1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
215
216
217
218
219
220
221
222
223
224
225
226
227
228
229
230
231
232
233
234
235
236
237
238
239
240
241
242
243
244
245
246
247
248
249
250
251
252
253
254
255
256
257
258
259
260
261
262
263
264
265
266
267
268
269
270
271
272
273
274
275
276
277
278
279
280
281
282
283
284
285
286
287
288
289
290
291
292
293
294
295
296
297
298
299
300
301
302
303
304
305
306
307
308
309
310
311
312
313
314
315
316
317
318
319
320
321
322
323
324
325
326
327
328
329
330
331
332
333
334
335
336
337
338
339
340
341
342
343
344
345
346
347
348
349
350
351
352
353
354
355
356
357
358
359
360
361
362
363
364
365
366
367
368
369
370
371
372
373
374
375
376
377
378
379
380
381
382
383
384
385
386
387
388
389
390
391
392
393
394
395
396
397
398
399
400
401
402
403
404
405
406
407
408
409
410
411
412
413
414
415
416
417
418
419
420
421
422
423
424
425
426
427
428
429
430
431
432
433
434
435
436
437
438
439
440
441
442
443
444
445
446
447
448
449
450
451
452
453
454
455
456
457
458
459
460
461
462
463
464
465
466
467
468
469
470
471
472
473
474
475
476
477
478
479
480
481
482
483
484
485
486
487
488
489
490
491
492
493
494
495
496
497
498
499
500
501
502
503
504
505
506
507
508
509
510
511
512
513
514
515
516
517
518
519
520
521
522
523
524
525
526
527
528
529
530
531
532
533
534
535
536
537
538
539
540
541
542
543
544
545
546
547
548
549
550
551
552
553
554
555
556
557
558
559
560
561
562
563
564
565
566
567
568
569
570
571
572
573
574
575
576
577
578
579
580
581
582
583
584
585
586
587
588
589
590
591
592
593
594
595
596
597
598
599
600
601
602
603
604
605
606
607
608
609
610
611
612
613
614
615
616
617
618
619
620
621
622
623
624
625
626
627
628
629
630
631
632
633
634
635
636
637
638
639
640
641
642
643
644
645
646
647
648
649
650
651
652
653
654
655
656
657
658
659
660
661
662
663
664
665
666
667
668
669
670
671
672
673
674
675
676
677
678
679
680
681
682
683
684
685
686
687
688
689
690
691
692
693
694
695
696
697
698
699
700
701
702
703
704
705
706
707
708
709
710
711
712
713
714
715
716
717
718
719
720
721
722
723
724
725
726
727
728
729
730
731
732
733
734
735
736
737
738
739
740
741
742
743
744
745
746
747
748
749
750
751
752
753
754
755
756
757
758
759
760
761
762
763
764
765
766
767
768
769
770
771
772
773
774
775
776
777
778
779
780
781
782
783
784
785
786
787
788
789
790
791
792
793
794
795
796
797
798
799
800
801
802
803
804
805
806
807
808
809
810
811
812
813
814
815
816
817
818
819
820
821
822
823
824
825
826
827
828
829
830
831
832
833
834
835
836
837
838
839
840
841
842
843
844
845
846
847
848
849
850
851
852
853
854
855
856
857
858
859
860
861
862
863
864
865
866
867
868
869
870
871
872
873
874
875
876
877
878
879
880
881
882
883
884
885
886
887
888
889
890
891
892
893
894
895
896
897
898
899
900
901
902
903
904
905
906
907
908
909
910
911
912
913
914
915
916
917
918
919
920
921
922
923
924
925
926
927
928
929
930
931
932
933
934
935
936
937
938
939
940
941
942
943
944
945
946
947
948
949
950
951
952
953
954
955
956
957
958
959
960
961
962
963
964
965
966
967
968
969
970
971
972
973
974
975
976
977
978
979
980
981
982
983
984
985
986
987
988
989
990
991
992
993
994
995
996
997
998
999
1000
1001
1002
1003
1004
1005
1006
1007
1008
1009
1010
1011
1012
1013
1014
1015
1016
1017
1018
1019
1020
1021
1022
1023
1024
1025
1026
1027
1028
1029
1030
1031
1032
1033
1034
1035
1036
1037
1038
1039
1040
1041
1042
1043
1044
1045
1046
1047
1048
1049
1050
1051
1052
1053
1054
1055
1056
1057
1058
1059
1060
1061
1062
1063
1064
1065
1066
1067
1068
1069
1070
1071
1072
1073
1074
1075
1076
1077
1078
1079
1080
1081
1082
1083
1084
1085
1086
1087
1088
1089
1090
1091
1092
1093
1094
1095
1096
1097
1098
1099
1100
1101
1102
1103
1104
1105
1106
1107
1108
1109
1110
1111
1112
1113
1114
1115
1116
1117
1118
1119
1120
1121
1122
1123
1124
1125
1126
1127
1128
1129
1130
1131
1132
1133
1134
1135
1136
1137
1138
1139
1140
1141
1142
1143
1144
1145
1146
1147
1148
1149
1150
1151
1152
1153
1154
1155
1156
1157
1158
1159
1160
1161
1162
1163
1164
1165
1166
1167
1168
1169
1170
1171
1172
1173
1174
1175
1176
1177
1178
1179
1180
1181
1182
1183
1184
1185
1186
1187
1188
1189
1190
1191
1192
1193
1194
1195
1196
1197
1198
1199
1200
1201
1202
1203
1204
1205
1206
1207
1208
1209
1210
1211
1212
1213
1214
1215
1216
1217
1218
1219
1220
1221
1222
1223
1224
1225
1226
1227
1228
1229
1230
1231
1232
1233
1234
1235
1236
1237
1238
1239
1240
1241
1242
1243
1244
1245
1246
1247
1248
1249
1250
1251
1252
1253
1254
1255
1256
1257
1258
1259
1260
1261
1262
1263
1264
1265
1266
1267
1268
1269
1270
1271
1272
1273
1274
1275
1276
1277
1278
1279
1280
1281
1282
1283
1284
1285
1286
1287
1288
1289
1290
1291
1292
1293
1294
1295
1296
1297
1298
1299
1300
1301
1302
1303
1304
1305
1306
1307
1308
1309
1310
1311
1312
1313
1314
1315
1316
1317
1318
1319
1320
1321
1322
1323
1324
1325
1326
1327
1328
1329
1330
1331
1332
1333
1334
1335
1336
1337
1338
1339
1340
1341
1342
1343
1344
1345
1346
1347
1348
1349
1350
1351
1352
1353
1354
1355
1356
1357
1358
1359
1360
1361
1362
1363
1364
1365
1366
1367
1368
1369
1370
1371
1372
1373
1374
1375
1376
1377
1378
1379
1380
1381
1382
1383
1384
1385
1386
1387
1388
1389
1390
1391
1392
1393
1394
1395
1396
1397
1398
1399
1400
1401
1402
1403
1404
1405
1406
1407
1408
1409
1410
1411
1412
1413
1414
1415
1416
1417
1418
1419
1420
1421
1422
1423
1424
1425
1426
1427
1428
1429
1430
1431
1432
1433
1434
1435
1436
1437
1438
1439
1440
1441
1442
1443
1444
1445
1446
1447
1448
1449
1450
1451
1452
1453
1454
1455
1456
1457
1458
1459
1460
1461
1462
1463
1464
1465
1466
1467
1468
1469
1470
1471
1472
1473
1474
1475
1476
1477
1478
1479
1480
1481
1482
1483
1484
1485
1486
1487
1488
1489
1490
1491
1492
1493
1494
1495
1496
1497
1498
1499
1500
1501
1502
1503
1504
1505
1506
1507
1508
1509
1510
1511
1512
1513
1514
1515
1516
1517
1518
1519
1520
1521
1522
1523
1524
1525
1526
1527
1528
1529
1530
1531
1532
1533
1534
1535
1536
1537
1538
1539
1540
1541
1542
1543
1544
1545
1546
1547
1548
1549
1550
1551
1552
1553
1554
1555
1556
1557
1558
1559
1560
1561
1562
1563
1564
1565
1566
1567
1568
1569
1570
1571
1572
1573
1574
1575
1576
1577
1578
1579
1580
1581
1582
1583
1584
1585
1586
1587
1588
1589
1590
1591
1592
1593
1594
1595
1596
1597
1598
1599
1600
1601
1602
1603
1604
1605
1606
1607
1608
1609
1610
1611
1612
1613
1614
1615
1616
1617
1618
1619
1620
1621
1622
1623
1624
1625
1626
1627
1628
1629
1630
1631
1632
1633
1634
1635
1636
1637
1638
1639
1640
1641
1642
1643
1644
1645
1646
1647
1648
1649
1650
1651
1652
1653
1654
1655
1656
1657
1658
1659
1660
1661
1662
1663
1664
1665
1666
1667
1668
1669
1670
1671
1672
1673
1674
1675
1676
1677
1678
1679
1680
1681
1682
1683
1684
1685
1686
1687
1688
1689
1690
1691
1692
1693
1694
1695
1696
1697
1698
1699
1700
1701
1702
|
data_1RNA
#
_entry.id 1RNA
#
_audit_conform.dict_name mmcif_pdbx.dic
_audit_conform.dict_version 5.292
_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic
#
loop_
_database_2.database_id
_database_2.database_code
PDB 1RNA
RCSB ARN035
WWPDB D_1000176131
#
_pdbx_database_status.status_code REL
_pdbx_database_status.entry_id 1RNA
_pdbx_database_status.recvd_initial_deposition_date 1990-02-01
_pdbx_database_status.deposit_site BNL
_pdbx_database_status.process_site BNL
_pdbx_database_status.SG_entry .
_pdbx_database_status.pdb_format_compatible Y
_pdbx_database_status.status_code_mr ?
_pdbx_database_status.status_code_sf ?
_pdbx_database_status.status_code_cs ?
_pdbx_database_status.methods_development_category ?
#
loop_
_audit_author.name
_audit_author.pdbx_ordinal
'Dock-Bregeon, A.C.' 1
'Chevrier, B.' 2
'Podjarny, A.' 3
'Johnson, J.' 4
'De Bear, J.S.' 5
'Gough, G.R.' 6
'Gilham, P.T.' 7
'Moras, D.' 8
#
loop_
_citation.id
_citation.title
_citation.journal_abbrev
_citation.journal_volume
_citation.page_first
_citation.page_last
_citation.year
_citation.journal_id_ASTM
_citation.country
_citation.journal_id_ISSN
_citation.journal_id_CSD
_citation.book_publisher
_citation.pdbx_database_id_PubMed
_citation.pdbx_database_id_DOI
primary 'Crystallographic structure of an RNA helix: [U(UA)6A]2.' J.Mol.Biol. 209 459 474 1989 JMOBAK UK 0022-2836 0070 ? 2479753
'10.1016/0022-2836(89)90010-7'
1 'High Resolution Structure of the RNA Duplex [u(u-A)6a]2' Nature 335 375 378 1988 NATUAS UK 0028-0836 0006 ? ?
?
#
loop_
_citation_author.citation_id
_citation_author.name
_citation_author.ordinal
primary 'Dock-Bregeon, A.C.' 1
primary 'Chevrier, B.' 2
primary 'Podjarny, A.' 3
primary 'Johnson, J.' 4
primary 'de Bear, J.S.' 5
primary 'Gough, G.R.' 6
primary 'Gilham, P.T.' 7
primary 'Moras, D.' 8
1 'Dock-Bregeon, A.C.' 9
1 'Chevier, B.' 10
1 'Podjarny, A.' 11
1 'Moras, D.' 12
1 'De Bear, J.S.' 13
1 'Gough, G.R.' 14
1 'Gilham, P.T.' 15
1 'Johnson, J.E.' 16
#
_cell.entry_id 1RNA
_cell.length_a 34.110
_cell.length_b 44.610
_cell.length_c 49.110
_cell.angle_alpha 90.00
_cell.angle_beta 90.00
_cell.angle_gamma 90.00
_cell.Z_PDB 8
_cell.pdbx_unique_axis ?
#
_symmetry.entry_id 1RNA
_symmetry.space_group_name_H-M 'P 21 21 21'
_symmetry.pdbx_full_space_group_name_H-M ?
_symmetry.cell_setting ?
_symmetry.Int_Tables_number 19
#
loop_
_entity.id
_entity.type
_entity.src_method
_entity.pdbx_description
_entity.formula_weight
_entity.pdbx_number_of_molecules
_entity.pdbx_ec
_entity.pdbx_mutation
_entity.pdbx_fragment
_entity.details
1 polymer syn
;RNA (5'-R(*UP*UP*AP*UP*AP*UP*AP*UP*AP*UP*AP*UP*AP*A)-3')
;
4402.644 2 ? ? ? ?
2 water nat water 18.015 91 ? ? ? ?
#
_entity_poly.entity_id 1
_entity_poly.type polyribonucleotide
_entity_poly.nstd_linkage no
_entity_poly.nstd_monomer no
_entity_poly.pdbx_seq_one_letter_code UUAUAUAUAUAUAA
_entity_poly.pdbx_seq_one_letter_code_can UUAUAUAUAUAUAA
_entity_poly.pdbx_strand_id A,B
_entity_poly.pdbx_target_identifier ?
#
loop_
_entity_poly_seq.entity_id
_entity_poly_seq.num
_entity_poly_seq.mon_id
_entity_poly_seq.hetero
1 1 U n
1 2 U n
1 3 A n
1 4 U n
1 5 A n
1 6 U n
1 7 A n
1 8 U n
1 9 A n
1 10 U n
1 11 A n
1 12 U n
1 13 A n
1 14 A n
#
_struct_ref.id 1
_struct_ref.entity_id 1
_struct_ref.db_name PDB
_struct_ref.db_code 1RNA
_struct_ref.pdbx_db_accession 1RNA
_struct_ref.pdbx_db_isoform ?
_struct_ref.pdbx_seq_one_letter_code ?
_struct_ref.pdbx_align_begin ?
#
loop_
_struct_ref_seq.align_id
_struct_ref_seq.ref_id
_struct_ref_seq.pdbx_PDB_id_code
_struct_ref_seq.pdbx_strand_id
_struct_ref_seq.seq_align_beg
_struct_ref_seq.pdbx_seq_align_beg_ins_code
_struct_ref_seq.seq_align_end
_struct_ref_seq.pdbx_seq_align_end_ins_code
_struct_ref_seq.pdbx_db_accession
_struct_ref_seq.db_align_beg
_struct_ref_seq.pdbx_db_align_beg_ins_code
_struct_ref_seq.db_align_end
_struct_ref_seq.pdbx_db_align_end_ins_code
_struct_ref_seq.pdbx_auth_seq_align_beg
_struct_ref_seq.pdbx_auth_seq_align_end
1 1 1RNA A 1 ? 14 ? 1RNA 1 ? 14 ? 1 14
2 1 1RNA B 1 ? 14 ? 1RNA 15 ? 28 ? 15 28
#
loop_
_chem_comp.id
_chem_comp.type
_chem_comp.mon_nstd_flag
_chem_comp.name
_chem_comp.pdbx_synonyms
_chem_comp.formula
_chem_comp.formula_weight
A 'RNA linking' y "ADENOSINE-5'-MONOPHOSPHATE" ? 'C10 H14 N5 O7 P' 347.221
HOH non-polymer . WATER ? 'H2 O' 18.015
U 'RNA linking' y "URIDINE-5'-MONOPHOSPHATE" ? 'C9 H13 N2 O9 P' 324.181
#
_exptl.entry_id 1RNA
_exptl.method 'X-RAY DIFFRACTION'
_exptl.crystals_number ?
#
_exptl_crystal.id 1
_exptl_crystal.density_meas ?
_exptl_crystal.density_Matthews 2.12
_exptl_crystal.density_percent_sol 42.03
_exptl_crystal.description ?
#
_exptl_crystal_grow.crystal_id 1
_exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP'
_exptl_crystal_grow.temp 308.00
_exptl_crystal_grow.temp_details ?
_exptl_crystal_grow.pH 6.50
_exptl_crystal_grow.pdbx_details 'pH 6.50, VAPOR DIFFUSION, HANGING DROP, temperature 308.00K'
_exptl_crystal_grow.pdbx_pH_range ?
#
loop_
_exptl_crystal_grow_comp.crystal_id
_exptl_crystal_grow_comp.id
_exptl_crystal_grow_comp.sol_id
_exptl_crystal_grow_comp.name
_exptl_crystal_grow_comp.volume
_exptl_crystal_grow_comp.conc
_exptl_crystal_grow_comp.details
1 1 1 WATER ? ? ?
1 2 1 MPD ? ? ?
1 3 1 'NA CACODYLATE' ? ? ?
1 4 1 SPERMINE ? ? ?
1 5 1 MG2+ ? ? ?
1 6 2 WATER ? ? ?
1 7 2 MPD ? ? ?
#
_diffrn.id 1
_diffrn.ambient_temp 291.00
_diffrn.ambient_temp_details ?
_diffrn.crystal_id 1
#
_diffrn_detector.diffrn_id 1
_diffrn_detector.detector DIFFRACTOMETER
_diffrn_detector.type 'ENRAF-NONIUS CAD4'
_diffrn_detector.pdbx_collection_date ?
_diffrn_detector.details ?
#
_diffrn_radiation.diffrn_id 1
_diffrn_radiation.wavelength_id 1
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l ?
_diffrn_radiation.monochromator ?
_diffrn_radiation.pdbx_diffrn_protocol ?
_diffrn_radiation.pdbx_scattering_type x-ray
#
_diffrn_radiation_wavelength.id 1
_diffrn_radiation_wavelength.wavelength .
_diffrn_radiation_wavelength.wt 1.0
#
_diffrn_source.diffrn_id 1
_diffrn_source.source ?
_diffrn_source.type ?
_diffrn_source.pdbx_synchrotron_site ?
_diffrn_source.pdbx_synchrotron_beamline ?
_diffrn_source.pdbx_wavelength ?
_diffrn_source.pdbx_wavelength_list ?
#
_reflns.entry_id 1RNA
_reflns.observed_criterion_sigma_I ?
_reflns.observed_criterion_sigma_F 2.000
_reflns.d_resolution_low 25.000
_reflns.d_resolution_high 2.250
_reflns.number_obs 2492
_reflns.number_all 4924
_reflns.percent_possible_obs ?
_reflns.pdbx_Rmerge_I_obs ?
_reflns.pdbx_Rsym_value ?
_reflns.pdbx_netI_over_sigmaI ?
_reflns.B_iso_Wilson_estimate ?
_reflns.pdbx_redundancy ?
_reflns.pdbx_diffrn_id 1
_reflns.pdbx_ordinal 1
#
_refine.entry_id 1RNA
_refine.ls_number_reflns_obs 2437
_refine.ls_number_reflns_all ?
_refine.pdbx_ls_sigma_I ?
_refine.pdbx_ls_sigma_F 2.000
_refine.pdbx_data_cutoff_high_absF ?
_refine.pdbx_data_cutoff_low_absF ?
_refine.pdbx_data_cutoff_high_rms_absF ?
_refine.ls_d_res_low 10.000
_refine.ls_d_res_high 2.250
_refine.ls_percent_reflns_obs ?
_refine.ls_R_factor_obs 0.1310000
_refine.ls_R_factor_all ?
_refine.ls_R_factor_R_work ?
_refine.ls_R_factor_R_free ?
_refine.ls_R_factor_R_free_error ?
_refine.ls_R_factor_R_free_error_details ?
_refine.ls_percent_reflns_R_free ?
_refine.ls_number_reflns_R_free ?
_refine.ls_number_parameters ?
_refine.ls_number_restraints ?
_refine.occupancy_min 0.51
_refine.occupancy_max 1.00
_refine.B_iso_mean ?
_refine.aniso_B[1][1] ?
_refine.aniso_B[2][2] ?
_refine.aniso_B[3][3] ?
_refine.aniso_B[1][2] ?
_refine.aniso_B[1][3] ?
_refine.aniso_B[2][3] ?
_refine.solvent_model_details ?
_refine.solvent_model_param_ksol ?
_refine.solvent_model_param_bsol ?
_refine.pdbx_ls_cross_valid_method ?
_refine.details ?
_refine.pdbx_starting_model ?
_refine.pdbx_method_to_determine_struct ?
_refine.pdbx_isotropic_thermal_model ?
_refine.pdbx_stereochemistry_target_values ?
_refine.pdbx_stereochem_target_val_spec_case ?
_refine.pdbx_R_Free_selection_details ?
_refine.pdbx_overall_ESU_R ?
_refine.pdbx_overall_ESU_R_Free ?
_refine.overall_SU_ML ?
_refine.overall_SU_B ?
_refine.pdbx_refine_id 'X-RAY DIFFRACTION'
_refine.pdbx_diffrn_id 1
_refine.pdbx_TLS_residual_ADP_flag ?
_refine.correlation_coeff_Fo_to_Fc ?
_refine.correlation_coeff_Fo_to_Fc_free ?
_refine.pdbx_solvent_vdw_probe_radii ?
_refine.pdbx_solvent_ion_probe_radii ?
_refine.pdbx_solvent_shrinkage_radii ?
_refine.pdbx_overall_phase_error ?
_refine.overall_SU_R_Cruickshank_DPI ?
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ?
_refine.pdbx_overall_SU_R_Blow_DPI ?
_refine.pdbx_overall_SU_R_free_Blow_DPI ?
#
_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION'
_refine_hist.cycle_id LAST
_refine_hist.pdbx_number_atoms_protein 0
_refine_hist.pdbx_number_atoms_nucleic_acid 582
_refine_hist.pdbx_number_atoms_ligand 0
_refine_hist.number_atoms_solvent 91
_refine_hist.number_atoms_total 673
_refine_hist.d_res_high 2.250
_refine_hist.d_res_low 10.000
#
loop_
_refine_ls_restr.type
_refine_ls_restr.dev_ideal
_refine_ls_restr.dev_ideal_target
_refine_ls_restr.weight
_refine_ls_restr.number
_refine_ls_restr.pdbx_refine_id
_refine_ls_restr.pdbx_restraint_function
n_bond_d 0.004 0.010 ? ? 'X-RAY DIFFRACTION' ?
n_angle_d 0.035 0.050 ? ? 'X-RAY DIFFRACTION' ?
n_planar_d ? ? ? ? 'X-RAY DIFFRACTION' ?
n_hb_or_metal_coord ? ? ? ? 'X-RAY DIFFRACTION' ?
n_sugar_bond_it 3.490 7.500 ? ? 'X-RAY DIFFRACTION' ?
n_sugar_angle_it 4.300 7.500 ? ? 'X-RAY DIFFRACTION' ?
n_phos_bond_it 5.020 7.500 ? ? 'X-RAY DIFFRACTION' ?
n_phos_angle_it 4.550 7.500 ? ? 'X-RAY DIFFRACTION' ?
n_bond_angle_restr ? ? ? ? 'X-RAY DIFFRACTION' ?
n_dihedral_angle_restr ? ? ? ? 'X-RAY DIFFRACTION' ?
n_impr_tor ? ? ? ? 'X-RAY DIFFRACTION' ?
n_sugar_bond_d ? ? ? ? 'X-RAY DIFFRACTION' ?
n_sugar_bond_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ?
n_phos_bond_d ? ? ? ? 'X-RAY DIFFRACTION' ?
n_phos_bond_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ?
n_plane_restr 0.017 0.030 ? ? 'X-RAY DIFFRACTION' ?
n_chiral_restr 0.077 0.100 ? ? 'X-RAY DIFFRACTION' ?
n_singtor_nbd 0.139 0.250 ? ? 'X-RAY DIFFRACTION' ?
n_multtor_nbd 0.168 0.250 ? ? 'X-RAY DIFFRACTION' ?
n_xhyhbond_nbd ? ? ? ? 'X-RAY DIFFRACTION' ?
#
_struct.entry_id 1RNA
_struct.title 'CRYSTALLOGRAPHIC STRUCTURE OF AN RNA HELIX: [U(U-A)6A]2'
_struct.pdbx_descriptor "5'-R(*UP*UP*AP*UP*AP*UP*AP*UP*AP*UP*AP*UP*AP*A)-3'"
_struct.pdbx_model_details ?
_struct.pdbx_CASP_flag ?
_struct.pdbx_model_type_details ?
#
_struct_keywords.entry_id 1RNA
_struct_keywords.pdbx_keywords RNA
_struct_keywords.text 'A-RNA, DOUBLE HELIX, RNA'
#
loop_
_struct_asym.id
_struct_asym.pdbx_blank_PDB_chainid_flag
_struct_asym.pdbx_modified
_struct_asym.entity_id
_struct_asym.details
A N N 1 ?
B N N 1 ?
C N N 2 ?
D N N 2 ?
#
_struct_biol.id 1
#
loop_
_struct_conn.id
_struct_conn.conn_type_id
_struct_conn.pdbx_leaving_atom_flag
_struct_conn.pdbx_PDB_id
_struct_conn.ptnr1_label_asym_id
_struct_conn.ptnr1_label_comp_id
_struct_conn.ptnr1_label_seq_id
_struct_conn.ptnr1_label_atom_id
_struct_conn.pdbx_ptnr1_label_alt_id
_struct_conn.pdbx_ptnr1_PDB_ins_code
_struct_conn.pdbx_ptnr1_standard_comp_id
_struct_conn.ptnr1_symmetry
_struct_conn.ptnr2_label_asym_id
_struct_conn.ptnr2_label_comp_id
_struct_conn.ptnr2_label_seq_id
_struct_conn.ptnr2_label_atom_id
_struct_conn.pdbx_ptnr2_label_alt_id
_struct_conn.pdbx_ptnr2_PDB_ins_code
_struct_conn.ptnr1_auth_asym_id
_struct_conn.ptnr1_auth_comp_id
_struct_conn.ptnr1_auth_seq_id
_struct_conn.ptnr2_auth_asym_id
_struct_conn.ptnr2_auth_comp_id
_struct_conn.ptnr2_auth_seq_id
_struct_conn.ptnr2_symmetry
_struct_conn.pdbx_ptnr3_label_atom_id
_struct_conn.pdbx_ptnr3_label_seq_id
_struct_conn.pdbx_ptnr3_label_comp_id
_struct_conn.pdbx_ptnr3_label_asym_id
_struct_conn.pdbx_ptnr3_label_alt_id
_struct_conn.pdbx_ptnr3_PDB_ins_code
_struct_conn.details
_struct_conn.pdbx_dist_value
_struct_conn.pdbx_value_order
hydrog1 hydrog ? ? A U 1 N3 ? ? ? 1_555 B A 14 N1 ? ? A U 1 B A 28 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog2 hydrog ? ? A U 1 O4 ? ? ? 1_555 B A 14 N6 ? ? A U 1 B A 28 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog3 hydrog ? ? A U 2 N3 ? ? ? 1_555 B A 13 N1 ? ? A U 2 B A 27 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog4 hydrog ? ? A U 2 O4 ? ? ? 1_555 B A 13 N6 ? ? A U 2 B A 27 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog5 hydrog ? ? A A 3 N1 ? ? ? 1_555 B U 12 N3 ? ? A A 3 B U 26 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog6 hydrog ? ? A A 3 N6 ? ? ? 1_555 B U 12 O4 ? ? A A 3 B U 26 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog7 hydrog ? ? A U 4 N3 ? ? ? 1_555 B A 11 N1 ? ? A U 4 B A 25 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog8 hydrog ? ? A U 4 O4 ? ? ? 1_555 B A 11 N6 ? ? A U 4 B A 25 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog9 hydrog ? ? A A 5 N1 ? ? ? 1_555 B U 10 N3 ? ? A A 5 B U 24 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog10 hydrog ? ? A A 5 N6 ? ? ? 1_555 B U 10 O4 ? ? A A 5 B U 24 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog11 hydrog ? ? A U 6 N3 ? ? ? 1_555 B A 9 N1 ? ? A U 6 B A 23 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog12 hydrog ? ? A U 6 O4 ? ? ? 1_555 B A 9 N6 ? ? A U 6 B A 23 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog13 hydrog ? ? A A 7 N1 ? ? ? 1_555 B U 8 N3 ? ? A A 7 B U 22 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog14 hydrog ? ? A A 7 N6 ? ? ? 1_555 B U 8 O4 ? ? A A 7 B U 22 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog15 hydrog ? ? A U 8 N3 ? ? ? 1_555 B A 7 N1 ? ? A U 8 B A 21 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog16 hydrog ? ? A U 8 O4 ? ? ? 1_555 B A 7 N6 ? ? A U 8 B A 21 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog17 hydrog ? ? A A 9 N1 ? ? ? 1_555 B U 6 N3 ? ? A A 9 B U 20 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog18 hydrog ? ? A A 9 N6 ? ? ? 1_555 B U 6 O4 ? ? A A 9 B U 20 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog19 hydrog ? ? A U 10 N3 ? ? ? 1_555 B A 5 N1 ? ? A U 10 B A 19 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog20 hydrog ? ? A U 10 O4 ? ? ? 1_555 B A 5 N6 ? ? A U 10 B A 19 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog21 hydrog ? ? A A 11 N1 ? ? ? 1_555 B U 4 N3 ? ? A A 11 B U 18 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog22 hydrog ? ? A A 11 N6 ? ? ? 1_555 B U 4 O4 ? ? A A 11 B U 18 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog23 hydrog ? ? A U 12 N3 ? ? ? 1_555 B A 3 N1 ? ? A U 12 B A 17 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog24 hydrog ? ? A U 12 O4 ? ? ? 1_555 B A 3 N6 ? ? A U 12 B A 17 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog25 hydrog ? ? A A 13 N1 ? ? ? 1_555 B U 2 N3 ? ? A A 13 B U 16 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog26 hydrog ? ? A A 13 N6 ? ? ? 1_555 B U 2 O4 ? ? A A 13 B U 16 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog27 hydrog ? ? A A 14 N1 ? ? ? 1_555 B U 1 N3 ? ? A A 14 B U 15 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
hydrog28 hydrog ? ? A A 14 N6 ? ? ? 1_555 B U 1 O4 ? ? A A 14 B U 15 1_555 ? ? ? ? ? ? WATSON-CRICK ? ?
#
_struct_conn_type.id hydrog
_struct_conn_type.criteria ?
_struct_conn_type.reference ?
#
_database_PDB_matrix.entry_id 1RNA
_database_PDB_matrix.origx[1][1] 1.000000
_database_PDB_matrix.origx[1][2] 0.000000
_database_PDB_matrix.origx[1][3] 0.000000
_database_PDB_matrix.origx[2][1] 0.000000
_database_PDB_matrix.origx[2][2] 1.000000
_database_PDB_matrix.origx[2][3] 0.000000
_database_PDB_matrix.origx[3][1] 0.000000
_database_PDB_matrix.origx[3][2] 0.000000
_database_PDB_matrix.origx[3][3] 1.000000
_database_PDB_matrix.origx_vector[1] 0.00000
_database_PDB_matrix.origx_vector[2] 0.00000
_database_PDB_matrix.origx_vector[3] 0.00000
#
_atom_sites.entry_id 1RNA
_atom_sites.fract_transf_matrix[1][1] 0.029317
_atom_sites.fract_transf_matrix[1][2] 0.000000
_atom_sites.fract_transf_matrix[1][3] 0.000000
_atom_sites.fract_transf_matrix[2][1] 0.000000
_atom_sites.fract_transf_matrix[2][2] 0.022416
_atom_sites.fract_transf_matrix[2][3] 0.000000
_atom_sites.fract_transf_matrix[3][1] 0.000000
_atom_sites.fract_transf_matrix[3][2] 0.000000
_atom_sites.fract_transf_matrix[3][3] 0.020362
_atom_sites.fract_transf_vector[1] 0.00000
_atom_sites.fract_transf_vector[2] 0.00000
_atom_sites.fract_transf_vector[3] 0.00000
#
loop_
_atom_type.symbol
C
N
O
P
#
loop_
_atom_site.group_PDB
_atom_site.id
_atom_site.type_symbol
_atom_site.label_atom_id
_atom_site.label_alt_id
_atom_site.label_comp_id
_atom_site.label_asym_id
_atom_site.label_entity_id
_atom_site.label_seq_id
_atom_site.pdbx_PDB_ins_code
_atom_site.Cartn_x
_atom_site.Cartn_y
_atom_site.Cartn_z
_atom_site.occupancy
_atom_site.B_iso_or_equiv
_atom_site.pdbx_formal_charge
_atom_site.auth_seq_id
_atom_site.auth_comp_id
_atom_site.auth_asym_id
_atom_site.auth_atom_id
_atom_site.pdbx_PDB_model_num
ATOM 1 O "O5'" . U A 1 1 ? 11.161 14.632 23.863 1.00 17.12 ? 1 U A "O5'" 1
ATOM 2 C "C5'" . U A 1 1 ? 10.813 13.651 24.869 1.00 8.66 ? 1 U A "C5'" 1
ATOM 3 C "C4'" . U A 1 1 ? 11.874 12.580 24.909 1.00 11.63 ? 1 U A "C4'" 1
ATOM 4 O "O4'" . U A 1 1 ? 11.106 11.411 25.085 1.00 14.38 ? 1 U A "O4'" 1
ATOM 5 C "C3'" . U A 1 1 ? 12.706 12.330 23.661 1.00 14.98 ? 1 U A "C3'" 1
ATOM 6 O "O3'" . U A 1 1 ? 14.009 12.924 23.592 1.00 16.97 ? 1 U A "O3'" 1
ATOM 7 C "C2'" . U A 1 1 ? 12.986 10.836 23.779 1.00 18.69 ? 1 U A "C2'" 1
ATOM 8 O "O2'" . U A 1 1 ? 14.023 10.733 24.747 1.00 24.74 ? 1 U A "O2'" 1
ATOM 9 C "C1'" . U A 1 1 ? 11.717 10.300 24.398 1.00 12.90 ? 1 U A "C1'" 1
ATOM 10 N N1 . U A 1 1 ? 10.615 9.894 23.499 1.00 15.37 ? 1 U A N1 1
ATOM 11 C C2 . U A 1 1 ? 10.595 8.570 23.101 1.00 10.02 ? 1 U A C2 1
ATOM 12 O O2 . U A 1 1 ? 11.550 7.834 23.347 1.00 13.22 ? 1 U A O2 1
ATOM 13 N N3 . U A 1 1 ? 9.503 8.159 22.394 1.00 7.95 ? 1 U A N3 1
ATOM 14 C C4 . U A 1 1 ? 8.446 8.971 22.114 1.00 9.90 ? 1 U A C4 1
ATOM 15 O O4 . U A 1 1 ? 7.487 8.480 21.456 1.00 11.99 ? 1 U A O4 1
ATOM 16 C C5 . U A 1 1 ? 8.490 10.323 22.566 1.00 7.92 ? 1 U A C5 1
ATOM 17 C C6 . U A 1 1 ? 9.568 10.729 23.254 1.00 11.79 ? 1 U A C6 1
ATOM 18 P P . U A 1 2 ? 14.592 13.271 22.144 1.00 26.17 ? 2 U A P 1
ATOM 19 O OP1 . U A 1 2 ? 15.701 14.244 22.384 1.00 27.75 ? 2 U A OP1 1
ATOM 20 O OP2 . U A 1 2 ? 13.504 13.847 21.279 1.00 19.00 ? 2 U A OP2 1
ATOM 21 O "O5'" . U A 1 2 ? 15.015 11.875 21.540 1.00 20.86 ? 2 U A "O5'" 1
ATOM 22 C "C5'" . U A 1 2 ? 16.141 11.095 22.001 1.00 12.81 ? 2 U A "C5'" 1
ATOM 23 C "C4'" . U A 1 2 ? 16.172 9.894 21.078 1.00 7.93 ? 2 U A "C4'" 1
ATOM 24 O "O4'" . U A 1 2 ? 15.043 9.087 21.324 1.00 8.29 ? 2 U A "O4'" 1
ATOM 25 C "C3'" . U A 1 2 ? 16.093 10.153 19.590 1.00 8.79 ? 2 U A "C3'" 1
ATOM 26 O "O3'" . U A 1 2 ? 17.328 10.483 18.956 1.00 11.62 ? 2 U A "O3'" 1
ATOM 27 C "C2'" . U A 1 2 ? 15.622 8.802 19.069 1.00 8.21 ? 2 U A "C2'" 1
ATOM 28 O "O2'" . U A 1 2 ? 16.779 7.985 19.222 1.00 17.98 ? 2 U A "O2'" 1
ATOM 29 C "C1'" . U A 1 2 ? 14.643 8.373 20.135 1.00 5.41 ? 2 U A "C1'" 1
ATOM 30 N N1 . U A 1 2 ? 13.245 8.739 19.840 1.00 4.77 ? 2 U A N1 1
ATOM 31 C C2 . U A 1 2 ? 12.467 7.700 19.359 1.00 3.38 ? 2 U A C2 1
ATOM 32 O O2 . U A 1 2 ? 12.921 6.584 19.128 1.00 3.49 ? 2 U A O2 1
ATOM 33 N N3 . U A 1 2 ? 11.157 8.003 19.158 1.00 3.13 ? 2 U A N3 1
ATOM 34 C C4 . U A 1 2 ? 10.622 9.234 19.369 1.00 6.12 ? 2 U A C4 1
ATOM 35 O O4 . U A 1 2 ? 9.387 9.288 19.114 1.00 4.25 ? 2 U A O4 1
ATOM 36 C C5 . U A 1 2 ? 11.447 10.287 19.855 1.00 4.68 ? 2 U A C5 1
ATOM 37 C C6 . U A 1 2 ? 12.730 9.975 20.091 1.00 5.55 ? 2 U A C6 1
ATOM 38 P P . A A 1 3 ? 17.215 10.889 17.385 1.00 8.91 ? 3 A A P 1
ATOM 39 O OP1 . A A 1 3 ? 18.566 11.434 17.179 1.00 12.74 ? 3 A A OP1 1
ATOM 40 O OP2 . A A 1 3 ? 16.158 11.947 17.621 1.00 10.83 ? 3 A A OP2 1
ATOM 41 O "O5'" . A A 1 3 ? 16.728 9.587 16.643 1.00 4.43 ? 3 A A "O5'" 1
ATOM 42 C "C5'" . A A 1 3 ? 17.707 8.534 16.457 1.00 9.32 ? 3 A A "C5'" 1
ATOM 43 C "C4'" . A A 1 3 ? 17.007 7.499 15.612 1.00 12.75 ? 3 A A "C4'" 1
ATOM 44 O "O4'" . A A 1 3 ? 15.844 7.071 16.280 1.00 8.90 ? 3 A A "O4'" 1
ATOM 45 C "C3'" . A A 1 3 ? 16.516 7.981 14.257 1.00 14.41 ? 3 A A "C3'" 1
ATOM 46 O "O3'" . A A 1 3 ? 17.505 8.141 13.235 1.00 12.93 ? 3 A A "O3'" 1
ATOM 47 C "C2'" . A A 1 3 ? 15.455 6.928 13.957 1.00 11.47 ? 3 A A "C2'" 1
ATOM 48 O "O2'" . A A 1 3 ? 16.097 5.706 13.638 1.00 25.34 ? 3 A A "O2'" 1
ATOM 49 C "C1'" . A A 1 3 ? 14.834 6.692 15.317 1.00 6.20 ? 3 A A "C1'" 1
ATOM 50 N N9 . A A 1 3 ? 13.613 7.499 15.489 1.00 2.10 ? 3 A A N9 1
ATOM 51 C C8 . A A 1 3 ? 13.559 8.703 16.147 1.00 2.00 ? 3 A A C8 1
ATOM 52 N N7 . A A 1 3 ? 12.351 9.203 16.206 1.00 3.84 ? 3 A A N7 1
ATOM 53 C C5 . A A 1 3 ? 11.560 8.266 15.548 1.00 2.00 ? 3 A A C5 1
ATOM 54 C C6 . A A 1 3 ? 10.168 8.222 15.312 1.00 2.28 ? 3 A A C6 1
ATOM 55 N N6 . A A 1 3 ? 9.288 9.136 15.705 1.00 2.34 ? 3 A A N6 1
ATOM 56 N N1 . A A 1 3 ? 9.735 7.129 14.610 1.00 2.00 ? 3 A A N1 1
ATOM 57 C C2 . A A 1 3 ? 10.581 6.129 14.237 1.00 4.00 ? 3 A A C2 1
ATOM 58 N N3 . A A 1 3 ? 11.891 6.107 14.468 1.00 6.23 ? 3 A A N3 1
ATOM 59 C C4 . A A 1 3 ? 12.324 7.205 15.116 1.00 2.00 ? 3 A A C4 1
ATOM 60 P P . U A 1 4 ? 17.202 9.038 11.914 1.00 2.00 ? 4 U A P 1
ATOM 61 O OP1 . U A 1 4 ? 18.604 8.980 11.305 1.00 9.22 ? 4 U A OP1 1
ATOM 62 O OP2 . U A 1 4 ? 16.816 10.363 12.209 1.00 5.12 ? 4 U A OP2 1
ATOM 63 O "O5'" . U A 1 4 ? 16.165 8.266 11.143 1.00 10.36 ? 4 U A "O5'" 1
ATOM 64 C "C5'" . U A 1 4 ? 16.172 6.919 10.618 1.00 10.19 ? 4 U A "C5'" 1
ATOM 65 C "C4'" . U A 1 4 ? 14.790 6.558 10.131 1.00 9.61 ? 4 U A "C4'" 1
ATOM 66 O "O4'" . U A 1 4 ? 13.903 6.602 11.227 1.00 6.89 ? 4 U A "O4'" 1
ATOM 67 C "C3'" . U A 1 4 ? 14.091 7.423 9.095 1.00 8.26 ? 4 U A "C3'" 1
ATOM 68 O "O3'" . U A 1 4 ? 14.381 7.231 7.710 1.00 11.09 ? 4 U A "O3'" 1
ATOM 69 C "C2'" . U A 1 4 ? 12.658 6.955 9.282 1.00 9.03 ? 4 U A "C2'" 1
ATOM 70 O "O2'" . U A 1 4 ? 12.713 5.572 8.933 1.00 15.88 ? 4 U A "O2'" 1
ATOM 71 C "C1'" . U A 1 4 ? 12.552 6.852 10.780 1.00 5.76 ? 4 U A "C1'" 1
ATOM 72 N N1 . U A 1 4 ? 12.014 8.083 11.394 1.00 2.00 ? 4 U A N1 1
ATOM 73 C C2 . U A 1 4 ? 10.649 8.065 11.619 1.00 4.92 ? 4 U A C2 1
ATOM 74 O O2 . U A 1 4 ? 9.946 7.142 11.212 1.00 9.92 ? 4 U A O2 1
ATOM 75 N N3 . U A 1 4 ? 10.124 9.136 12.282 1.00 6.09 ? 4 U A N3 1
ATOM 76 C C4 . U A 1 4 ? 10.878 10.180 12.729 1.00 2.92 ? 4 U A C4 1
ATOM 77 O O4 . U A 1 4 ? 10.257 11.099 13.328 1.00 2.00 ? 4 U A O4 1
ATOM 78 C C5 . U A 1 4 ? 12.276 10.162 12.479 1.00 4.04 ? 4 U A C5 1
ATOM 79 C C6 . U A 1 4 ? 12.791 9.100 11.840 1.00 2.00 ? 4 U A C6 1
ATOM 80 P P . A A 1 5 ? 14.026 8.320 6.654 1.00 8.18 ? 5 A A P 1
ATOM 81 O OP1 . A A 1 5 ? 15.025 8.106 5.594 1.00 10.00 ? 5 A A OP1 1
ATOM 82 O OP2 . A A 1 5 ? 14.275 9.582 7.425 1.00 11.16 ? 5 A A OP2 1
ATOM 83 O "O5'" . A A 1 5 ? 12.590 8.146 6.178 1.00 13.16 ? 5 A A "O5'" 1
ATOM 84 C "C5'" . A A 1 5 ? 11.973 7.124 5.343 1.00 14.44 ? 5 A A "C5'" 1
ATOM 85 C "C4'" . A A 1 5 ? 10.472 7.271 5.432 1.00 12.02 ? 5 A A "C4'" 1
ATOM 86 O "O4'" . A A 1 5 ? 10.086 7.410 6.777 1.00 13.65 ? 5 A A "O4'" 1
ATOM 87 C "C3'" . A A 1 5 ? 9.878 8.498 4.769 1.00 13.59 ? 5 A A "C3'" 1
ATOM 88 O "O3'" . A A 1 5 ? 9.817 8.405 3.339 1.00 18.15 ? 5 A A "O3'" 1
ATOM 89 C "C2'" . A A 1 5 ? 8.531 8.641 5.466 1.00 11.90 ? 5 A A "C2'" 1
ATOM 90 O "O2'" . A A 1 5 ? 7.661 7.651 4.945 1.00 15.10 ? 5 A A "O2'" 1
ATOM 91 C "C1'" . A A 1 5 ? 8.910 8.235 6.875 1.00 8.89 ? 5 A A "C1'" 1
ATOM 92 N N9 . A A 1 5 ? 9.165 9.373 7.784 1.00 3.67 ? 5 A A N9 1
ATOM 93 C C8 . A A 1 5 ? 10.329 9.872 8.309 1.00 2.00 ? 5 A A C8 1
ATOM 94 N N7 . A A 1 5 ? 10.151 10.871 9.134 1.00 2.58 ? 5 A A N7 1
ATOM 95 C C5 . A A 1 5 ? 8.766 11.032 9.159 1.00 2.00 ? 5 A A C5 1
ATOM 96 C C6 . A A 1 5 ? 7.934 11.960 9.832 1.00 4.93 ? 5 A A C6 1
ATOM 97 N N6 . A A 1 5 ? 8.435 12.883 10.647 1.00 5.39 ? 5 A A N6 1
ATOM 98 N N1 . A A 1 5 ? 6.593 11.822 9.562 1.00 6.86 ? 5 A A N1 1
ATOM 99 C C2 . A A 1 5 ? 6.119 10.876 8.702 1.00 7.98 ? 5 A A C2 1
ATOM 100 N N3 . A A 1 5 ? 6.842 9.984 8.034 1.00 2.26 ? 5 A A N3 1
ATOM 101 C C4 . A A 1 5 ? 8.149 10.126 8.324 1.00 2.00 ? 5 A A C4 1
ATOM 102 P P . U A 1 6 ? 10.158 9.828 2.573 1.00 14.24 ? 6 U A P 1
ATOM 103 O OP1 . U A 1 6 ? 10.247 9.252 1.193 1.00 20.60 ? 6 U A OP1 1
ATOM 104 O OP2 . U A 1 6 ? 11.447 10.381 3.163 1.00 7.32 ? 6 U A OP2 1
ATOM 105 O "O5'" . U A 1 6 ? 8.814 10.590 2.912 1.00 10.58 ? 6 U A "O5'" 1
ATOM 106 C "C5'" . U A 1 6 ? 7.647 9.948 2.338 1.00 6.13 ? 6 U A "C5'" 1
ATOM 107 C "C4'" . U A 1 6 ? 6.433 10.764 2.711 1.00 6.66 ? 6 U A "C4'" 1
ATOM 108 O "O4'" . U A 1 6 ? 6.314 10.720 4.111 1.00 9.50 ? 6 U A "O4'" 1
ATOM 109 C "C3'" . U A 1 6 ? 6.477 12.250 2.397 1.00 11.43 ? 6 U A "C3'" 1
ATOM 110 O "O3'" . U A 1 6 ? 6.194 12.634 1.051 1.00 17.03 ? 6 U A "O3'" 1
ATOM 111 C "C2'" . U A 1 6 ? 5.461 12.799 3.394 1.00 10.37 ? 6 U A "C2'" 1
ATOM 112 O "O2'" . U A 1 6 ? 4.178 12.455 2.883 1.00 12.27 ? 6 U A "O2'" 1
ATOM 113 C "C1'" . U A 1 6 ? 5.730 11.942 4.611 1.00 5.76 ? 6 U A "C1'" 1
ATOM 114 N N1 . U A 1 6 ? 6.696 12.607 5.505 1.00 3.44 ? 6 U A N1 1
ATOM 115 C C2 . U A 1 6 ? 6.239 13.495 6.458 1.00 4.19 ? 6 U A C2 1
ATOM 116 O O2 . U A 1 6 ? 5.065 13.793 6.625 1.00 11.90 ? 6 U A O2 1
ATOM 117 N N3 . U A 1 6 ? 7.170 14.061 7.278 1.00 6.64 ? 6 U A N3 1
ATOM 118 C C4 . U A 1 6 ? 8.507 13.820 7.150 1.00 11.12 ? 6 U A C4 1
ATOM 119 O O4 . U A 1 6 ? 9.230 14.440 7.985 1.00 9.54 ? 6 U A O4 1
ATOM 120 C C5 . U A 1 6 ? 8.964 12.919 6.149 1.00 3.72 ? 6 U A C5 1
ATOM 121 C C6 . U A 1 6 ? 8.026 12.344 5.382 1.00 6.86 ? 6 U A C6 1
ATOM 122 P P . A A 1 7 ? 6.866 14.003 0.471 1.00 20.60 ? 7 A A P 1
ATOM 123 O OP1 . A A 1 7 ? 6.379 14.378 -0.899 1.00 22.46 ? 7 A A OP1 1
ATOM 124 O OP2 . A A 1 7 ? 8.302 13.767 0.643 1.00 21.33 ? 7 A A OP2 1
ATOM 125 O "O5'" . A A 1 7 ? 6.024 14.962 1.478 1.00 23.19 ? 7 A A "O5'" 1
ATOM 126 C "C5'" . A A 1 7 ? 4.687 15.047 0.909 1.00 18.73 ? 7 A A "C5'" 1
ATOM 127 C "C4'" . A A 1 7 ? 4.032 16.158 1.699 1.00 21.65 ? 7 A A "C4'" 1
ATOM 128 O "O4'" . A A 1 7 ? 4.059 15.854 3.074 1.00 20.61 ? 7 A A "O4'" 1
ATOM 129 C "C3'" . A A 1 7 ? 4.728 17.505 1.576 1.00 20.09 ? 7 A A "C3'" 1
ATOM 130 O "O3'" . A A 1 7 ? 4.472 18.210 0.359 1.00 21.43 ? 7 A A "O3'" 1
ATOM 131 C "C2'" . A A 1 7 ? 4.206 18.219 2.819 1.00 18.59 ? 7 A A "C2'" 1
ATOM 132 O "O2'" . A A 1 7 ? 2.903 18.634 2.426 1.00 10.44 ? 7 A A "O2'" 1
ATOM 133 C "C1'" . A A 1 7 ? 4.196 17.077 3.821 1.00 14.22 ? 7 A A "C1'" 1
ATOM 134 N N9 . A A 1 7 ? 5.516 17.059 4.494 1.00 9.74 ? 7 A A N9 1
ATOM 135 C C8 . A A 1 7 ? 6.655 16.394 4.115 1.00 6.03 ? 7 A A C8 1
ATOM 136 N N7 . A A 1 7 ? 7.685 16.604 4.896 1.00 4.54 ? 7 A A N7 1
ATOM 137 C C5 . A A 1 7 ? 7.180 17.447 5.878 1.00 12.99 ? 7 A A C5 1
ATOM 138 C C6 . A A 1 7 ? 7.777 18.072 6.998 1.00 11.92 ? 7 A A C6 1
ATOM 139 N N6 . A A 1 7 ? 9.032 17.924 7.416 1.00 13.19 ? 7 A A N6 1
ATOM 140 N N1 . A A 1 7 ? 6.955 18.897 7.720 1.00 8.63 ? 7 A A N1 1
ATOM 141 C C2 . A A 1 7 ? 5.655 19.089 7.381 1.00 12.17 ? 7 A A C2 1
ATOM 142 N N3 . A A 1 7 ? 5.028 18.527 6.355 1.00 13.89 ? 7 A A N3 1
ATOM 143 C C4 . A A 1 7 ? 5.857 17.737 5.638 1.00 10.72 ? 7 A A C4 1
ATOM 144 P P . U A 1 8 ? 5.369 19.312 -0.216 1.00 22.44 ? 8 U A P 1
ATOM 145 O OP1 . U A 1 8 ? 4.956 19.860 -1.503 1.00 27.17 ? 8 U A OP1 1
ATOM 146 O OP2 . U A 1 8 ? 6.842 19.048 -0.113 1.00 26.01 ? 8 U A OP2 1
ATOM 147 O "O5'" . U A 1 8 ? 4.932 20.382 0.948 1.00 23.45 ? 8 U A "O5'" 1
ATOM 148 C "C5'" . U A 1 8 ? 3.721 21.145 0.712 1.00 15.82 ? 8 U A "C5'" 1
ATOM 149 C "C4'" . U A 1 8 ? 3.858 22.247 1.743 1.00 17.65 ? 8 U A "C4'" 1
ATOM 150 O "O4'" . U A 1 8 ? 4.138 21.636 2.981 1.00 15.70 ? 8 U A "O4'" 1
ATOM 151 C "C3'" . U A 1 8 ? 4.997 23.228 1.552 1.00 13.92 ? 8 U A "C3'" 1
ATOM 152 O "O3'" . U A 1 8 ? 4.758 24.339 0.688 1.00 16.39 ? 8 U A "O3'" 1
ATOM 153 C "C2'" . U A 1 8 ? 5.209 23.737 2.976 1.00 14.81 ? 8 U A "C2'" 1
ATOM 154 O "O2'" . U A 1 8 ? 4.138 24.647 3.163 1.00 20.27 ? 8 U A "O2'" 1
ATOM 155 C "C1'" . U A 1 8 ? 4.960 22.492 3.801 1.00 13.16 ? 8 U A "C1'" 1
ATOM 156 N N1 . U A 1 8 ? 6.222 21.814 4.165 1.00 10.07 ? 8 U A N1 1
ATOM 157 C C2 . U A 1 8 ? 6.839 22.122 5.368 1.00 10.29 ? 8 U A C2 1
ATOM 158 O O2 . U A 1 8 ? 6.396 22.974 6.134 1.00 11.85 ? 8 U A O2 1
ATOM 159 N N3 . U A 1 8 ? 8.002 21.457 5.648 1.00 12.02 ? 8 U A N3 1
ATOM 160 C C4 . U A 1 8 ? 8.534 20.507 4.832 1.00 7.21 ? 8 U A C4 1
ATOM 161 O O4 . U A 1 8 ? 9.622 19.950 5.147 1.00 6.30 ? 8 U A O4 1
ATOM 162 C C5 . U A 1 8 ? 7.838 20.182 3.634 1.00 7.76 ? 8 U A C5 1
ATOM 163 C C6 . U A 1 8 ? 6.703 20.837 3.349 1.00 10.29 ? 8 U A C6 1
ATOM 164 P P . A A 1 9 ? 6.205 24.843 0.103 1.00 16.80 ? 9 A A P 1
ATOM 165 O OP1 . A A 1 9 ? 5.979 25.602 -1.149 1.00 22.48 ? 9 A A OP1 1
ATOM 166 O OP2 . A A 1 9 ? 6.914 23.594 -0.138 1.00 24.77 ? 9 A A OP2 1
ATOM 167 O "O5'" . A A 1 9 ? 6.784 25.709 1.238 1.00 19.82 ? 9 A A "O5'" 1
ATOM 168 C "C5'" . A A 1 9 ? 5.983 26.730 1.886 1.00 14.47 ? 9 A A "C5'" 1
ATOM 169 C "C4'" . A A 1 9 ? 6.996 27.359 2.819 1.00 16.27 ? 9 A A "C4'" 1
ATOM 170 O "O4'" . A A 1 9 ? 7.207 26.467 3.894 1.00 18.90 ? 9 A A "O4'" 1
ATOM 171 C "C3'" . A A 1 9 ? 8.377 27.605 2.225 1.00 16.08 ? 9 A A "C3'" 1
ATOM 172 O "O3'" . A A 1 9 ? 8.473 28.769 1.400 1.00 11.57 ? 9 A A "O3'" 1
ATOM 173 C "C2'" . A A 1 9 ? 9.254 27.631 3.472 1.00 15.91 ? 9 A A "C2'" 1
ATOM 174 O "O2'" . A A 1 9 ? 9.193 28.894 4.125 1.00 12.64 ? 9 A A "O2'" 1
ATOM 175 C "C1'" . A A 1 9 ? 8.575 26.579 4.341 1.00 13.28 ? 9 A A "C1'" 1
ATOM 176 N N9 . A A 1 9 ? 9.350 25.321 4.204 1.00 6.23 ? 9 A A N9 1
ATOM 177 C C8 . A A 1 9 ? 9.210 24.353 3.246 1.00 5.10 ? 9 A A C8 1
ATOM 178 N N7 . A A 1 9 ? 10.066 23.376 3.379 1.00 7.76 ? 9 A A N7 1
ATOM 179 C C5 . A A 1 9 ? 10.844 23.724 4.479 1.00 4.57 ? 9 A A C5 1
ATOM 180 C C6 . A A 1 9 ? 11.939 23.090 5.112 1.00 6.81 ? 9 A A C6 1
ATOM 181 N N6 . A A 1 9 ? 12.450 21.912 4.759 1.00 6.76 ? 9 A A N6 1
ATOM 182 N N1 . A A 1 9 ? 12.443 23.773 6.188 1.00 2.72 ? 9 A A N1 1
ATOM 183 C C2 . A A 1 9 ? 11.915 24.950 6.615 1.00 5.94 ? 9 A A C2 1
ATOM 184 N N3 . A A 1 9 ? 10.895 25.588 6.050 1.00 4.94 ? 9 A A N3 1
ATOM 185 C C4 . A A 1 9 ? 10.400 24.919 4.994 1.00 2.57 ? 9 A A C4 1
ATOM 186 P P . U A 1 10 ? 9.592 29.220 0.530 1.00 12.72 ? 10 U A P 1
ATOM 187 O OP1 . U A 1 10 ? 9.462 30.446 -0.339 1.00 17.21 ? 10 U A OP1 1
ATOM 188 O OP2 . U A 1 10 ? 9.899 28.082 -0.383 1.00 14.19 ? 10 U A OP2 1
ATOM 189 O "O5'" . U A 1 10 ? 10.956 29.496 1.346 1.00 12.40 ? 10 U A "O5'" 1
ATOM 190 C "C5'" . U A 1 10 ? 11.198 30.571 2.284 1.00 7.71 ? 10 U A "C5'" 1
ATOM 191 C "C4'" . U A 1 10 ? 12.440 30.317 3.109 1.00 6.39 ? 10 U A "C4'" 1
ATOM 192 O "O4'" . U A 1 10 ? 12.331 29.144 3.885 1.00 6.98 ? 10 U A "O4'" 1
ATOM 193 C "C3'" . U A 1 10 ? 13.743 30.161 2.338 1.00 5.17 ? 10 U A "C3'" 1
ATOM 194 O "O3'" . U A 1 10 ? 14.299 31.419 1.940 1.00 10.03 ? 10 U A "O3'" 1
ATOM 195 C "C2'" . U A 1 10 ? 14.647 29.452 3.330 1.00 5.06 ? 10 U A "C2'" 1
ATOM 196 O "O2'" . U A 1 10 ? 15.203 30.500 4.111 1.00 5.32 ? 10 U A "O2'" 1
ATOM 197 C "C1'" . U A 1 10 ? 13.647 28.582 4.076 1.00 7.34 ? 10 U A "C1'" 1
ATOM 198 N N1 . U A 1 10 ? 13.627 27.199 3.556 1.00 7.85 ? 10 U A N1 1
ATOM 199 C C2 . U A 1 10 ? 14.514 26.280 4.091 1.00 6.20 ? 10 U A C2 1
ATOM 200 O O2 . U A 1 10 ? 15.322 26.601 4.960 1.00 7.64 ? 10 U A O2 1
ATOM 201 N N3 . U A 1 10 ? 14.418 25.031 3.551 1.00 5.95 ? 10 U A N3 1
ATOM 202 C C4 . U A 1 10 ? 13.542 24.678 2.573 1.00 2.00 ? 10 U A C4 1
ATOM 203 O O4 . U A 1 10 ? 13.552 23.501 2.141 1.00 2.00 ? 10 U A O4 1
ATOM 204 C C5 . U A 1 10 ? 12.614 25.637 2.077 1.00 3.51 ? 10 U A C5 1
ATOM 205 C C6 . U A 1 10 ? 12.706 26.864 2.613 1.00 6.67 ? 10 U A C6 1
ATOM 206 P P . A A 1 11 ? 14.879 31.642 0.437 1.00 20.17 ? 11 A A P 1
ATOM 207 O OP1 . A A 1 11 ? 15.087 33.105 0.413 1.00 19.84 ? 11 A A OP1 1
ATOM 208 O OP2 . A A 1 11 ? 13.975 31.165 -0.604 1.00 11.94 ? 11 A A OP2 1
ATOM 209 O "O5'" . A A 1 11 ? 16.131 30.736 0.579 1.00 14.92 ? 11 A A "O5'" 1
ATOM 210 C "C5'" . A A 1 11 ? 16.915 30.027 -0.422 1.00 12.49 ? 11 A A "C5'" 1
ATOM 211 C "C4'" . A A 1 11 ? 17.949 29.456 0.525 1.00 5.50 ? 11 A A "C4'" 1
ATOM 212 O "O4'" . A A 1 11 ? 17.133 28.657 1.355 1.00 10.23 ? 11 A A "O4'" 1
ATOM 213 C "C3'" . A A 1 11 ? 19.061 28.550 0.039 1.00 10.89 ? 11 A A "C3'" 1
ATOM 214 O "O3'" . A A 1 11 ? 20.241 29.246 -0.373 1.00 9.86 ? 11 A A "O3'" 1
ATOM 215 C "C2'" . A A 1 11 ? 19.357 27.685 1.262 1.00 3.49 ? 11 A A "C2'" 1
ATOM 216 O "O2'" . A A 1 11 ? 20.173 28.515 2.072 1.00 9.82 ? 11 A A "O2'" 1
ATOM 217 C "C1'" . A A 1 11 ? 17.952 27.565 1.822 1.00 9.43 ? 11 A A "C1'" 1
ATOM 218 N N9 . A A 1 11 ? 17.304 26.351 1.287 1.00 7.58 ? 11 A A N9 1
ATOM 219 C C8 . A A 1 11 ? 16.144 26.333 0.555 1.00 6.75 ? 11 A A C8 1
ATOM 220 N N7 . A A 1 11 ? 15.803 25.111 0.241 1.00 6.84 ? 11 A A N7 1
ATOM 221 C C5 . A A 1 11 ? 16.796 24.299 0.791 1.00 8.52 ? 11 A A C5 1
ATOM 222 C C6 . A A 1 11 ? 16.987 22.889 0.786 1.00 7.16 ? 11 A A C6 1
ATOM 223 N N6 . A A 1 11 ? 16.151 22.055 0.177 1.00 10.40 ? 11 A A N6 1
ATOM 224 N N1 . A A 1 11 ? 18.116 22.470 1.429 1.00 6.14 ? 11 A A N1 1
ATOM 225 C C2 . A A 1 11 ? 18.938 23.349 2.063 1.00 10.66 ? 11 A A C2 1
ATOM 226 N N3 . A A 1 11 ? 18.839 24.674 2.112 1.00 8.83 ? 11 A A N3 1
ATOM 227 C C4 . A A 1 11 ? 17.741 25.062 1.434 1.00 6.83 ? 11 A A C4 1
ATOM 228 P P . U A 1 12 ? 20.701 29.211 -1.910 1.00 10.35 ? 12 U A P 1
ATOM 229 O OP1 . U A 1 12 ? 21.247 30.647 -2.156 1.00 13.15 ? 12 U A OP1 1
ATOM 230 O OP2 . U A 1 12 ? 19.613 28.765 -2.814 1.00 8.99 ? 12 U A OP2 1
ATOM 231 O "O5'" . U A 1 12 ? 21.905 28.158 -1.910 1.00 11.58 ? 12 U A "O5'" 1
ATOM 232 C "C5'" . U A 1 12 ? 23.062 28.399 -1.071 1.00 11.63 ? 12 U A "C5'" 1
ATOM 233 C "C4'" . U A 1 12 ? 23.403 27.034 -0.521 1.00 13.09 ? 12 U A "C4'" 1
ATOM 234 O "O4'" . U A 1 12 ? 22.253 26.476 0.069 1.00 12.73 ? 12 U A "O4'" 1
ATOM 235 C "C3'" . U A 1 12 ? 23.839 25.999 -1.537 1.00 13.56 ? 12 U A "C3'" 1
ATOM 236 O "O3'" . U A 1 12 ? 25.183 26.124 -2.004 1.00 12.28 ? 12 U A "O3'" 1
ATOM 237 C "C2'" . U A 1 12 ? 23.577 24.714 -0.776 1.00 12.13 ? 12 U A "C2'" 1
ATOM 238 O "O2'" . U A 1 12 ? 24.569 24.647 0.236 1.00 14.53 ? 12 U A "O2'" 1
ATOM 239 C "C1'" . U A 1 12 ? 22.284 25.040 -0.059 1.00 9.61 ? 12 U A "C1'" 1
ATOM 240 N N1 . U A 1 12 ? 21.131 24.509 -0.820 1.00 9.82 ? 12 U A N1 1
ATOM 241 C C2 . U A 1 12 ? 20.967 23.135 -0.796 1.00 5.32 ? 12 U A C2 1
ATOM 242 O O2 . U A 1 12 ? 21.827 22.475 -0.206 1.00 8.34 ? 12 U A O2 1
ATOM 243 N N3 . U A 1 12 ? 19.869 22.635 -1.434 1.00 3.38 ? 12 U A N3 1
ATOM 244 C C4 . U A 1 12 ? 18.948 23.411 -2.068 1.00 2.46 ? 12 U A C4 1
ATOM 245 O O4 . U A 1 12 ? 17.959 22.872 -2.627 1.00 2.31 ? 12 U A O4 1
ATOM 246 C C5 . U A 1 12 ? 19.119 24.825 -2.053 1.00 5.84 ? 12 U A C5 1
ATOM 247 C C6 . U A 1 12 ? 20.207 25.303 -1.429 1.00 6.82 ? 12 U A C6 1
ATOM 248 P P . A A 1 13 ? 25.415 25.959 -3.590 1.00 14.08 ? 13 A A P 1
ATOM 249 O OP1 . A A 1 13 ? 26.701 26.641 -4.076 1.00 15.23 ? 13 A A OP1 1
ATOM 250 O OP2 . A A 1 13 ? 24.215 26.423 -4.273 1.00 9.92 ? 13 A A OP2 1
ATOM 251 O "O5'" . A A 1 13 ? 25.675 24.344 -3.541 1.00 13.46 ? 13 A A "O5'" 1
ATOM 252 C "C5'" . A A 1 13 ? 26.463 23.599 -2.578 1.00 2.00 ? 13 A A "C5'" 1
ATOM 253 C "C4'" . A A 1 13 ? 26.381 22.113 -2.873 1.00 8.41 ? 13 A A "C4'" 1
ATOM 254 O "O4'" . A A 1 13 ? 25.129 21.712 -2.372 1.00 12.28 ? 13 A A "O4'" 1
ATOM 255 C "C3'" . A A 1 13 ? 26.347 21.614 -4.307 1.00 5.18 ? 13 A A "C3'" 1
ATOM 256 O "O3'" . A A 1 13 ? 27.605 21.270 -4.896 1.00 8.02 ? 13 A A "O3'" 1
ATOM 257 C "C2'" . A A 1 13 ? 25.583 20.293 -4.209 1.00 13.26 ? 13 A A "C2'" 1
ATOM 258 O "O2'" . A A 1 13 ? 26.476 19.294 -3.767 1.00 17.22 ? 13 A A "O2'" 1
ATOM 259 C "C1'" . A A 1 13 ? 24.580 20.614 -3.133 1.00 9.87 ? 13 A A "C1'" 1
ATOM 260 N N9 . A A 1 13 ? 23.263 21.038 -3.649 1.00 8.62 ? 13 A A N9 1
ATOM 261 C C8 . A A 1 13 ? 22.789 22.323 -3.747 1.00 5.17 ? 13 A A C8 1
ATOM 262 N N7 . A A 1 13 ? 21.564 22.376 -4.199 1.00 10.43 ? 13 A A N7 1
ATOM 263 C C5 . A A 1 13 ? 21.196 21.047 -4.376 1.00 4.34 ? 13 A A C5 1
ATOM 264 C C6 . A A 1 13 ? 19.999 20.458 -4.837 1.00 2.33 ? 13 A A C6 1
ATOM 265 N N6 . A A 1 13 ? 18.904 21.127 -5.196 1.00 11.60 ? 13 A A N6 1
ATOM 266 N N1 . A A 1 13 ? 20.036 19.093 -4.901 1.00 10.52 ? 13 A A N1 1
ATOM 267 C C2 . A A 1 13 ? 21.131 18.361 -4.557 1.00 8.47 ? 13 A A C2 1
ATOM 268 N N3 . A A 1 13 ? 22.287 18.866 -4.130 1.00 11.79 ? 13 A A N3 1
ATOM 269 C C4 . A A 1 13 ? 22.240 20.213 -4.047 1.00 6.77 ? 13 A A C4 1
ATOM 270 P P . A A 1 14 ? 27.769 21.738 -6.433 1.00 9.14 ? 14 A A P 1
ATOM 271 O OP1 . A A 1 14 ? 29.225 21.667 -6.645 1.00 17.21 ? 14 A A OP1 1
ATOM 272 O OP2 . A A 1 14 ? 27.032 22.992 -6.404 1.00 11.64 ? 14 A A OP2 1
ATOM 273 O "O5'" . A A 1 14 ? 27.141 20.534 -7.258 1.00 14.31 ? 14 A A "O5'" 1
ATOM 274 C "C5'" . A A 1 14 ? 27.656 19.196 -7.062 1.00 8.19 ? 14 A A "C5'" 1
ATOM 275 C "C4'" . A A 1 14 ? 26.643 18.272 -7.696 1.00 9.84 ? 14 A A "C4'" 1
ATOM 276 O "O4'" . A A 1 14 ? 25.405 18.344 -7.028 1.00 7.88 ? 14 A A "O4'" 1
ATOM 277 C "C3'" . A A 1 14 ? 26.292 18.522 -9.154 1.00 3.98 ? 14 A A "C3'" 1
ATOM 278 O "O3'" . A A 1 14 ? 27.319 18.089 -10.043 1.00 12.62 ? 14 A A "O3'" 1
ATOM 279 C "C2'" . A A 1 14 ? 24.979 17.755 -9.238 1.00 4.86 ? 14 A A "C2'" 1
ATOM 280 O "O2'" . A A 1 14 ? 25.385 16.394 -9.326 1.00 2.00 ? 14 A A "O2'" 1
ATOM 281 C "C1'" . A A 1 14 ? 24.307 18.022 -7.907 1.00 2.14 ? 14 A A "C1'" 1
ATOM 282 N N9 . A A 1 14 ? 23.311 19.111 -7.921 1.00 3.95 ? 14 A A N9 1
ATOM 283 C C8 . A A 1 14 ? 23.481 20.454 -7.720 1.00 2.22 ? 14 A A C8 1
ATOM 284 N N7 . A A 1 14 ? 22.383 21.159 -7.843 1.00 6.16 ? 14 A A N7 1
ATOM 285 C C5 . A A 1 14 ? 21.394 20.208 -8.088 1.00 4.33 ? 14 A A C5 1
ATOM 286 C C6 . A A 1 14 ? 20.002 20.311 -8.309 1.00 8.14 ? 14 A A C6 1
ATOM 287 N N6 . A A 1 14 ? 19.272 21.426 -8.309 1.00 16.01 ? 14 A A N6 1
ATOM 288 N N1 . A A 1 14 ? 19.327 19.142 -8.540 1.00 8.87 ? 14 A A N1 1
ATOM 289 C C2 . A A 1 14 ? 19.988 17.956 -8.575 1.00 6.82 ? 14 A A C2 1
ATOM 290 N N3 . A A 1 14 ? 21.298 17.804 -8.403 1.00 4.22 ? 14 A A N3 1
ATOM 291 C C4 . A A 1 14 ? 21.957 18.950 -8.147 1.00 5.89 ? 14 A A C4 1
ATOM 292 O "O5'" . U B 1 1 ? 11.239 17.741 -7.971 1.00 28.59 ? 15 U B "O5'" 1
ATOM 293 C "C5'" . U B 1 1 ? 10.714 16.769 -8.904 1.00 32.81 ? 15 U B "C5'" 1
ATOM 294 C "C4'" . U B 1 1 ? 11.870 16.211 -9.699 1.00 30.58 ? 15 U B "C4'" 1
ATOM 295 O "O4'" . U B 1 1 ? 12.498 17.242 -10.426 1.00 33.03 ? 15 U B "O4'" 1
ATOM 296 C "C3'" . U B 1 1 ? 12.999 15.631 -8.864 1.00 30.76 ? 15 U B "C3'" 1
ATOM 297 O "O3'" . U B 1 1 ? 12.713 14.275 -8.511 1.00 33.25 ? 15 U B "O3'" 1
ATOM 298 C "C2'" . U B 1 1 ? 14.234 15.716 -9.758 1.00 29.76 ? 15 U B "C2'" 1
ATOM 299 O "O2'" . U B 1 1 ? 14.238 14.574 -10.603 1.00 31.01 ? 15 U B "O2'" 1
ATOM 300 C "C1'" . U B 1 1 ? 13.917 16.996 -10.495 1.00 27.02 ? 15 U B "C1'" 1
ATOM 301 N N1 . U B 1 1 ? 14.568 18.121 -9.788 1.00 27.20 ? 15 U B N1 1
ATOM 302 C C2 . U B 1 1 ? 15.885 17.951 -9.400 1.00 26.26 ? 15 U B C2 1
ATOM 303 O O2 . U B 1 1 ? 16.448 16.894 -9.665 1.00 22.96 ? 15 U B O2 1
ATOM 304 N N3 . U B 1 1 ? 16.461 19.004 -8.746 1.00 26.41 ? 15 U B N3 1
ATOM 305 C C4 . U B 1 1 ? 15.800 20.164 -8.476 1.00 25.30 ? 15 U B C4 1
ATOM 306 O O4 . U B 1 1 ? 16.414 21.096 -7.882 1.00 25.06 ? 15 U B O4 1
ATOM 307 C C5 . U B 1 1 ? 14.439 20.298 -8.874 1.00 27.70 ? 15 U B C5 1
ATOM 308 C C6 . U B 1 1 ? 13.873 19.258 -9.508 1.00 27.07 ? 15 U B C6 1
ATOM 309 P P . U B 1 2 ? 12.020 14.052 -7.052 1.00 40.23 ? 16 U B P 1
ATOM 310 O OP1 . U B 1 2 ? 10.939 13.017 -7.258 1.00 35.49 ? 16 U B OP1 1
ATOM 311 O OP2 . U B 1 2 ? 11.434 15.390 -6.733 1.00 40.52 ? 16 U B OP2 1
ATOM 312 O "O5'" . U B 1 2 ? 13.409 13.704 -6.276 1.00 31.34 ? 16 U B "O5'" 1
ATOM 313 C "C5'" . U B 1 2 ? 14.118 12.607 -6.900 1.00 29.97 ? 16 U B "C5'" 1
ATOM 314 C "C4'" . U B 1 2 ? 15.616 12.669 -6.738 1.00 22.88 ? 16 U B "C4'" 1
ATOM 315 O "O4'" . U B 1 2 ? 16.069 13.793 -7.450 1.00 20.99 ? 16 U B "O4'" 1
ATOM 316 C "C3'" . U B 1 2 ? 16.172 12.879 -5.338 1.00 24.36 ? 16 U B "C3'" 1
ATOM 317 O "O3'" . U B 1 2 ? 16.284 11.715 -4.513 1.00 26.03 ? 16 U B "O3'" 1
ATOM 318 C "C2'" . U B 1 2 ? 17.553 13.486 -5.584 1.00 25.77 ? 16 U B "C2'" 1
ATOM 319 O "O2'" . U B 1 2 ? 18.488 12.451 -5.844 1.00 31.95 ? 16 U B "O2'" 1
ATOM 320 C "C1'" . U B 1 2 ? 17.236 14.338 -6.802 1.00 19.70 ? 16 U B "C1'" 1
ATOM 321 N N1 . U B 1 2 ? 16.908 15.725 -6.424 1.00 13.08 ? 16 U B N1 1
ATOM 322 C C2 . U B 1 2 ? 17.990 16.568 -6.252 1.00 17.74 ? 16 U B C2 1
ATOM 323 O O2 . U B 1 2 ? 19.139 16.144 -6.370 1.00 22.86 ? 16 U B O2 1
ATOM 324 N N3 . U B 1 2 ? 17.717 17.866 -5.928 1.00 15.68 ? 16 U B N3 1
ATOM 325 C C4 . U B 1 2 ? 16.455 18.353 -5.785 1.00 15.08 ? 16 U B C4 1
ATOM 326 O O4 . U B 1 2 ? 16.404 19.579 -5.481 1.00 19.22 ? 16 U B O4 1
ATOM 327 C C5 . U B 1 2 ? 15.350 17.469 -5.962 1.00 16.64 ? 16 U B C5 1
ATOM 328 C C6 . U B 1 2 ? 15.636 16.193 -6.266 1.00 17.60 ? 16 U B C6 1
ATOM 329 P P . A B 1 3 ? 15.755 12.103 -3.030 1.00 32.35 ? 17 A B P 1
ATOM 330 O OP1 . A B 1 3 ? 15.377 10.912 -2.249 1.00 38.14 ? 17 A B OP1 1
ATOM 331 O OP2 . A B 1 3 ? 14.688 13.129 -3.231 1.00 29.50 ? 17 A B OP2 1
ATOM 332 O "O5'" . A B 1 3 ? 17.093 12.754 -2.411 1.00 27.03 ? 17 A B "O5'" 1
ATOM 333 C "C5'" . A B 1 3 ? 18.034 11.773 -1.930 1.00 18.22 ? 17 A B "C5'" 1
ATOM 334 C "C4'" . A B 1 3 ? 19.279 12.567 -1.621 1.00 10.91 ? 17 A B "C4'" 1
ATOM 335 O "O4'" . A B 1 3 ? 19.426 13.566 -2.598 1.00 12.55 ? 17 A B "O4'" 1
ATOM 336 C "C3'" . A B 1 3 ? 19.351 13.338 -0.309 1.00 13.40 ? 17 A B "C3'" 1
ATOM 337 O "O3'" . A B 1 3 ? 19.576 12.500 0.825 1.00 14.50 ? 17 A B "O3'" 1
ATOM 338 C "C2'" . A B 1 3 ? 20.483 14.320 -0.589 1.00 11.89 ? 17 A B "C2'" 1
ATOM 339 O "O2'" . A B 1 3 ? 21.718 13.642 -0.727 1.00 12.48 ? 17 A B "O2'" 1
ATOM 340 C "C1'" . A B 1 3 ? 20.145 14.668 -2.018 1.00 11.82 ? 17 A B "C1'" 1
ATOM 341 N N9 . A B 1 3 ? 19.224 15.823 -2.033 1.00 9.30 ? 17 A B N9 1
ATOM 342 C C8 . A B 1 3 ? 17.887 15.765 -2.328 1.00 4.21 ? 17 A B C8 1
ATOM 343 N N7 . A B 1 3 ? 17.335 16.952 -2.347 1.00 9.17 ? 17 A B N7 1
ATOM 344 C C5 . A B 1 3 ? 18.382 17.831 -2.068 1.00 8.36 ? 17 A B C5 1
ATOM 345 C C6 . A B 1 3 ? 18.416 19.236 -1.905 1.00 6.35 ? 17 A B C6 1
ATOM 346 N N6 . A B 1 3 ? 17.382 20.066 -2.072 1.00 6.81 ? 17 A B N6 1
ATOM 347 N N1 . A B 1 3 ? 19.637 19.753 -1.581 1.00 9.04 ? 17 A B N1 1
ATOM 348 C C2 . A B 1 3 ? 20.729 18.959 -1.434 1.00 6.73 ? 17 A B C2 1
ATOM 349 N N3 . A B 1 3 ? 20.773 17.634 -1.552 1.00 10.40 ? 17 A B N3 1
ATOM 350 C C4 . A B 1 3 ? 19.555 17.144 -1.861 1.00 6.80 ? 17 A B C4 1
ATOM 351 P P . U B 1 4 ? 18.808 12.718 2.176 1.00 16.58 ? 18 U B P 1
ATOM 352 O OP1 . U B 1 4 ? 19.132 11.608 3.192 1.00 18.79 ? 18 U B OP1 1
ATOM 353 O OP2 . U B 1 4 ? 17.355 12.825 1.896 1.00 21.21 ? 18 U B OP2 1
ATOM 354 O "O5'" . U B 1 4 ? 19.531 14.021 2.760 1.00 20.54 ? 18 U B "O5'" 1
ATOM 355 C "C5'" . U B 1 4 ? 20.974 14.030 2.603 1.00 14.94 ? 18 U B "C5'" 1
ATOM 356 C "C4'" . U B 1 4 ? 21.421 15.413 3.015 1.00 12.79 ? 18 U B "C4'" 1
ATOM 357 O "O4'" . U B 1 4 ? 21.189 16.269 1.920 1.00 15.05 ? 18 U B "O4'" 1
ATOM 358 C "C3'" . U B 1 4 ? 20.684 16.055 4.179 1.00 14.17 ? 18 U B "C3'" 1
ATOM 359 O "O3'" . U B 1 4 ? 21.155 15.591 5.451 1.00 10.95 ? 18 U B "O3'" 1
ATOM 360 C "C2'" . U B 1 4 ? 20.916 17.536 3.904 1.00 13.03 ? 18 U B "C2'" 1
ATOM 361 O "O2'" . U B 1 4 ? 22.257 17.844 4.268 1.00 17.28 ? 18 U B "O2'" 1
ATOM 362 C "C1'" . U B 1 4 ? 20.865 17.594 2.392 1.00 15.68 ? 18 U B "C1'" 1
ATOM 363 N N1 . U B 1 4 ? 19.514 17.973 1.920 1.00 12.29 ? 18 U B N1 1
ATOM 364 C C2 . U B 1 4 ? 19.269 19.321 1.709 1.00 5.83 ? 18 U B C2 1
ATOM 365 O O2 . U B 1 4 ? 20.139 20.155 1.930 1.00 6.45 ? 18 U B O2 1
ATOM 366 N N3 . U B 1 4 ? 18.017 19.628 1.267 1.00 11.95 ? 18 U B N3 1
ATOM 367 C C4 . U B 1 4 ? 17.041 18.701 1.026 1.00 10.75 ? 18 U B C4 1
ATOM 368 O O4 . U B 1 4 ? 15.953 19.196 0.609 1.00 13.13 ? 18 U B O4 1
ATOM 369 C C5 . U B 1 4 ? 17.335 17.327 1.242 1.00 8.24 ? 18 U B C5 1
ATOM 370 C C6 . U B 1 4 ? 18.569 17.023 1.665 1.00 10.24 ? 18 U B C6 1
ATOM 371 P P . A B 1 5 ? 20.152 15.787 6.679 1.00 12.87 ? 19 A B P 1
ATOM 372 O OP1 . A B 1 5 ? 20.780 14.877 7.759 1.00 18.17 ? 19 A B OP1 1
ATOM 373 O OP2 . A B 1 5 ? 18.812 15.413 6.266 1.00 9.62 ? 19 A B OP2 1
ATOM 374 O "O5'" . A B 1 5 ? 20.340 17.273 7.200 1.00 12.96 ? 19 A B "O5'" 1
ATOM 375 C "C5'" . A B 1 5 ? 21.677 17.732 7.524 1.00 17.03 ? 19 A B "C5'" 1
ATOM 376 C "C4'" . A B 1 5 ? 21.537 19.236 7.671 1.00 14.93 ? 19 A B "C4'" 1
ATOM 377 O "O4'" . A B 1 5 ? 21.329 19.767 6.384 1.00 14.88 ? 19 A B "O4'" 1
ATOM 378 C "C3'" . A B 1 5 ? 20.326 19.651 8.491 1.00 12.91 ? 19 A B "C3'" 1
ATOM 379 O "O3'" . A B 1 5 ? 20.562 19.602 9.901 1.00 16.73 ? 19 A B "O3'" 1
ATOM 380 C "C2'" . A B 1 5 ? 20.019 21.043 7.926 1.00 11.60 ? 19 A B "C2'" 1
ATOM 381 O "O2'" . A B 1 5 ? 20.855 22.055 8.462 1.00 12.17 ? 19 A B "O2'" 1
ATOM 382 C "C1'" . A B 1 5 ? 20.398 20.864 6.463 1.00 11.23 ? 19 A B "C1'" 1
ATOM 383 N N9 . A B 1 5 ? 19.132 20.659 5.716 1.00 6.83 ? 19 A B N9 1
ATOM 384 C C8 . A B 1 5 ? 18.546 19.490 5.299 1.00 5.81 ? 19 A B C8 1
ATOM 385 N N7 . A B 1 5 ? 17.403 19.664 4.690 1.00 6.46 ? 19 A B N7 1
ATOM 386 C C5 . A B 1 5 ? 17.246 21.047 4.695 1.00 2.00 ? 19 A B C5 1
ATOM 387 C C6 . A B 1 5 ? 16.206 21.868 4.204 1.00 3.46 ? 19 A B C6 1
ATOM 388 N N6 . A B 1 5 ? 15.114 21.457 3.560 1.00 5.51 ? 19 A B N6 1
ATOM 389 N N1 . A B 1 5 ? 16.407 23.202 4.435 1.00 3.28 ? 19 A B N1 1
ATOM 390 C C2 . A B 1 5 ? 17.498 23.715 5.058 1.00 3.85 ? 19 A B C2 1
ATOM 391 N N3 . A B 1 5 ? 18.471 22.983 5.579 1.00 3.49 ? 19 A B N3 1
ATOM 392 C C4 . A B 1 5 ? 18.283 21.667 5.338 1.00 3.88 ? 19 A B C4 1
ATOM 393 P P . U B 1 6 ? 19.559 19.321 11.109 1.00 13.22 ? 20 U B P 1
ATOM 394 O OP1 . U B 1 6 ? 20.217 18.656 12.263 1.00 16.03 ? 20 U B OP1 1
ATOM 395 O OP2 . U B 1 6 ? 18.600 18.361 10.367 1.00 19.11 ? 20 U B OP2 1
ATOM 396 O "O5'" . U B 1 6 ? 18.791 20.605 11.364 1.00 15.78 ? 20 U B "O5'" 1
ATOM 397 C "C5'" . U B 1 6 ? 18.952 21.819 12.135 1.00 16.21 ? 20 U B "C5'" 1
ATOM 398 C "C4'" . U B 1 6 ? 18.177 23.001 11.605 1.00 12.98 ? 20 U B "C4'" 1
ATOM 399 O "O4'" . U B 1 6 ? 18.269 23.126 10.200 1.00 16.41 ? 20 U B "O4'" 1
ATOM 400 C "C3'" . U B 1 6 ? 16.683 22.996 11.855 1.00 15.20 ? 20 U B "C3'" 1
ATOM 401 O "O3'" . U B 1 6 ? 16.305 23.367 13.181 1.00 19.02 ? 20 U B "O3'" 1
ATOM 402 C "C2'" . U B 1 6 ? 16.192 24.045 10.868 1.00 13.91 ? 20 U B "C2'" 1
ATOM 403 O "O2'" . U B 1 6 ? 16.543 25.240 11.551 1.00 16.35 ? 20 U B "O2'" 1
ATOM 404 C "C1'" . U B 1 6 ? 17.086 23.750 9.680 1.00 12.43 ? 20 U B "C1'" 1
ATOM 405 N N1 . U B 1 6 ? 16.342 22.778 8.855 1.00 5.13 ? 20 U B N1 1
ATOM 406 C C2 . U B 1 6 ? 15.292 23.277 8.098 1.00 12.04 ? 20 U B C2 1
ATOM 407 O O2 . U B 1 6 ? 15.012 24.469 8.020 1.00 11.63 ? 20 U B O2 1
ATOM 408 N N3 . U B 1 6 ? 14.585 22.350 7.386 1.00 9.80 ? 20 U B N3 1
ATOM 409 C C4 . U B 1 6 ? 14.841 21.011 7.396 1.00 6.46 ? 20 U B C4 1
ATOM 410 O O4 . U B 1 6 ? 14.084 20.347 6.635 1.00 8.50 ? 20 U B O4 1
ATOM 411 C C5 . U B 1 6 ? 15.933 20.538 8.177 1.00 10.65 ? 20 U B C5 1
ATOM 412 C C6 . U B 1 6 ? 16.622 21.448 8.879 1.00 7.39 ? 20 U B C6 1
ATOM 413 P P . A B 1 7 ? 15.568 22.238 14.099 1.00 19.13 ? 21 A B P 1
ATOM 414 O OP1 . A B 1 7 ? 16.543 22.243 15.254 1.00 14.55 ? 21 A B OP1 1
ATOM 415 O OP2 . A B 1 7 ? 15.530 20.949 13.402 1.00 13.20 ? 21 A B OP2 1
ATOM 416 O "O5'" . A B 1 7 ? 14.169 22.938 14.173 1.00 11.20 ? 21 A B "O5'" 1
ATOM 417 C "C5'" . A B 1 7 ? 14.108 24.344 14.527 1.00 11.33 ? 21 A B "C5'" 1
ATOM 418 C "C4'" . A B 1 7 ? 12.931 24.879 13.761 1.00 12.34 ? 21 A B "C4'" 1
ATOM 419 O "O4'" . A B 1 7 ? 13.296 24.857 12.395 1.00 8.95 ? 21 A B "O4'" 1
ATOM 420 C "C3'" . A B 1 7 ? 11.618 24.116 13.893 1.00 14.87 ? 21 A B "C3'" 1
ATOM 421 O "O3'" . A B 1 7 ? 10.772 24.388 15.018 1.00 9.38 ? 21 A B "O3'" 1
ATOM 422 C "C2'" . A B 1 7 ? 10.898 24.571 12.621 1.00 10.36 ? 21 A B "C2'" 1
ATOM 423 O "O2'" . A B 1 7 ? 10.311 25.807 12.995 1.00 21.20 ? 21 A B "O2'" 1
ATOM 424 C "C1'" . A B 1 7 ? 12.065 24.687 11.664 1.00 10.29 ? 21 A B "C1'" 1
ATOM 425 N N9 . A B 1 7 ? 12.106 23.434 10.888 1.00 7.17 ? 21 A B N9 1
ATOM 426 C C8 . A B 1 7 ? 12.921 22.345 11.020 1.00 7.56 ? 21 A B C8 1
ATOM 427 N N7 . A B 1 7 ? 12.634 21.413 10.141 1.00 13.53 ? 21 A B N7 1
ATOM 428 C C5 . A B 1 7 ? 11.580 21.930 9.390 1.00 11.26 ? 21 A B C5 1
ATOM 429 C C6 . A B 1 7 ? 10.854 21.453 8.270 1.00 8.29 ? 21 A B C6 1
ATOM 430 N N6 . A B 1 7 ? 10.983 20.266 7.676 1.00 8.24 ? 21 A B N6 1
ATOM 431 N N1 . A B 1 7 ? 9.865 22.256 7.779 1.00 7.64 ? 21 A B N1 1
ATOM 432 C C2 . A B 1 7 ? 9.599 23.465 8.344 1.00 8.35 ? 21 A B C2 1
ATOM 433 N N3 . A B 1 7 ? 10.267 23.991 9.365 1.00 13.13 ? 21 A B N3 1
ATOM 434 C C4 . A B 1 7 ? 11.236 23.179 9.851 1.00 8.24 ? 21 A B C4 1
ATOM 435 P P . U B 1 8 ? 10.185 23.104 15.774 1.00 15.37 ? 22 U B P 1
ATOM 436 O OP1 . U B 1 8 ? 9.755 23.643 17.105 1.00 15.74 ? 22 U B OP1 1
ATOM 437 O OP2 . U B 1 8 ? 10.871 21.872 15.764 1.00 5.20 ? 22 U B OP2 1
ATOM 438 O "O5'" . U B 1 8 ? 8.848 22.925 14.866 1.00 12.94 ? 22 U B "O5'" 1
ATOM 439 C "C5'" . U B 1 8 ? 7.924 23.902 15.416 1.00 11.86 ? 22 U B "C5'" 1
ATOM 440 C "C4'" . U B 1 8 ? 6.897 23.929 14.311 1.00 11.63 ? 22 U B "C4'" 1
ATOM 441 O "O4'" . U B 1 8 ? 7.583 23.849 13.083 1.00 13.80 ? 22 U B "O4'" 1
ATOM 442 C "C3'" . U B 1 8 ? 5.990 22.711 14.345 1.00 16.36 ? 22 U B "C3'" 1
ATOM 443 O "O3'" . U B 1 8 ? 4.922 22.778 15.293 1.00 14.98 ? 22 U B "O3'" 1
ATOM 444 C "C2'" . U B 1 8 ? 5.550 22.666 12.882 1.00 18.60 ? 22 U B "C2'" 1
ATOM 445 O "O2'" . U B 1 8 ? 4.571 23.697 12.729 1.00 18.77 ? 22 U B "O2'" 1
ATOM 446 C "C1'" . U B 1 8 ? 6.819 23.063 12.150 1.00 9.33 ? 22 U B "C1'" 1
ATOM 447 N N1 . U B 1 8 ? 7.610 21.899 11.698 1.00 8.14 ? 22 U B N1 1
ATOM 448 C C2 . U B 1 8 ? 7.180 21.261 10.549 1.00 6.96 ? 22 U B C2 1
ATOM 449 O O2 . U B 1 8 ? 6.167 21.707 10.014 1.00 12.78 ? 22 U B O2 1
ATOM 450 N N3 . U B 1 8 ? 7.883 20.199 10.063 1.00 6.59 ? 22 U B N3 1
ATOM 451 C C4 . U B 1 8 ? 9.026 19.744 10.647 1.00 7.47 ? 22 U B C4 1
ATOM 452 O O4 . U B 1 8 ? 9.629 18.745 10.151 1.00 6.64 ? 22 U B O4 1
ATOM 453 C C5 . U B 1 8 ? 9.448 20.405 11.831 1.00 10.69 ? 22 U B C5 1
ATOM 454 C C6 . U B 1 8 ? 8.729 21.431 12.317 1.00 11.85 ? 22 U B C6 1
ATOM 455 P P . A B 1 9 ? 4.769 21.283 16.020 1.00 14.80 ? 23 A B P 1
ATOM 456 O OP1 . A B 1 9 ? 3.977 21.431 17.267 1.00 19.44 ? 23 A B OP1 1
ATOM 457 O OP2 . A B 1 9 ? 6.150 20.815 16.133 1.00 13.40 ? 23 A B OP2 1
ATOM 458 O "O5'" . A B 1 9 ? 3.940 20.463 14.944 1.00 11.22 ? 23 A B "O5'" 1
ATOM 459 C "C5'" . A B 1 9 ? 2.719 21.150 14.586 1.00 8.05 ? 23 A B "C5'" 1
ATOM 460 C "C4'" . A B 1 9 ? 2.251 20.405 13.358 1.00 14.31 ? 23 A B "C4'" 1
ATOM 461 O "O4'" . A B 1 9 ? 3.094 20.543 12.238 1.00 16.51 ? 23 A B "O4'" 1
ATOM 462 C "C3'" . A B 1 9 ? 2.186 18.910 13.623 1.00 13.43 ? 23 A B "C3'" 1
ATOM 463 O "O3'" . A B 1 9 ? 1.150 18.638 14.566 1.00 15.47 ? 23 A B "O3'" 1
ATOM 464 C "C2'" . A B 1 9 ? 2.132 18.366 12.199 1.00 12.95 ? 23 A B "C2'" 1
ATOM 465 O "O2'" . A B 1 9 ? 0.914 18.558 11.502 1.00 15.55 ? 23 A B "O2'" 1
ATOM 466 C "C1'" . A B 1 9 ? 3.060 19.325 11.472 1.00 10.79 ? 23 A B "C1'" 1
ATOM 467 N N9 . A B 1 9 ? 4.352 18.620 11.374 1.00 9.26 ? 23 A B N9 1
ATOM 468 C C8 . A B 1 9 ? 5.400 18.678 12.253 1.00 11.90 ? 23 A B C8 1
ATOM 469 N N7 . A B 1 9 ? 6.402 17.902 11.919 1.00 13.46 ? 23 A B N7 1
ATOM 470 C C5 . A B 1 9 ? 5.973 17.282 10.750 1.00 7.23 ? 23 A B C5 1
ATOM 471 C C6 . A B 1 9 ? 6.634 16.354 9.915 1.00 5.96 ? 23 A B C6 1
ATOM 472 N N6 . A B 1 9 ? 7.869 15.908 10.126 1.00 5.21 ? 23 A B N6 1
ATOM 473 N N1 . A B 1 9 ? 5.877 15.993 8.835 1.00 10.33 ? 23 A B N1 1
ATOM 474 C C2 . A B 1 9 ? 4.622 16.452 8.599 1.00 10.95 ? 23 A B C2 1
ATOM 475 N N3 . A B 1 9 ? 3.960 17.327 9.355 1.00 9.31 ? 23 A B N3 1
ATOM 476 C C4 . A B 1 9 ? 4.711 17.710 10.406 1.00 8.13 ? 23 A B C4 1
ATOM 477 P P . U B 1 10 ? 0.849 17.264 15.401 1.00 17.51 ? 24 U B P 1
ATOM 478 O OP1 . U B 1 10 ? -0.263 17.478 16.309 1.00 16.97 ? 24 U B OP1 1
ATOM 479 O OP2 . U B 1 10 ? 2.016 16.698 16.025 1.00 18.78 ? 24 U B OP2 1
ATOM 480 O "O5'" . U B 1 10 ? 0.587 16.385 14.041 1.00 16.19 ? 24 U B "O5'" 1
ATOM 481 C "C5'" . U B 1 10 ? -0.280 15.252 13.844 1.00 16.25 ? 24 U B "C5'" 1
ATOM 482 C "C4'" . U B 1 10 ? -0.133 14.739 12.430 1.00 16.52 ? 24 U B "C4'" 1
ATOM 483 O "O4'" . U B 1 10 ? 0.955 15.315 11.742 1.00 16.97 ? 24 U B "O4'" 1
ATOM 484 C "C3'" . U B 1 10 ? 0.164 13.245 12.459 1.00 15.48 ? 24 U B "C3'" 1
ATOM 485 O "O3'" . U B 1 10 ? -0.999 12.468 12.754 1.00 18.84 ? 24 U B "O3'" 1
ATOM 486 C "C2'" . U B 1 10 ? 0.849 13.017 11.114 1.00 13.88 ? 24 U B "C2'" 1
ATOM 487 O "O2'" . U B 1 10 ? -0.181 12.834 10.151 1.00 19.49 ? 24 U B "O2'" 1
ATOM 488 C "C1'" . U B 1 10 ? 1.630 14.315 10.942 1.00 12.74 ? 24 U B "C1'" 1
ATOM 489 N N1 . U B 1 10 ? 3.026 14.248 11.452 1.00 6.79 ? 24 U B N1 1
ATOM 490 C C2 . U B 1 10 ? 3.994 13.468 10.839 1.00 5.66 ? 24 U B C2 1
ATOM 491 O O2 . U B 1 10 ? 3.766 12.790 9.837 1.00 14.51 ? 24 U B O2 1
ATOM 492 N N3 . U B 1 10 ? 5.246 13.508 11.379 1.00 7.61 ? 24 U B N3 1
ATOM 493 C C4 . U B 1 10 ? 5.604 14.204 12.498 1.00 8.96 ? 24 U B C4 1
ATOM 494 O O4 . U B 1 10 ? 6.825 14.097 12.818 1.00 8.16 ? 24 U B O4 1
ATOM 495 C C5 . U B 1 10 ? 4.598 14.971 13.157 1.00 5.13 ? 24 U B C5 1
ATOM 496 C C6 . U B 1 10 ? 3.387 14.940 12.582 1.00 9.60 ? 24 U B C6 1
ATOM 497 P P . A B 1 11 ? -0.897 11.286 13.908 1.00 19.42 ? 25 A B P 1
ATOM 498 O OP1 . A B 1 11 ? -2.309 11.014 14.330 1.00 22.20 ? 25 A B OP1 1
ATOM 499 O OP2 . A B 1 11 ? -0.119 11.782 15.033 1.00 21.13 ? 25 A B OP2 1
ATOM 500 O "O5'" . A B 1 11 ? -0.375 10.162 12.931 1.00 17.42 ? 25 A B "O5'" 1
ATOM 501 C "C5'" . A B 1 11 ? -0.972 9.823 11.649 1.00 9.72 ? 25 A B "C5'" 1
ATOM 502 C "C4'" . A B 1 11 ? 0.058 8.895 11.040 1.00 14.48 ? 25 A B "C4'" 1
ATOM 503 O "O4'" . A B 1 11 ? 1.190 9.640 10.642 1.00 13.62 ? 25 A B "O4'" 1
ATOM 504 C "C3'" . A B 1 11 ? 0.621 7.847 11.988 1.00 12.66 ? 25 A B "C3'" 1
ATOM 505 O "O3'" . A B 1 11 ? -0.191 6.696 12.223 1.00 15.91 ? 25 A B "O3'" 1
ATOM 506 C "C2'" . A B 1 11 ? 1.951 7.517 11.315 1.00 13.80 ? 25 A B "C2'" 1
ATOM 507 O "O2'" . A B 1 11 ? 1.685 6.687 10.195 1.00 15.12 ? 25 A B "O2'" 1
ATOM 508 C "C1'" . A B 1 11 ? 2.398 8.864 10.775 1.00 7.62 ? 25 A B "C1'" 1
ATOM 509 N N9 . A B 1 11 ? 3.387 9.493 11.678 1.00 5.14 ? 25 A B N9 1
ATOM 510 C C8 . A B 1 11 ? 3.176 10.457 12.631 1.00 2.07 ? 25 A B C8 1
ATOM 511 N N7 . A B 1 11 ? 4.260 10.858 13.235 1.00 2.00 ? 25 A B N7 1
ATOM 512 C C5 . A B 1 11 ? 5.277 10.135 12.616 1.00 3.07 ? 25 A B C5 1
ATOM 513 C C6 . A B 1 11 ? 6.675 10.113 12.828 1.00 4.54 ? 25 A B C6 1
ATOM 514 N N6 . A B 1 11 ? 7.340 10.858 13.712 1.00 2.00 ? 25 A B N6 1
ATOM 515 N N1 . A B 1 11 ? 7.354 9.261 12.002 1.00 2.00 ? 25 A B N1 1
ATOM 516 C C2 . A B 1 11 ? 6.726 8.480 11.084 1.00 4.66 ? 25 A B C2 1
ATOM 517 N N3 . A B 1 11 ? 5.413 8.440 10.868 1.00 5.82 ? 25 A B N3 1
ATOM 518 C C4 . A B 1 11 ? 4.748 9.292 11.669 1.00 2.00 ? 25 A B C4 1
ATOM 519 P P . U B 1 12 ? 0.007 5.911 13.687 1.00 14.19 ? 26 U B P 1
ATOM 520 O OP1 . U B 1 12 ? -1.238 5.442 14.276 1.00 18.89 ? 26 U B OP1 1
ATOM 521 O OP2 . U B 1 12 ? 0.440 7.089 14.497 1.00 19.55 ? 26 U B OP2 1
ATOM 522 O "O5'" . U B 1 12 ? 1.190 4.903 13.515 1.00 11.88 ? 26 U B "O5'" 1
ATOM 523 C "C5'" . U B 1 12 ? 1.286 3.738 12.661 1.00 7.57 ? 26 U B "C5'" 1
ATOM 524 C "C4'" . U B 1 12 ? 2.684 3.489 12.150 1.00 6.24 ? 26 U B "C4'" 1
ATOM 525 O "O4'" . U B 1 12 ? 3.380 4.653 11.772 1.00 11.12 ? 26 U B "O4'" 1
ATOM 526 C "C3'" . U B 1 12 ? 3.602 2.868 13.186 1.00 9.51 ? 26 U B "C3'" 1
ATOM 527 O "O3'" . U B 1 12 ? 3.261 1.503 13.422 1.00 12.14 ? 26 U B "O3'" 1
ATOM 528 C "C2'" . U B 1 12 ? 4.987 3.145 12.616 1.00 8.08 ? 26 U B "C2'" 1
ATOM 529 O "O2'" . U B 1 12 ? 5.198 2.217 11.560 1.00 6.71 ? 26 U B "O2'" 1
ATOM 530 C "C1'" . U B 1 12 ? 4.792 4.528 12.032 1.00 5.10 ? 26 U B "C1'" 1
ATOM 531 N N1 . U B 1 12 ? 5.232 5.532 13.024 1.00 7.38 ? 26 U B N1 1
ATOM 532 C C2 . U B 1 12 ? 6.593 5.719 13.206 1.00 8.27 ? 26 U B C2 1
ATOM 533 O O2 . U B 1 12 ? 7.368 5.041 12.533 1.00 8.47 ? 26 U B O2 1
ATOM 534 N N3 . U B 1 12 ? 6.948 6.674 14.114 1.00 4.21 ? 26 U B N3 1
ATOM 535 C C4 . U B 1 12 ? 6.082 7.423 14.851 1.00 2.70 ? 26 U B C4 1
ATOM 536 O O4 . U B 1 12 ? 6.488 8.253 15.705 1.00 5.62 ? 26 U B O4 1
ATOM 537 C C5 . U B 1 12 ? 4.690 7.205 14.650 1.00 2.00 ? 26 U B C5 1
ATOM 538 C C6 . U B 1 12 ? 4.349 6.277 13.746 1.00 7.51 ? 26 U B C6 1
ATOM 539 P P . A B 1 13 ? 3.084 1.008 14.959 1.00 17.01 ? 27 A B P 1
ATOM 540 O OP1 . A B 1 13 ? 2.678 -0.433 14.802 1.00 17.56 ? 27 A B OP1 1
ATOM 541 O OP2 . A B 1 13 ? 2.538 1.851 15.990 1.00 13.38 ? 27 A B OP2 1
ATOM 542 O "O5'" . A B 1 13 ? 4.724 0.977 15.200 1.00 18.53 ? 27 A B "O5'" 1
ATOM 543 C "C5'" . A B 1 13 ? 5.396 0.129 14.232 1.00 17.24 ? 27 A B "C5'" 1
ATOM 544 C "C4'" . A B 1 13 ? 6.863 0.165 14.595 1.00 13.41 ? 27 A B "C4'" 1
ATOM 545 O "O4'" . A B 1 13 ? 7.433 1.405 14.252 1.00 17.52 ? 27 A B "O4'" 1
ATOM 546 C "C3'" . A B 1 13 ? 7.064 0.036 16.098 1.00 13.73 ? 27 A B "C3'" 1
ATOM 547 O "O3'" . A B 1 13 ? 6.928 -1.320 16.535 1.00 16.08 ? 27 A B "O3'" 1
ATOM 548 C "C2'" . A B 1 13 ? 8.439 0.647 16.314 1.00 14.28 ? 27 A B "C2'" 1
ATOM 549 O "O2'" . A B 1 13 ? 9.472 -0.228 15.882 1.00 13.43 ? 27 A B "O2'" 1
ATOM 550 C "C1'" . A B 1 13 ? 8.371 1.762 15.288 1.00 10.49 ? 27 A B "C1'" 1
ATOM 551 N N9 . A B 1 13 ? 7.886 2.958 16.010 1.00 2.00 ? 27 A B N9 1
ATOM 552 C C8 . A B 1 13 ? 6.621 3.453 16.201 1.00 2.00 ? 27 A B C8 1
ATOM 553 N N7 . A B 1 13 ? 6.570 4.559 16.894 1.00 2.00 ? 27 A B N7 1
ATOM 554 C C5 . A B 1 13 ? 7.907 4.796 17.203 1.00 2.00 ? 27 A B C5 1
ATOM 555 C C6 . A B 1 13 ? 8.558 5.831 17.915 1.00 2.00 ? 27 A B C6 1
ATOM 556 N N6 . A B 1 13 ? 7.944 6.861 18.475 1.00 4.63 ? 27 A B N6 1
ATOM 557 N N1 . A B 1 13 ? 9.916 5.737 18.028 1.00 4.44 ? 27 A B N1 1
ATOM 558 C C2 . A B 1 13 ? 10.584 4.706 17.444 1.00 8.01 ? 27 A B C2 1
ATOM 559 N N3 . A B 1 13 ? 10.059 3.694 16.756 1.00 5.40 ? 27 A B N3 1
ATOM 560 C C4 . A B 1 13 ? 8.719 3.810 16.692 1.00 2.00 ? 27 A B C4 1
ATOM 561 P P . A B 1 14 ? 6.812 -1.758 18.092 1.00 23.39 ? 28 A B P 1
ATOM 562 O OP1 . A B 1 14 ? 6.460 -3.194 17.704 1.00 16.84 ? 28 A B OP1 1
ATOM 563 O OP2 . A B 1 14 ? 5.768 -0.990 18.809 1.00 12.59 ? 28 A B OP2 1
ATOM 564 O "O5'" . A B 1 14 ? 8.319 -1.615 18.510 1.00 14.74 ? 28 A B "O5'" 1
ATOM 565 C "C5'" . A B 1 14 ? 9.121 -2.373 19.452 1.00 17.23 ? 28 A B "C5'" 1
ATOM 566 C "C4'" . A B 1 14 ? 10.325 -1.512 19.742 1.00 11.61 ? 28 A B "C4'" 1
ATOM 567 O "O4'" . A B 1 14 ? 10.168 -0.303 19.035 1.00 18.88 ? 28 A B "O4'" 1
ATOM 568 C "C3'" . A B 1 14 ? 10.424 -1.111 21.206 1.00 10.76 ? 28 A B "C3'" 1
ATOM 569 O "O3'" . A B 1 14 ? 11.035 -2.128 22.006 1.00 17.46 ? 28 A B "O3'" 1
ATOM 570 C "C2'" . A B 1 14 ? 11.185 0.205 21.098 1.00 12.36 ? 28 A B "C2'" 1
ATOM 571 O "O2'" . A B 1 14 ? 12.549 -0.125 20.891 1.00 11.15 ? 28 A B "O2'" 1
ATOM 572 C "C1'" . A B 1 14 ? 10.659 0.812 19.811 1.00 10.93 ? 28 A B "C1'" 1
ATOM 573 N N9 . A B 1 14 ? 9.554 1.735 20.115 1.00 6.32 ? 28 A B N9 1
ATOM 574 C C8 . A B 1 14 ? 8.200 1.517 20.150 1.00 9.01 ? 28 A B C8 1
ATOM 575 N N7 . A B 1 14 ? 7.477 2.561 20.484 1.00 8.83 ? 28 A B N7 1
ATOM 576 C C5 . A B 1 14 ? 8.435 3.533 20.744 1.00 4.64 ? 28 A B C5 1
ATOM 577 C C6 . A B 1 14 ? 8.309 4.876 21.161 1.00 7.73 ? 28 A B C6 1
ATOM 578 N N6 . A B 1 14 ? 7.180 5.545 21.382 1.00 9.94 ? 28 A B N6 1
ATOM 579 N N1 . A B 1 14 ? 9.500 5.549 21.250 1.00 7.93 ? 28 A B N1 1
ATOM 580 C C2 . A B 1 14 ? 10.704 4.956 21.019 1.00 13.09 ? 28 A B C2 1
ATOM 581 N N3 . A B 1 14 ? 10.881 3.685 20.651 1.00 14.90 ? 28 A B N3 1
ATOM 582 C C4 . A B 1 14 ? 9.701 3.047 20.508 1.00 9.54 ? 28 A B C4 1
HETATM 583 O O . HOH C 2 . ? 20.295 25.526 3.919 1.00 19.11 ? 29 HOH A O 1
HETATM 584 O O . HOH C 2 . ? 13.869 34.140 3.266 1.00 27.76 ? 30 HOH A O 1
HETATM 585 O O . HOH C 2 . ? 12.119 11.853 17.002 0.68 11.69 ? 31 HOH A O 1
HETATM 586 O O . HOH C 2 . ? 15.114 5.264 18.912 1.00 16.06 ? 33 HOH A O 1
HETATM 587 O O . HOH C 2 . ? 5.195 11.095 -1.002 0.75 7.91 ? 34 HOH A O 1
HETATM 588 O O . HOH C 2 . ? 13.528 24.014 -1.842 0.70 13.07 ? 35 HOH A O 1
HETATM 589 O O . HOH C 2 . ? 22.301 23.817 -7.912 1.00 34.60 ? 36 HOH A O 1
HETATM 590 O O . HOH C 2 . ? 18.962 5.023 13.328 1.00 22.38 ? 38 HOH A O 1
HETATM 591 O O . HOH C 2 . ? 23.679 30.652 -4.233 1.00 24.34 ? 40 HOH A O 1
HETATM 592 O O . HOH C 2 . ? 6.935 25.468 -3.772 1.00 31.32 ? 41 HOH A O 1
HETATM 593 O O . HOH C 2 . ? 17.932 9.011 4.847 0.83 20.14 ? 42 HOH A O 1
HETATM 594 O O . HOH C 2 . ? 26.729 30.098 -0.697 0.88 11.21 ? 43 HOH A O 1
HETATM 595 O O . HOH C 2 . ? 14.139 36.660 3.998 1.00 36.22 ? 45 HOH A O 1
HETATM 596 O O . HOH C 2 . ? 5.134 8.025 4.896 1.00 23.03 ? 46 HOH A O 1
HETATM 597 O O . HOH C 2 . ? 18.672 12.812 13.191 0.79 8.20 ? 47 HOH A O 1
HETATM 598 O O . HOH C 2 . ? 20.125 32.904 -3.575 0.98 31.01 ? 54 HOH A O 1
HETATM 599 O O . HOH C 2 . ? 18.607 9.698 7.553 0.67 18.26 ? 56 HOH A O 1
HETATM 600 O O . HOH C 2 . ? 3.350 29.081 2.534 1.00 23.05 ? 61 HOH A O 1
HETATM 601 O O . HOH C 2 . ? 28.571 21.564 -11.590 1.00 13.14 ? 62 HOH A O 1
HETATM 602 O O . HOH C 2 . ? 31.316 28.524 0.103 0.51 9.65 ? 63 HOH A O 1
HETATM 603 O O . HOH C 2 . ? 7.774 22.069 -2.780 1.00 37.06 ? 64 HOH A O 1
HETATM 604 O O . HOH C 2 . ? 18.873 24.357 -5.883 1.00 29.20 ? 65 HOH A O 1
HETATM 605 O O . HOH C 2 . ? 27.087 22.109 1.198 1.00 19.05 ? 66 HOH A O 1
HETATM 606 O O . HOH C 2 . ? 28.506 26.199 -6.964 1.00 32.18 ? 69 HOH A O 1
HETATM 607 O O . HOH C 2 . ? 29.328 21.199 -1.036 0.59 12.66 ? 70 HOH A O 1
HETATM 608 O O . HOH C 2 . ? 27.213 27.730 -0.236 0.75 16.31 ? 71 HOH A O 1
HETATM 609 O O . HOH C 2 . ? 3.609 27.346 -0.732 0.66 20.59 ? 72 HOH A O 1
HETATM 610 O O . HOH C 2 . ? 1.289 14.025 2.195 1.00 23.97 ? 74 HOH A O 1
HETATM 611 O O . HOH C 2 . ? 14.220 3.234 11.654 1.00 40.11 ? 78 HOH A O 1
HETATM 612 O O . HOH C 2 . ? 12.952 12.147 9.994 0.90 42.44 ? 80 HOH A O 1
HETATM 613 O O . HOH C 2 . ? 2.681 20.739 7.465 0.82 28.31 ? 86 HOH A O 1
HETATM 614 O O . HOH C 2 . ? 11.307 31.410 -2.952 0.69 16.92 ? 90 HOH A O 1
HETATM 615 O O . HOH C 2 . ? 15.227 12.036 13.510 0.70 24.93 ? 93 HOH A O 1
HETATM 616 O O . HOH C 2 . ? 12.273 16.796 6.247 0.89 41.94 ? 95 HOH A O 1
HETATM 617 O O . HOH C 2 . ? 21.100 7.668 14.036 0.62 27.26 ? 96 HOH A O 1
HETATM 618 O O . HOH C 2 . ? 2.579 14.413 4.940 1.00 33.01 ? 98 HOH A O 1
HETATM 619 O O . HOH C 2 . ? 8.326 12.375 17.567 0.83 33.01 ? 101 HOH A O 1
HETATM 620 O O . HOH C 2 . ? 11.345 13.825 20.071 1.00 44.12 ? 102 HOH A O 1
HETATM 621 O O . HOH C 2 . ? 10.035 15.966 4.852 0.51 23.26 ? 104 HOH A O 1
HETATM 622 O O . HOH C 2 . ? 19.852 27.538 -5.068 1.00 36.11 ? 105 HOH A O 1
HETATM 623 O O . HOH C 2 . ? 8.780 11.442 26.961 0.78 33.71 ? 109 HOH A O 1
HETATM 624 O O . HOH C 2 . ? 14.292 10.046 1.738 0.99 42.74 ? 110 HOH A O 1
HETATM 625 O O . HOH C 2 . ? 11.853 13.842 3.934 0.87 33.29 ? 112 HOH A O 1
HETATM 626 O O . HOH C 2 . ? 12.815 27.819 -1.773 0.73 36.70 ? 114 HOH A O 1
HETATM 627 O O . HOH C 2 . ? 24.876 17.532 -2.878 0.75 39.44 ? 115 HOH A O 1
HETATM 628 O O . HOH C 2 . ? 13.542 36.183 6.782 0.94 38.90 ? 118 HOH A O 1
HETATM 629 O O . HOH C 2 . ? 11.775 28.122 -4.376 0.68 37.26 ? 119 HOH A O 1
HETATM 630 O O . HOH D 2 . ? 7.665 18.107 13.888 0.97 34.75 ? 32 HOH B O 1
HETATM 631 O O . HOH D 2 . ? 1.668 12.535 16.692 1.00 26.70 ? 37 HOH B O 1
HETATM 632 O O . HOH D 2 . ? 10.520 29.327 13.810 1.00 14.11 ? 39 HOH B O 1
HETATM 633 O O . HOH D 2 . ? 3.466 19.967 19.531 0.71 7.55 ? 44 HOH B O 1
HETATM 634 O O . HOH D 2 . ? 10.407 -3.560 24.113 1.00 27.97 ? 48 HOH B O 1
HETATM 635 O O . HOH D 2 . ? 2.705 22.573 19.020 1.00 19.39 ? 49 HOH B O 1
HETATM 636 O O . HOH D 2 . ? 16.247 23.309 -6.468 1.00 35.06 ? 50 HOH B O 1
HETATM 637 O O . HOH D 2 . ? 5.205 10.524 17.223 1.00 44.48 ? 51 HOH B O 1
HETATM 638 O O . HOH D 2 . ? 14.077 26.913 8.530 0.98 17.00 ? 52 HOH B O 1
HETATM 639 O O . HOH D 2 . ? 11.253 16.091 -3.988 0.58 16.64 ? 53 HOH B O 1
HETATM 640 O O . HOH D 2 . ? 15.510 17.072 4.268 0.94 24.08 ? 55 HOH B O 1
HETATM 641 O O . HOH D 2 . ? 10.912 27.542 15.357 0.87 22.93 ? 57 HOH B O 1
HETATM 642 O O . HOH D 2 . ? 3.612 5.023 17.233 1.00 18.08 ? 58 HOH B O 1
HETATM 643 O O . HOH D 2 . ? 12.167 15.698 -0.570 1.00 40.94 ? 59 HOH B O 1
HETATM 644 O O . HOH D 2 . ? 15.851 27.105 16.393 1.00 21.29 ? 60 HOH B O 1
HETATM 645 O O . HOH D 2 . ? -2.415 14.030 7.062 0.97 24.05 ? 67 HOH B O 1
HETATM 646 O O . HOH D 2 . ? 13.859 20.985 18.230 1.00 39.88 ? 68 HOH B O 1
HETATM 647 O O . HOH D 2 . ? 0.171 22.992 13.103 0.96 28.27 ? 73 HOH B O 1
HETATM 648 O O . HOH D 2 . ? 8.961 3.319 12.695 1.00 24.26 ? 75 HOH B O 1
HETATM 649 O O . HOH D 2 . ? 11.973 14.391 -13.260 1.00 32.55 ? 76 HOH B O 1
HETATM 650 O O . HOH D 2 . ? 20.776 13.169 -6.836 1.00 28.53 ? 77 HOH B O 1
HETATM 651 O O . HOH D 2 . ? 3.217 -3.265 12.297 0.75 19.10 ? 79 HOH B O 1
HETATM 652 O O . HOH D 2 . ? 14.016 18.036 10.028 1.00 39.00 ? 81 HOH B O 1
HETATM 653 O O . HOH D 2 . ? 12.406 19.771 14.468 0.91 17.96 ? 82 HOH B O 1
HETATM 654 O O . HOH D 2 . ? 15.609 11.688 3.934 0.96 17.61 ? 83 HOH B O 1
HETATM 655 O O . HOH D 2 . ? 9.237 18.576 16.025 0.88 43.97 ? 84 HOH B O 1
HETATM 656 O O . HOH D 2 . ? 16.090 15.944 6.787 1.00 24.51 ? 85 HOH B O 1
HETATM 657 O O . HOH D 2 . ? -0.587 18.219 19.025 1.00 24.17 ? 87 HOH B O 1
HETATM 658 O O . HOH D 2 . ? 6.044 26.333 11.055 1.00 23.60 ? 88 HOH B O 1
HETATM 659 O O . HOH D 2 . ? 12.211 17.853 2.220 1.00 46.50 ? 89 HOH B O 1
HETATM 660 O O . HOH D 2 . ? 8.892 16.461 -2.711 0.52 4.88 ? 91 HOH B O 1
HETATM 661 O O . HOH D 2 . ? 14.869 24.790 19.168 0.95 40.83 ? 92 HOH B O 1
HETATM 662 O O . HOH D 2 . ? 19.071 21.645 16.737 0.80 37.66 ? 94 HOH B O 1
HETATM 663 O O . HOH D 2 . ? 11.921 18.794 -5.893 0.81 32.85 ? 97 HOH B O 1
HETATM 664 O O . HOH D 2 . ? 21.053 25.147 8.491 0.63 36.43 ? 99 HOH B O 1
HETATM 665 O O . HOH D 2 . ? 4.895 12.339 15.445 1.00 41.36 ? 100 HOH B O 1
HETATM 666 O O . HOH D 2 . ? 11.239 15.506 11.227 0.72 40.51 ? 103 HOH B O 1
HETATM 667 O O . HOH D 2 . ? 22.751 12.928 9.734 0.75 44.31 ? 106 HOH B O 1
HETATM 668 O O . HOH D 2 . ? -2.609 12.366 17.360 0.96 45.52 ? 107 HOH B O 1
HETATM 669 O O . HOH D 2 . ? 5.304 1.784 19.688 1.00 32.53 ? 108 HOH B O 1
HETATM 670 O O . HOH D 2 . ? 3.046 3.167 19.325 0.85 39.94 ? 111 HOH B O 1
HETATM 671 O O . HOH D 2 . ? 8.886 -6.571 22.807 0.93 38.19 ? 113 HOH B O 1
HETATM 672 O O . HOH D 2 . ? 20.446 13.994 10.981 0.96 37.90 ? 116 HOH B O 1
HETATM 673 O O . HOH D 2 . ? 14.562 17.492 -2.578 0.78 38.04 ? 117 HOH B O 1
#
loop_
_pdbx_poly_seq_scheme.asym_id
_pdbx_poly_seq_scheme.entity_id
_pdbx_poly_seq_scheme.seq_id
_pdbx_poly_seq_scheme.mon_id
_pdbx_poly_seq_scheme.ndb_seq_num
_pdbx_poly_seq_scheme.pdb_seq_num
_pdbx_poly_seq_scheme.auth_seq_num
_pdbx_poly_seq_scheme.pdb_mon_id
_pdbx_poly_seq_scheme.auth_mon_id
_pdbx_poly_seq_scheme.pdb_strand_id
_pdbx_poly_seq_scheme.pdb_ins_code
_pdbx_poly_seq_scheme.hetero
A 1 1 U 1 1 1 U U A . n
A 1 2 U 2 2 2 U U A . n
A 1 3 A 3 3 3 A A A . n
A 1 4 U 4 4 4 U U A . n
A 1 5 A 5 5 5 A A A . n
A 1 6 U 6 6 6 U U A . n
A 1 7 A 7 7 7 A A A . n
A 1 8 U 8 8 8 U U A . n
A 1 9 A 9 9 9 A A A . n
A 1 10 U 10 10 10 U U A . n
A 1 11 A 11 11 11 A A A . n
A 1 12 U 12 12 12 U U A . n
A 1 13 A 13 13 13 A A A . n
A 1 14 A 14 14 14 A A A . n
B 1 1 U 1 15 15 U U B . n
B 1 2 U 2 16 16 U U B . n
B 1 3 A 3 17 17 A A B . n
B 1 4 U 4 18 18 U U B . n
B 1 5 A 5 19 19 A A B . n
B 1 6 U 6 20 20 U U B . n
B 1 7 A 7 21 21 A A B . n
B 1 8 U 8 22 22 U U B . n
B 1 9 A 9 23 23 A A B . n
B 1 10 U 10 24 24 U U B . n
B 1 11 A 11 25 25 A A B . n
B 1 12 U 12 26 26 U U B . n
B 1 13 A 13 27 27 A A B . n
B 1 14 A 14 28 28 A A B . n
#
loop_
_pdbx_nonpoly_scheme.asym_id
_pdbx_nonpoly_scheme.entity_id
_pdbx_nonpoly_scheme.mon_id
_pdbx_nonpoly_scheme.ndb_seq_num
_pdbx_nonpoly_scheme.pdb_seq_num
_pdbx_nonpoly_scheme.auth_seq_num
_pdbx_nonpoly_scheme.pdb_mon_id
_pdbx_nonpoly_scheme.auth_mon_id
_pdbx_nonpoly_scheme.pdb_strand_id
_pdbx_nonpoly_scheme.pdb_ins_code
C 2 HOH 1 29 29 HOH HOH A .
C 2 HOH 2 30 30 HOH HOH A .
C 2 HOH 3 31 31 HOH HOH A .
C 2 HOH 4 33 33 HOH HOH A .
C 2 HOH 5 34 34 HOH HOH A .
C 2 HOH 6 35 35 HOH HOH A .
C 2 HOH 7 36 36 HOH HOH A .
C 2 HOH 8 38 38 HOH HOH A .
C 2 HOH 9 40 40 HOH HOH A .
C 2 HOH 10 41 41 HOH HOH A .
C 2 HOH 11 42 42 HOH HOH A .
C 2 HOH 12 43 43 HOH HOH A .
C 2 HOH 13 45 45 HOH HOH A .
C 2 HOH 14 46 46 HOH HOH A .
C 2 HOH 15 47 47 HOH HOH A .
C 2 HOH 16 54 54 HOH HOH A .
C 2 HOH 17 56 56 HOH HOH A .
C 2 HOH 18 61 61 HOH HOH A .
C 2 HOH 19 62 62 HOH HOH A .
C 2 HOH 20 63 63 HOH HOH A .
C 2 HOH 21 64 64 HOH HOH A .
C 2 HOH 22 65 65 HOH HOH A .
C 2 HOH 23 66 66 HOH HOH A .
C 2 HOH 24 69 69 HOH HOH A .
C 2 HOH 25 70 70 HOH HOH A .
C 2 HOH 26 71 71 HOH HOH A .
C 2 HOH 27 72 72 HOH HOH A .
C 2 HOH 28 74 74 HOH HOH A .
C 2 HOH 29 78 78 HOH HOH A .
C 2 HOH 30 80 80 HOH HOH A .
C 2 HOH 31 86 86 HOH HOH A .
C 2 HOH 32 90 90 HOH HOH A .
C 2 HOH 33 93 93 HOH HOH A .
C 2 HOH 34 95 95 HOH HOH A .
C 2 HOH 35 96 96 HOH HOH A .
C 2 HOH 36 98 98 HOH HOH A .
C 2 HOH 37 101 101 HOH HOH A .
C 2 HOH 38 102 102 HOH HOH A .
C 2 HOH 39 104 104 HOH HOH A .
C 2 HOH 40 105 105 HOH HOH A .
C 2 HOH 41 109 109 HOH HOH A .
C 2 HOH 42 110 110 HOH HOH A .
C 2 HOH 43 112 112 HOH HOH A .
C 2 HOH 44 114 114 HOH HOH A .
C 2 HOH 45 115 115 HOH HOH A .
C 2 HOH 46 118 118 HOH HOH A .
C 2 HOH 47 119 119 HOH HOH A .
D 2 HOH 1 32 32 HOH HOH B .
D 2 HOH 2 37 37 HOH HOH B .
D 2 HOH 3 39 39 HOH HOH B .
D 2 HOH 4 44 44 HOH HOH B .
D 2 HOH 5 48 48 HOH HOH B .
D 2 HOH 6 49 49 HOH HOH B .
D 2 HOH 7 50 50 HOH HOH B .
D 2 HOH 8 51 51 HOH HOH B .
D 2 HOH 9 52 52 HOH HOH B .
D 2 HOH 10 53 53 HOH HOH B .
D 2 HOH 11 55 55 HOH HOH B .
D 2 HOH 12 57 57 HOH HOH B .
D 2 HOH 13 58 58 HOH HOH B .
D 2 HOH 14 59 59 HOH HOH B .
D 2 HOH 15 60 60 HOH HOH B .
D 2 HOH 16 67 67 HOH HOH B .
D 2 HOH 17 68 68 HOH HOH B .
D 2 HOH 18 73 73 HOH HOH B .
D 2 HOH 19 75 75 HOH HOH B .
D 2 HOH 20 76 76 HOH HOH B .
D 2 HOH 21 77 77 HOH HOH B .
D 2 HOH 22 79 79 HOH HOH B .
D 2 HOH 23 81 81 HOH HOH B .
D 2 HOH 24 82 82 HOH HOH B .
D 2 HOH 25 83 83 HOH HOH B .
D 2 HOH 26 84 84 HOH HOH B .
D 2 HOH 27 85 85 HOH HOH B .
D 2 HOH 28 87 87 HOH HOH B .
D 2 HOH 29 88 88 HOH HOH B .
D 2 HOH 30 89 89 HOH HOH B .
D 2 HOH 31 91 91 HOH HOH B .
D 2 HOH 32 92 92 HOH HOH B .
D 2 HOH 33 94 94 HOH HOH B .
D 2 HOH 34 97 97 HOH HOH B .
D 2 HOH 35 99 99 HOH HOH B .
D 2 HOH 36 100 100 HOH HOH B .
D 2 HOH 37 103 103 HOH HOH B .
D 2 HOH 38 106 106 HOH HOH B .
D 2 HOH 39 107 107 HOH HOH B .
D 2 HOH 40 108 108 HOH HOH B .
D 2 HOH 41 111 111 HOH HOH B .
D 2 HOH 42 113 113 HOH HOH B .
D 2 HOH 43 116 116 HOH HOH B .
D 2 HOH 44 117 117 HOH HOH B .
#
_pdbx_struct_assembly.id 1
_pdbx_struct_assembly.details author_defined_assembly
_pdbx_struct_assembly.method_details ?
_pdbx_struct_assembly.oligomeric_details dimeric
_pdbx_struct_assembly.oligomeric_count 2
#
_pdbx_struct_assembly_gen.assembly_id 1
_pdbx_struct_assembly_gen.oper_expression 1
_pdbx_struct_assembly_gen.asym_id_list A,B,C,D
#
_pdbx_struct_oper_list.id 1
_pdbx_struct_oper_list.type 'identity operation'
_pdbx_struct_oper_list.name 1_555
_pdbx_struct_oper_list.symmetry_operation x,y,z
_pdbx_struct_oper_list.matrix[1][1] 1.0000000000
_pdbx_struct_oper_list.matrix[1][2] 0.0000000000
_pdbx_struct_oper_list.matrix[1][3] 0.0000000000
_pdbx_struct_oper_list.vector[1] 0.0000000000
_pdbx_struct_oper_list.matrix[2][1] 0.0000000000
_pdbx_struct_oper_list.matrix[2][2] 1.0000000000
_pdbx_struct_oper_list.matrix[2][3] 0.0000000000
_pdbx_struct_oper_list.vector[2] 0.0000000000
_pdbx_struct_oper_list.matrix[3][1] 0.0000000000
_pdbx_struct_oper_list.matrix[3][2] 0.0000000000
_pdbx_struct_oper_list.matrix[3][3] 1.0000000000
_pdbx_struct_oper_list.vector[3] 0.0000000000
#
loop_
_pdbx_audit_revision_history.ordinal
_pdbx_audit_revision_history.data_content_type
_pdbx_audit_revision_history.major_revision
_pdbx_audit_revision_history.minor_revision
_pdbx_audit_revision_history.revision_date
1 'Structure model' 1 0 1991-04-15
2 'Structure model' 1 1 2008-05-22
3 'Structure model' 1 2 2011-07-13
4 'Structure model' 1 3 2018-04-18
#
_pdbx_audit_revision_details.ordinal 1
_pdbx_audit_revision_details.revision_ordinal 1
_pdbx_audit_revision_details.data_content_type 'Structure model'
_pdbx_audit_revision_details.provider repository
_pdbx_audit_revision_details.type 'Initial release'
_pdbx_audit_revision_details.description ?
#
loop_
_pdbx_audit_revision_group.ordinal
_pdbx_audit_revision_group.revision_ordinal
_pdbx_audit_revision_group.data_content_type
_pdbx_audit_revision_group.group
1 2 'Structure model' 'Version format compliance'
2 3 'Structure model' 'Version format compliance'
3 4 'Structure model' 'Data collection'
#
_pdbx_audit_revision_category.ordinal 1
_pdbx_audit_revision_category.revision_ordinal 4
_pdbx_audit_revision_category.data_content_type 'Structure model'
_pdbx_audit_revision_category.category diffrn_detector
#
_pdbx_audit_revision_item.ordinal 1
_pdbx_audit_revision_item.revision_ordinal 4
_pdbx_audit_revision_item.data_content_type 'Structure model'
_pdbx_audit_revision_item.item '_diffrn_detector.detector'
#
loop_
_refine_B_iso.class
_refine_B_iso.details
_refine_B_iso.treatment
_refine_B_iso.pdbx_refine_id
'ALL ATOMS' TR isotropic 'X-RAY DIFFRACTION'
'ALL WATERS' TR isotropic 'X-RAY DIFFRACTION'
#
loop_
_refine_occupancy.class
_refine_occupancy.treatment
_refine_occupancy.pdbx_refine_id
'ALL ATOMS' fix 'X-RAY DIFFRACTION'
'ALL WATERS' ref 'X-RAY DIFFRACTION'
#
_software.name NUCLSQ
_software.classification refinement
_software.version .
_software.citation_id ?
_software.pdbx_ordinal 1
#
loop_
_pdbx_validate_rmsd_bond.id
_pdbx_validate_rmsd_bond.PDB_model_num
_pdbx_validate_rmsd_bond.auth_atom_id_1
_pdbx_validate_rmsd_bond.auth_asym_id_1
_pdbx_validate_rmsd_bond.auth_comp_id_1
_pdbx_validate_rmsd_bond.auth_seq_id_1
_pdbx_validate_rmsd_bond.PDB_ins_code_1
_pdbx_validate_rmsd_bond.label_alt_id_1
_pdbx_validate_rmsd_bond.auth_atom_id_2
_pdbx_validate_rmsd_bond.auth_asym_id_2
_pdbx_validate_rmsd_bond.auth_comp_id_2
_pdbx_validate_rmsd_bond.auth_seq_id_2
_pdbx_validate_rmsd_bond.PDB_ins_code_2
_pdbx_validate_rmsd_bond.label_alt_id_2
_pdbx_validate_rmsd_bond.bond_value
_pdbx_validate_rmsd_bond.bond_target_value
_pdbx_validate_rmsd_bond.bond_deviation
_pdbx_validate_rmsd_bond.bond_standard_deviation
_pdbx_validate_rmsd_bond.linker_flag
1 1 P A U 4 ? ? "O5'" A U 4 ? ? 1.505 1.593 -0.088 0.010 N
2 1 P A A 5 ? ? "O5'" A A 5 ? ? 1.523 1.593 -0.070 0.010 N
3 1 "O3'" A A 7 ? ? P A U 8 ? ? 1.533 1.607 -0.074 0.012 Y
4 1 "O3'" A A 9 ? ? P A U 10 ? ? 1.487 1.607 -0.120 0.012 Y
5 1 P B U 20 ? ? "O5'" B U 20 ? ? 1.518 1.593 -0.075 0.010 N
6 1 P B A 27 ? ? "O5'" B A 27 ? ? 1.658 1.593 0.065 0.010 N
#
loop_
_pdbx_validate_rmsd_angle.id
_pdbx_validate_rmsd_angle.PDB_model_num
_pdbx_validate_rmsd_angle.auth_atom_id_1
_pdbx_validate_rmsd_angle.auth_asym_id_1
_pdbx_validate_rmsd_angle.auth_comp_id_1
_pdbx_validate_rmsd_angle.auth_seq_id_1
_pdbx_validate_rmsd_angle.PDB_ins_code_1
_pdbx_validate_rmsd_angle.label_alt_id_1
_pdbx_validate_rmsd_angle.auth_atom_id_2
_pdbx_validate_rmsd_angle.auth_asym_id_2
_pdbx_validate_rmsd_angle.auth_comp_id_2
_pdbx_validate_rmsd_angle.auth_seq_id_2
_pdbx_validate_rmsd_angle.PDB_ins_code_2
_pdbx_validate_rmsd_angle.label_alt_id_2
_pdbx_validate_rmsd_angle.auth_atom_id_3
_pdbx_validate_rmsd_angle.auth_asym_id_3
_pdbx_validate_rmsd_angle.auth_comp_id_3
_pdbx_validate_rmsd_angle.auth_seq_id_3
_pdbx_validate_rmsd_angle.PDB_ins_code_3
_pdbx_validate_rmsd_angle.label_alt_id_3
_pdbx_validate_rmsd_angle.angle_value
_pdbx_validate_rmsd_angle.angle_target_value
_pdbx_validate_rmsd_angle.angle_deviation
_pdbx_validate_rmsd_angle.angle_standard_deviation
_pdbx_validate_rmsd_angle.linker_flag
1 1 "O4'" A U 1 ? ? "C1'" A U 1 ? ? N1 A U 1 ? ? 100.68 108.20 -7.52 0.80 N
2 1 C2 A U 1 ? ? N3 A U 1 ? ? C4 A U 1 ? ? 123.24 127.00 -3.76 0.60 N
3 1 N3 A U 1 ? ? C4 A U 1 ? ? C5 A U 1 ? ? 118.43 114.60 3.83 0.60 N
4 1 "O5'" A U 2 ? ? "C5'" A U 2 ? ? "C4'" A U 2 ? ? 104.44 109.40 -4.96 0.80 N
5 1 N3 A U 2 ? ? C4 A U 2 ? ? C5 A U 2 ? ? 119.68 114.60 5.08 0.60 N
6 1 N3 A U 2 ? ? C4 A U 2 ? ? O4 A U 2 ? ? 113.12 119.40 -6.28 0.70 N
7 1 "O5'" A A 3 ? ? P A A 3 ? ? OP1 A A 3 ? ? 121.60 110.70 10.90 1.20 N
8 1 N1 A A 3 ? ? C2 A A 3 ? ? N3 A A 3 ? ? 125.19 129.30 -4.11 0.50 N
9 1 P A U 4 ? ? "O5'" A U 4 ? ? "C5'" A U 4 ? ? 131.34 120.90 10.44 1.60 N
10 1 C2 A U 4 ? ? N3 A U 4 ? ? C4 A U 4 ? ? 123.20 127.00 -3.80 0.60 N
11 1 N3 A U 4 ? ? C4 A U 4 ? ? C5 A U 4 ? ? 118.49 114.60 3.89 0.60 N
12 1 P A A 5 ? ? "O5'" A A 5 ? ? "C5'" A A 5 ? ? 131.20 120.90 10.30 1.60 N
13 1 C5 A A 5 ? ? C6 A A 5 ? ? N1 A A 5 ? ? 114.45 117.70 -3.25 0.50 N
14 1 N1 A A 5 ? ? C6 A A 5 ? ? N6 A A 5 ? ? 123.90 118.60 5.30 0.60 N
15 1 C2 A U 6 ? ? N3 A U 6 ? ? C4 A U 6 ? ? 122.63 127.00 -4.37 0.60 N
16 1 N3 A U 6 ? ? C4 A U 6 ? ? C5 A U 6 ? ? 119.52 114.60 4.92 0.60 N
17 1 N3 A U 6 ? ? C4 A U 6 ? ? O4 A U 6 ? ? 114.27 119.40 -5.13 0.70 N
18 1 "O5'" A A 7 ? ? P A A 7 ? ? OP2 A A 7 ? ? 122.00 110.70 11.30 1.20 N
19 1 "O5'" A A 7 ? ? "C5'" A A 7 ? ? "C4'" A A 7 ? ? 103.68 109.40 -5.72 0.80 N
20 1 P A A 7 ? ? "O5'" A A 7 ? ? "C5'" A A 7 ? ? 105.55 120.90 -15.35 1.60 N
21 1 N1 A A 7 ? ? C2 A A 7 ? ? N3 A A 7 ? ? 125.85 129.30 -3.45 0.50 N
22 1 "O5'" A U 8 ? ? "C5'" A U 8 ? ? "C4'" A U 8 ? ? 101.32 109.40 -8.08 0.80 N
23 1 C2 A U 8 ? ? N3 A U 8 ? ? C4 A U 8 ? ? 123.28 127.00 -3.72 0.60 N
24 1 N3 A U 8 ? ? C4 A U 8 ? ? C5 A U 8 ? ? 118.23 114.60 3.63 0.60 N
25 1 C5 A U 8 ? ? C4 A U 8 ? ? O4 A U 8 ? ? 122.06 125.90 -3.84 0.60 N
26 1 "C3'" A U 8 ? ? "O3'" A U 8 ? ? P A A 9 ? ? 107.90 119.70 -11.80 1.20 Y
27 1 "O5'" A A 9 ? ? "C5'" A A 9 ? ? "C4'" A A 9 ? ? 101.43 109.40 -7.97 0.80 N
28 1 "O4'" A A 9 ? ? "C1'" A A 9 ? ? N9 A A 9 ? ? 113.61 108.50 5.11 0.70 N
29 1 C6 A A 9 ? ? N1 A A 9 ? ? C2 A A 9 ? ? 122.38 118.60 3.78 0.60 N
30 1 N1 A A 9 ? ? C2 A A 9 ? ? N3 A A 9 ? ? 125.48 129.30 -3.82 0.50 N
31 1 C5 A A 9 ? ? C6 A A 9 ? ? N1 A A 9 ? ? 114.37 117.70 -3.33 0.50 N
32 1 "C3'" A A 9 ? ? "O3'" A A 9 ? ? P A U 10 ? ? 129.40 119.70 9.70 1.20 Y
33 1 "O3'" A A 9 ? ? P A U 10 ? ? OP1 A U 10 ? ? 121.24 110.50 10.74 1.10 Y
34 1 OP1 A U 10 ? ? P A U 10 ? ? OP2 A U 10 ? ? 106.58 119.60 -13.02 1.50 N
35 1 N3 A U 10 ? ? C4 A U 10 ? ? C5 A U 10 ? ? 119.72 114.60 5.12 0.60 N
36 1 C4 A U 10 ? ? C5 A U 10 ? ? C6 A U 10 ? ? 115.59 119.70 -4.11 0.60 N
37 1 C5 A U 10 ? ? C4 A U 10 ? ? O4 A U 10 ? ? 121.16 125.90 -4.74 0.60 N
38 1 "O5'" A A 11 ? ? "C5'" A A 11 ? ? "C4'" A A 11 ? ? 96.97 109.40 -12.43 0.80 N
39 1 P A A 11 ? ? "O5'" A A 11 ? ? "C5'" A A 11 ? ? 130.98 120.90 10.08 1.60 N
40 1 "C5'" A A 11 ? ? "C4'" A A 11 ? ? "O4'" A A 11 ? ? 100.75 109.10 -8.35 1.20 N
41 1 C5 A A 11 ? ? C6 A A 11 ? ? N1 A A 11 ? ? 114.43 117.70 -3.27 0.50 N
42 1 C8 A A 11 ? ? N9 A A 11 ? ? C4 A A 11 ? ? 108.35 105.80 2.55 0.40 N
43 1 N1 A A 11 ? ? C6 A A 11 ? ? N6 A A 11 ? ? 122.93 118.60 4.33 0.60 N
44 1 "O5'" A U 12 ? ? "C5'" A U 12 ? ? "C4'" A U 12 ? ? 103.93 109.40 -5.47 0.80 N
45 1 "O4'" A U 12 ? ? "C1'" A U 12 ? ? N1 A U 12 ? ? 112.72 108.50 4.22 0.70 N
46 1 N3 A U 12 ? ? C4 A U 12 ? ? C5 A U 12 ? ? 118.68 114.60 4.08 0.60 N
47 1 N1 A U 12 ? ? C2 A U 12 ? ? O2 A U 12 ? ? 117.17 122.80 -5.63 0.70 N
48 1 C5 A U 12 ? ? C4 A U 12 ? ? O4 A U 12 ? ? 121.64 125.90 -4.26 0.60 N
49 1 C6 A A 13 ? ? N1 A A 13 ? ? C2 A A 13 ? ? 123.15 118.60 4.55 0.60 N
50 1 N1 A A 13 ? ? C2 A A 13 ? ? N3 A A 13 ? ? 125.12 129.30 -4.18 0.50 N
51 1 C5 A A 13 ? ? C6 A A 13 ? ? N1 A A 13 ? ? 114.14 117.70 -3.56 0.50 N
52 1 N1 A A 14 ? ? C2 A A 14 ? ? N3 A A 14 ? ? 125.16 129.30 -4.14 0.50 N
53 1 C2 A A 14 ? ? N3 A A 14 ? ? C4 A A 14 ? ? 114.17 110.60 3.57 0.50 N
54 1 C2 B U 15 ? ? N3 B U 15 ? ? C4 B U 15 ? ? 123.12 127.00 -3.88 0.60 N
55 1 N3 B U 15 ? ? C4 B U 15 ? ? C5 B U 15 ? ? 119.24 114.60 4.64 0.60 N
56 1 C5 B U 15 ? ? C4 B U 15 ? ? O4 B U 15 ? ? 121.73 125.90 -4.17 0.60 N
57 1 "O5'" B U 16 ? ? P B U 16 ? ? OP1 B U 16 ? ? 121.93 110.70 11.23 1.20 N
58 1 N3 B U 16 ? ? C4 B U 16 ? ? C5 B U 16 ? ? 118.94 114.60 4.34 0.60 N
59 1 N3 B U 16 ? ? C4 B U 16 ? ? O4 B U 16 ? ? 114.20 119.40 -5.20 0.70 N
60 1 "C3'" B U 16 ? ? "O3'" B U 16 ? ? P B A 17 ? ? 107.88 119.70 -11.82 1.20 Y
61 1 "O5'" B A 17 ? ? "C5'" B A 17 ? ? "C4'" B A 17 ? ? 104.41 109.40 -4.99 0.80 N
62 1 N3 B U 18 ? ? C4 B U 18 ? ? C5 B U 18 ? ? 118.74 114.60 4.14 0.60 N
63 1 N3 B U 18 ? ? C4 B U 18 ? ? O4 B U 18 ? ? 113.98 119.40 -5.42 0.70 N
64 1 "O5'" B A 19 ? ? "C5'" B A 19 ? ? "C4'" B A 19 ? ? 104.49 109.40 -4.91 0.80 N
65 1 "O4'" B A 19 ? ? "C1'" B A 19 ? ? N9 B A 19 ? ? 114.73 108.50 6.23 0.70 N
66 1 C6 B A 19 ? ? N1 B A 19 ? ? C2 B A 19 ? ? 124.33 118.60 5.73 0.60 N
67 1 N1 B A 19 ? ? C2 B A 19 ? ? N3 B A 19 ? ? 124.22 129.30 -5.08 0.50 N
68 1 C5 B A 19 ? ? C6 B A 19 ? ? N1 B A 19 ? ? 113.55 117.70 -4.15 0.50 N
69 1 "C3'" B A 19 ? ? "O3'" B A 19 ? ? P B U 20 ? ? 130.45 119.70 10.75 1.20 Y
70 1 "O5'" B U 20 ? ? P B U 20 ? ? OP1 B U 20 ? ? 118.18 110.70 7.48 1.20 N
71 1 P B U 20 ? ? "O5'" B U 20 ? ? "C5'" B U 20 ? ? 137.98 120.90 17.08 1.60 N
72 1 N3 B U 20 ? ? C4 B U 20 ? ? C5 B U 20 ? ? 118.32 114.60 3.72 0.60 N
73 1 N3 B U 20 ? ? C4 B U 20 ? ? O4 B U 20 ? ? 113.56 119.40 -5.84 0.70 N
74 1 "O5'" B A 21 ? ? P B A 21 ? ? OP1 B A 21 ? ? 122.59 110.70 11.89 1.20 N
75 1 N1 B A 21 ? ? C2 B A 21 ? ? N3 B A 21 ? ? 124.93 129.30 -4.37 0.50 N
76 1 "O3'" B A 21 ? ? P B U 22 ? ? OP2 B U 22 ? ? 121.25 110.50 10.75 1.10 Y
77 1 "O5'" B U 22 ? ? "C5'" B U 22 ? ? "C4'" B U 22 ? ? 99.65 109.40 -9.75 0.80 N
78 1 P B U 22 ? ? "O5'" B U 22 ? ? "C5'" B U 22 ? ? 103.74 120.90 -17.16 1.60 N
79 1 N1 B U 22 ? ? C2 B U 22 ? ? N3 B U 22 ? ? 119.69 114.90 4.79 0.60 N
80 1 C2 B U 22 ? ? N3 B U 22 ? ? C4 B U 22 ? ? 122.70 127.00 -4.30 0.60 N
81 1 N1 B U 22 ? ? C2 B U 22 ? ? O2 B U 22 ? ? 116.77 122.80 -6.03 0.70 N
82 1 "C3'" B U 22 ? ? "O3'" B U 22 ? ? P B A 23 ? ? 108.38 119.70 -11.32 1.20 Y
83 1 "O5'" B A 23 ? ? "C5'" B A 23 ? ? "C4'" B A 23 ? ? 103.21 109.40 -6.19 0.80 N
84 1 N9 B A 23 ? ? "C1'" B A 23 ? ? "C2'" B A 23 ? ? 105.37 112.00 -6.63 1.10 N
85 1 "O4'" B A 23 ? ? "C1'" B A 23 ? ? N9 B A 23 ? ? 114.78 108.50 6.28 0.70 N
86 1 C6 B A 23 ? ? N1 B A 23 ? ? C2 B A 23 ? ? 124.06 118.60 5.46 0.60 N
87 1 N1 B A 23 ? ? C2 B A 23 ? ? N3 B A 23 ? ? 125.66 129.30 -3.64 0.50 N
88 1 C5 B A 23 ? ? C6 B A 23 ? ? N1 B A 23 ? ? 112.41 117.70 -5.29 0.50 N
89 1 N1 B A 23 ? ? C6 B A 23 ? ? N6 B A 23 ? ? 123.43 118.60 4.83 0.60 N
90 1 "C3'" B A 23 ? ? "O3'" B A 23 ? ? P B U 24 ? ? 129.12 119.70 9.42 1.20 Y
91 1 "O5'" B U 24 ? ? P B U 24 ? ? OP1 B U 24 ? ? 118.38 110.70 7.68 1.20 N
92 1 C4 B U 24 ? ? C5 B U 24 ? ? C6 B U 24 ? ? 115.24 119.70 -4.46 0.60 N
93 1 C5 B U 24 ? ? C6 B U 24 ? ? N1 B U 24 ? ? 127.00 122.70 4.30 0.50 N
94 1 N3 B U 24 ? ? C4 B U 24 ? ? O4 B U 24 ? ? 114.62 119.40 -4.78 0.70 N
95 1 OP1 B A 25 ? ? P B A 25 ? ? OP2 B A 25 ? ? 110.36 119.60 -9.24 1.50 N
96 1 "O5'" B A 25 ? ? P B A 25 ? ? OP2 B A 25 ? ? 123.00 110.70 12.30 1.20 N
97 1 "O5'" B A 25 ? ? "C5'" B A 25 ? ? "C4'" B A 25 ? ? 102.60 109.40 -6.80 0.80 N
98 1 "O4'" B A 25 ? ? "C1'" B A 25 ? ? N9 B A 25 ? ? 112.80 108.50 4.30 0.70 N
99 1 C6 B A 25 ? ? N1 B A 25 ? ? C2 B A 25 ? ? 122.46 118.60 3.86 0.60 N
100 1 N1 B A 25 ? ? C2 B A 25 ? ? N3 B A 25 ? ? 125.63 129.30 -3.67 0.50 N
101 1 C5 B A 25 ? ? C6 B A 25 ? ? N1 B A 25 ? ? 114.21 117.70 -3.49 0.50 N
102 1 OP1 B U 26 ? ? P B U 26 ? ? OP2 B U 26 ? ? 106.42 119.60 -13.18 1.50 N
103 1 "O5'" B U 26 ? ? P B U 26 ? ? OP1 B U 26 ? ? 118.95 110.70 8.25 1.20 N
104 1 N1 B U 26 ? ? C2 B U 26 ? ? O2 B U 26 ? ? 118.20 122.80 -4.60 0.70 N
105 1 C5 B U 26 ? ? C4 B U 26 ? ? O4 B U 26 ? ? 120.83 125.90 -5.07 0.60 N
106 1 "O3'" B U 26 ? ? P B A 27 ? ? "O5'" B A 27 ? ? 92.03 104.00 -11.97 1.90 Y
107 1 "O3'" B U 26 ? ? P B A 27 ? ? OP2 B A 27 ? ? 122.73 110.50 12.23 1.10 Y
108 1 "O3'" B A 27 ? ? P B A 28 ? ? OP1 B A 28 ? ? 91.52 105.20 -13.68 2.20 Y
109 1 "O5'" B A 28 ? ? P B A 28 ? ? OP2 B A 28 ? ? 120.02 110.70 9.32 1.20 N
110 1 P B A 28 ? ? "O5'" B A 28 ? ? "C5'" B A 28 ? ? 130.97 120.90 10.07 1.60 N
111 1 C6 B A 28 ? ? N1 B A 28 ? ? C2 B A 28 ? ? 122.91 118.60 4.31 0.60 N
112 1 N1 B A 28 ? ? C2 B A 28 ? ? N3 B A 28 ? ? 125.35 129.30 -3.95 0.50 N
113 1 C5 B A 28 ? ? C6 B A 28 ? ? N1 B A 28 ? ? 114.12 117.70 -3.58 0.50 N
#
loop_
_ndb_struct_conf_na.entry_id
_ndb_struct_conf_na.feature
1RNA 'double helix'
1RNA 'a-form double helix'
#
loop_
_ndb_struct_na_base_pair.model_number
_ndb_struct_na_base_pair.i_label_asym_id
_ndb_struct_na_base_pair.i_label_comp_id
_ndb_struct_na_base_pair.i_label_seq_id
_ndb_struct_na_base_pair.i_symmetry
_ndb_struct_na_base_pair.j_label_asym_id
_ndb_struct_na_base_pair.j_label_comp_id
_ndb_struct_na_base_pair.j_label_seq_id
_ndb_struct_na_base_pair.j_symmetry
_ndb_struct_na_base_pair.shear
_ndb_struct_na_base_pair.stretch
_ndb_struct_na_base_pair.stagger
_ndb_struct_na_base_pair.buckle
_ndb_struct_na_base_pair.propeller
_ndb_struct_na_base_pair.opening
_ndb_struct_na_base_pair.pair_number
_ndb_struct_na_base_pair.pair_name
_ndb_struct_na_base_pair.i_auth_asym_id
_ndb_struct_na_base_pair.i_auth_seq_id
_ndb_struct_na_base_pair.i_PDB_ins_code
_ndb_struct_na_base_pair.j_auth_asym_id
_ndb_struct_na_base_pair.j_auth_seq_id
_ndb_struct_na_base_pair.j_PDB_ins_code
_ndb_struct_na_base_pair.hbond_type_28
_ndb_struct_na_base_pair.hbond_type_12
1 A U 1 1_555 B A 14 1_555 -0.049 -0.122 0.012 -4.896 -28.802 -0.602 1 A_U1:A28_B A 1 ? B 28 ? 20 1
1 A U 2 1_555 B A 13 1_555 0.388 -0.183 0.126 7.500 -15.965 0.653 2 A_U2:A27_B A 2 ? B 27 ? 20 1
1 A A 3 1_555 B U 12 1_555 0.134 -0.111 0.149 -3.378 -17.650 -3.062 3 A_A3:U26_B A 3 ? B 26 ? 20 1
1 A U 4 1_555 B A 11 1_555 0.265 -0.169 -0.333 10.739 -20.033 3.454 4 A_U4:A25_B A 4 ? B 25 ? 20 1
1 A A 5 1_555 B U 10 1_555 -0.719 -0.343 0.349 -1.517 -16.449 0.801 5 A_A5:U24_B A 5 ? B 24 ? 20 1
1 A U 6 1_555 B A 9 1_555 0.437 -0.242 -0.025 -0.198 -18.752 2.017 6 A_U6:A23_B A 6 ? B 23 ? 20 1
1 A A 7 1_555 B U 8 1_555 0.075 -0.108 0.137 0.213 -18.580 -1.161 7 A_A7:U22_B A 7 ? B 22 ? 20 1
1 A U 8 1_555 B A 7 1_555 -0.278 -0.002 -0.289 5.123 -18.947 -3.059 8 A_U8:A21_B A 8 ? B 21 ? 20 1
1 A A 9 1_555 B U 6 1_555 -0.489 -0.210 0.141 1.280 -23.694 1.358 9 A_A9:U20_B A 9 ? B 20 ? 20 1
1 A U 10 1_555 B A 5 1_555 0.047 -0.156 -0.006 0.859 -17.326 -0.261 10 A_U10:A19_B A 10 ? B 19 ? 20 1
1 A A 11 1_555 B U 4 1_555 -0.780 -0.309 -0.048 -3.703 -15.985 0.298 11 A_A11:U18_B A 11 ? B 18 ? 20 1
1 A U 12 1_555 B A 3 1_555 0.033 -0.094 0.070 3.776 -20.801 -4.071 12 A_U12:A17_B A 12 ? B 17 ? 20 1
1 A A 13 1_555 B U 2 1_555 -0.368 -0.180 -0.402 -8.713 -21.687 4.344 13 A_A13:U16_B A 13 ? B 16 ? 20 1
1 A A 14 1_555 B U 1 1_555 0.264 -0.107 0.777 10.566 -15.067 -5.718 14 A_A14:U15_B A 14 ? B 15 ? 20 1
#
loop_
_ndb_struct_na_base_pair_step.model_number
_ndb_struct_na_base_pair_step.i_label_asym_id_1
_ndb_struct_na_base_pair_step.i_label_comp_id_1
_ndb_struct_na_base_pair_step.i_label_seq_id_1
_ndb_struct_na_base_pair_step.i_symmetry_1
_ndb_struct_na_base_pair_step.j_label_asym_id_1
_ndb_struct_na_base_pair_step.j_label_comp_id_1
_ndb_struct_na_base_pair_step.j_label_seq_id_1
_ndb_struct_na_base_pair_step.j_symmetry_1
_ndb_struct_na_base_pair_step.i_label_asym_id_2
_ndb_struct_na_base_pair_step.i_label_comp_id_2
_ndb_struct_na_base_pair_step.i_label_seq_id_2
_ndb_struct_na_base_pair_step.i_symmetry_2
_ndb_struct_na_base_pair_step.j_label_asym_id_2
_ndb_struct_na_base_pair_step.j_label_comp_id_2
_ndb_struct_na_base_pair_step.j_label_seq_id_2
_ndb_struct_na_base_pair_step.j_symmetry_2
_ndb_struct_na_base_pair_step.shift
_ndb_struct_na_base_pair_step.slide
_ndb_struct_na_base_pair_step.rise
_ndb_struct_na_base_pair_step.tilt
_ndb_struct_na_base_pair_step.roll
_ndb_struct_na_base_pair_step.twist
_ndb_struct_na_base_pair_step.x_displacement
_ndb_struct_na_base_pair_step.y_displacement
_ndb_struct_na_base_pair_step.helical_rise
_ndb_struct_na_base_pair_step.inclination
_ndb_struct_na_base_pair_step.tip
_ndb_struct_na_base_pair_step.helical_twist
_ndb_struct_na_base_pair_step.step_number
_ndb_struct_na_base_pair_step.step_name
_ndb_struct_na_base_pair_step.i_auth_asym_id_1
_ndb_struct_na_base_pair_step.i_auth_seq_id_1
_ndb_struct_na_base_pair_step.i_PDB_ins_code_1
_ndb_struct_na_base_pair_step.j_auth_asym_id_1
_ndb_struct_na_base_pair_step.j_auth_seq_id_1
_ndb_struct_na_base_pair_step.j_PDB_ins_code_1
_ndb_struct_na_base_pair_step.i_auth_asym_id_2
_ndb_struct_na_base_pair_step.i_auth_seq_id_2
_ndb_struct_na_base_pair_step.i_PDB_ins_code_2
_ndb_struct_na_base_pair_step.j_auth_asym_id_2
_ndb_struct_na_base_pair_step.j_auth_seq_id_2
_ndb_struct_na_base_pair_step.j_PDB_ins_code_2
1 A U 1 1_555 B A 14 1_555 A U 2 1_555 B A 13 1_555 -0.328 -0.569 3.092 -5.485 4.824 34.386 -1.622 -0.229 3.003 8.047 9.149
35.131 1 AA_U1U2:A27A28_BB A 1 ? B 28 ? A 2 ? B 27 ?
1 A U 2 1_555 B A 13 1_555 A A 3 1_555 B U 12 1_555 -0.339 -1.320 3.517 -2.566 12.709 31.406 -4.317 0.167 2.807 22.324 4.507
33.915 2 AA_U2A3:U26A27_BB A 2 ? B 27 ? A 3 ? B 26 ?
1 A A 3 1_555 B U 12 1_555 A U 4 1_555 B A 11 1_555 0.561 -1.172 2.914 5.339 1.655 28.943 -2.620 -0.081 2.898 3.274 -10.558
29.466 3 AA_A3U4:A25U26_BB A 3 ? B 26 ? A 4 ? B 25 ?
1 A U 4 1_555 B A 11 1_555 A A 5 1_555 B U 10 1_555 -0.039 -1.362 3.500 -5.623 13.083 29.999 -4.571 -0.870 2.657 23.671 10.173
33.137 4 AA_U4A5:U24A25_BB A 4 ? B 25 ? A 5 ? B 24 ?
1 A A 5 1_555 B U 10 1_555 A U 6 1_555 B A 9 1_555 -0.232 -1.201 3.267 1.463 6.296 37.676 -2.603 0.532 3.024 9.662 -2.244
38.207 5 AA_A5U6:A23U24_BB A 5 ? B 24 ? A 6 ? B 23 ?
1 A U 6 1_555 B A 9 1_555 A A 7 1_555 B U 8 1_555 -0.203 -1.466 3.168 0.056 10.393 28.505 -4.677 0.398 2.491 20.274 -0.110
30.304 6 AA_U6A7:U22A23_BB A 6 ? B 23 ? A 7 ? B 22 ?
1 A A 7 1_555 B U 8 1_555 A U 8 1_555 B A 7 1_555 -0.243 -1.272 3.206 1.542 13.715 29.393 -4.447 0.680 2.378 25.343 -2.849
32.407 7 AA_A7U8:A21U22_BB A 7 ? B 22 ? A 8 ? B 21 ?
1 A U 8 1_555 B A 7 1_555 A A 9 1_555 B U 6 1_555 0.251 -1.328 3.411 -3.519 16.438 28.909 -4.881 -0.988 2.301 29.945 6.410
33.350 8 AA_U8A9:U20A21_BB A 8 ? B 21 ? A 9 ? B 20 ?
1 A A 9 1_555 B U 6 1_555 A U 10 1_555 B A 5 1_555 -0.044 -1.067 3.337 -0.540 10.533 36.121 -2.998 -0.001 2.923 16.558 0.849
37.580 9 AA_A9U10:A19U20_BB A 9 ? B 20 ? A 10 ? B 19 ?
1 A U 10 1_555 B A 5 1_555 A A 11 1_555 B U 4 1_555 0.899 -1.407 3.377 3.020 14.066 20.748 -7.032 -1.243 2.118 34.245 -7.352
25.203 10 AA_U10A11:U18A19_BB A 10 ? B 19 ? A 11 ? B 18 ?
1 A A 11 1_555 B U 4 1_555 A U 12 1_555 B A 3 1_555 -0.472 -1.356 3.109 -1.013 3.472 34.636 -2.759 0.645 2.975 5.812 1.695
34.819 11 AA_A11U12:A17U18_BB A 11 ? B 18 ? A 12 ? B 17 ?
1 A U 12 1_555 B A 3 1_555 A A 13 1_555 B U 2 1_555 0.146 -1.503 3.476 0.168 14.771 35.182 -4.137 -0.202 2.657 23.213 -0.264
38.067 12 AA_U12A13:U16A17_BB A 12 ? B 17 ? A 13 ? B 16 ?
1 A A 13 1_555 B U 2 1_555 A A 14 1_555 B U 1 1_555 -0.063 -1.188 2.662 -6.607 3.949 35.936 -2.315 -0.620 2.494 6.312 10.559
36.725 13 AA_A13A14:U15U16_BB A 13 ? B 16 ? A 14 ? B 15 ?
#
_pdbx_entity_nonpoly.entity_id 2
_pdbx_entity_nonpoly.name water
_pdbx_entity_nonpoly.comp_id HOH
#
|
