A 1 21 ? 22.721 1.655 9.227 1.00 0.00 ? 21 C A "H4'" 1
|
| 1637 |
+
ATOM 679 H "H3'" . C A 1 21 ? 23.377 0.270 11.871 1.00 0.00 ? 21 C A "H3'" 1
|
| 1638 |
+
ATOM 680 H "H2'" . C A 1 21 ? 21.966 1.864 12.970 1.00 0.00 ? 21 C A "H2'" 1
|
| 1639 |
+
ATOM 681 H "HO2'" . C A 1 21 ? 22.669 3.376 10.726 1.00 0.00 ? 21 C A "HO2'" 1
|
| 1640 |
+
ATOM 682 H "H1'" . C A 1 21 ? 20.047 2.120 10.917 1.00 0.00 ? 21 C A "H1'" 1
|
| 1641 |
+
ATOM 683 H H41 . C A 1 21 ? 17.380 -1.478 15.444 1.00 0.00 ? 21 C A H41 1
|
| 1642 |
+
ATOM 684 H H42 . C A 1 21 ? 18.224 -2.902 14.869 1.00 0.00 ? 21 C A H42 1
|
| 1643 |
+
ATOM 685 H H5 . C A 1 21 ? 19.790 -2.818 12.961 1.00 0.00 ? 21 C A H5 1
|
| 1644 |
+
ATOM 686 H H6 . C A 1 21 ? 20.945 -1.332 11.405 1.00 0.00 ? 21 C A H6 1
|
| 1645 |
+
ATOM 687 P P . C A 1 22 ? 25.408 2.080 12.196 1.00 0.00 ? 22 C A P 1
|
| 1646 |
+
ATOM 688 O OP1 . C A 1 22 ? 26.703 2.020 11.482 1.00 0.00 ? 22 C A OP1 1
|
| 1647 |
+
ATOM 689 O OP2 . C A 1 22 ? 25.102 1.092 13.255 1.00 0.00 ? 22 C A OP2 1
|
| 1648 |
+
ATOM 690 O "O5'" . C A 1 22 ? 25.242 3.555 12.820 1.00 0.00 ? 22 C A "O5'" 1
|
| 1649 |
+
ATOM 691 C "C5'" . C A 1 22 ? 25.174 4.701 11.968 1.00 0.00 ? 22 C A "C5'" 1
|
| 1650 |
+
ATOM 692 C "C4'" . C A 1 22 ? 24.352 5.821 12.598 1.00 0.00 ? 22 C A "C4'" 1
|
| 1651 |
+
ATOM 693 O "O4'" . C A 1 22 ? 23.031 5.340 12.866 1.00 0.00 ? 22 C A "O4'" 1
|
| 1652 |
+
ATOM 694 C "C3'" . C A 1 22 ? 24.866 6.302 13.947 1.00 0.00 ? 22 C A "C3'" 1
|
| 1653 |
+
ATOM 695 O "O3'" . C A 1 22 ? 25.833 7.342 13.773 1.00 0.00 ? 22 C A "O3'" 1
|
| 1654 |
+
ATOM 696 C "C2'" . C A 1 22 ? 23.599 6.854 14.587 1.00 0.00 ? 22 C A "C2'" 1
|
| 1655 |
+
ATOM 697 O "O2'" . C A 1 22 ? 23.319 8.167 14.096 1.00 0.00 ? 22 C A "O2'" 1
|
| 1656 |
+
ATOM 698 C "C1'" . C A 1 22 ? 22.539 5.866 14.107 1.00 0.00 ? 22 C A "C1'" 1
|
| 1657 |
+
ATOM 699 N N1 . C A 1 22 ? 22.341 4.749 15.056 1.00 0.00 ? 22 C A N1 1
|
| 1658 |
+
ATOM 700 C C2 . C A 1 22 ? 21.579 4.996 16.188 1.00 0.00 ? 22 C A C2 1
|
| 1659 |
+
ATOM 701 O O2 . C A 1 22 ? 21.091 6.109 16.374 1.00 0.00 ? 22 C A O2 1
|
| 1660 |
+
ATOM 702 N N3 . C A 1 22 ? 21.387 3.986 17.081 1.00 0.00 ? 22 C A N3 1
|
| 1661 |
+
ATOM 703 C C4 . C A 1 22 ? 21.922 2.776 16.869 1.00 0.00 ? 22 C A C4 1
|
| 1662 |
+
ATOM 704 N N4 . C A 1 22 ? 21.700 1.829 17.780 1.00 0.00 ? 22 C A N4 1
|
| 1663 |
+
ATOM 705 C C5 . C A 1 22 ? 22.709 2.513 15.703 1.00 0.00 ? 22 C A C5 1
|
| 1664 |
+
ATOM 706 C C6 . C A 1 22 ? 22.893 3.520 14.828 1.00 0.00 ? 22 C A C6 1
|
| 1665 |
+
ATOM 707 H "H5'" . C A 1 22 ? 24.716 4.414 11.021 1.00 0.00 ? 22 C A "H5'" 1
|
| 1666 |
+
ATOM 708 H "H5''" . C A 1 22 ? 26.184 5.065 11.779 1.00 0.00 ? 22 C A "H5''" 1
|
| 1667 |
+
ATOM 709 H "H4'" . C A 1 22 ? 24.290 6.651 11.895 1.00 0.00 ? 22 C A "H4'" 1
|
| 1668 |
+
ATOM 710 H "H3'" . C A 1 22 ? 25.274 5.476 14.529 1.00 0.00 ? 22 C A "H3'" 1
|
| 1669 |
+
ATOM 711 H "HO3'" . C A 1 22 ? 25.588 8.061 14.359 1.00 0.00 ? 22 C A "HO3'" 1
|
| 1670 |
+
ATOM 712 H "H2'" . C A 1 22 ? 23.676 6.847 15.674 1.00 0.00 ? 22 C A "H2'" 1
|
| 1671 |
+
ATOM 713 H "HO2'" . C A 1 22 ? 24.120 8.686 14.196 1.00 0.00 ? 22 C A "HO2'" 1
|
| 1672 |
+
ATOM 714 H "H1'" . C A 1 22 ? 21.588 6.369 13.934 1.00 0.00 ? 22 C A "H1'" 1
|
| 1673 |
+
ATOM 715 H H41 . C A 1 22 ? 21.202 2.053 18.631 1.00 0.00 ? 22 C A H41 1
|
| 1674 |
+
ATOM 716 H H42 . C A 1 22 ? 22.029 0.887 17.620 1.00 0.00 ? 22 C A H42 1
|
| 1675 |
+
ATOM 717 H H5 . C A 1 22 ? 23.152 1.533 15.522 1.00 0.00 ? 22 C A H5 1
|
| 1676 |
+
ATOM 718 H H6 . C A 1 22 ? 23.487 3.353 13.927 1.00 0.00 ? 22 C A H6 1
|
| 1677 |
+
#
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