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Upload 1bn0_MC with huggingface_hub

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@@ -0,0 +1,529 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Residue conformations -------------------------------------------
2
+ A1 : G C3p_endo anti
3
+ A2 : G C2p_exo anti
4
+ A3 : A C2p_exo anti
5
+ A4 : C C3p_endo anti
6
+ A5 : U C3p_endo anti
7
+ A6 : A C3p_endo anti
8
+ A7 : G C2p_exo anti
9
+ A8 : C C3p_endo anti
10
+ A9 : G C4p_exo anti
11
+ A10 : G C2p_endo syn
12
+ A11 : A O4p_endo syn
13
+ A12 : G C2p_exo anti
14
+ A13 : G C1p_endo anti
15
+ A14 : C C3p_endo anti
16
+ A15 : U C2p_exo anti
17
+ A16 : A C4p_exo anti
18
+ A17 : G C3p_endo anti
19
+ A18 : U C2p_exo anti
20
+ A19 : C C3p_endo anti
21
+ A20 : C C3p_endo anti
22
+ Adjacent stackings ----------------------------------------------
23
+ A2-A3 : adjacent_5p upward
24
+ A3-A4 : adjacent_5p upward
25
+ A6-A7 : adjacent_5p upward
26
+ A7-A8 : adjacent_5p upward
27
+ A13-A14 : adjacent_5p upward
28
+ A14-A15 : adjacent_5p upward
29
+ A15-A16 : adjacent_5p upward
30
+ A16-A17 : adjacent_5p upward
31
+ A17-A18 : adjacent_5p upward
32
+ A18-A19 : adjacent_5p upward
33
+ Non-Adjacent stackings ------------------------------------------
34
+ A6-A16 : outward
35
+ Number of stackings = 11
36
+ Number of adjacent stackings = 10
37
+ Number of non adjacent stackings = 1
38
+ Base-pairs ------------------------------------------------------
39
+ A1-A20 : G-C Ww/Ww pairing antiparallel cis XIX
40
+ A2-A19 : G-C Ww/Ww pairing antiparallel cis XIX
41
+ A3-A18 : A-U Ww/Ww pairing antiparallel cis XX
42
+ A4-A17 : C-G Ww/Ww pairing antiparallel cis XIX
43
+ A5-A16 : U-A Ww/Ww pairing antiparallel cis one_hbond
44
+ A6-A15 : A-U Ww/Ww pairing antiparallel cis XX
45
+ A7-A14 : G-C Ww/Ww pairing antiparallel cis XIX
46
+ A8-A13 : C-G Ww/Ww pairing antiparallel cis XIX
47
+ A9-A11 : G-A Wh/Hw pairing parallel cis one_hbond
48
+ A11-A13 : A-G Ss/O2P pairing
49
+ Residue conformations -------------------------------------------
50
+ A1 : G C3p_endo anti
51
+ A2 : G C2p_exo anti
52
+ A3 : A C2p_exo anti
53
+ A4 : C C3p_endo anti
54
+ A5 : U C3p_endo anti
55
+ A6 : A C3p_endo anti
56
+ A7 : G C2p_exo anti
57
+ A8 : C C3p_endo anti
58
+ A9 : G C3p_endo anti
59
+ A10 : G C3p_endo anti
60
+ A11 : A C4p_endo syn
61
+ A12 : G C2p_exo anti
62
+ A13 : G C2p_exo anti
63
+ A14 : C C3p_endo anti
64
+ A15 : U C2p_exo anti
65
+ A16 : A C4p_exo anti
66
+ A17 : G C2p_exo anti
67
+ A18 : U C1p_endo anti
68
+ A19 : C C4p_exo anti
69
+ A20 : C C3p_endo anti
70
+ Adjacent stackings ----------------------------------------------
71
+ A1-A2 : adjacent_5p upward
72
+ A2-A3 : adjacent_5p upward
73
+ A3-A4 : adjacent_5p upward
74
+ A6-A7 : adjacent_5p upward
75
+ A7-A8 : adjacent_5p upward
76
+ A13-A14 : adjacent_5p upward
77
+ A14-A15 : adjacent_5p upward
78
+ A15-A16 : adjacent_5p upward
79
+ A16-A17 : adjacent_5p upward
80
+ A17-A18 : adjacent_5p upward
81
+ A18-A19 : adjacent_5p upward
82
+ Non-Adjacent stackings ------------------------------------------
83
+ Number of stackings = 11
84
+ Number of adjacent stackings = 11
85
+ Number of non adjacent stackings = 0
86
+ Base-pairs ------------------------------------------------------
87
+ A1-A20 : G-C Ww/Ww pairing antiparallel cis XIX
88
+ A2-A19 : G-C Ww/Ww pairing antiparallel cis XIX
89
+ A3-A18 : A-U Ww/Ww pairing antiparallel cis XX
90
+ A4-A17 : C-G Ww/Ww pairing antiparallel cis XIX
91
+ A5-A16 : U-A Ww/Ww pairing antiparallel cis XX
92
+ A6-A15 : A-U Ww/Ww pairing antiparallel cis XX
93
+ A7-A14 : G-C Ww/Ww pairing antiparallel cis XIX
94
+ A8-A13 : C-G Ww/Ww pairing antiparallel cis XIX
95
+ Residue conformations -------------------------------------------
96
+ A1 : G C3p_endo anti
97
+ A2 : G C2p_exo anti
98
+ A3 : A C2p_exo anti
99
+ A4 : C C3p_endo anti
100
+ A5 : U C3p_endo anti
101
+ A6 : A C3p_endo anti
102
+ A7 : G C2p_exo anti
103
+ A8 : C C3p_endo anti
104
+ A9 : G C2p_exo anti
105
+ A10 : G C3p_exo syn
106
+ A11 : A O4p_endo syn
107
+ A12 : G C4p_endo anti
108
+ A13 : G C2p_exo anti
109
+ A14 : C C3p_endo anti
110
+ A15 : U C2p_exo anti
111
+ A16 : A C4p_exo anti
112
+ A17 : G C2p_exo anti
113
+ A18 : U C2p_exo anti
114
+ A19 : C C3p_endo anti
115
+ A20 : C C3p_endo anti
116
+ Adjacent stackings ----------------------------------------------
117
+ A1-A2 : adjacent_5p upward
118
+ A2-A3 : adjacent_5p upward
119
+ A3-A4 : adjacent_5p upward
120
+ A4-A5 : adjacent_5p upward
121
+ A5-A6 : adjacent_5p upward
122
+ A6-A7 : adjacent_5p upward
123
+ A7-A8 : adjacent_5p upward
124
+ A13-A14 : adjacent_5p upward
125
+ A14-A15 : adjacent_5p upward
126
+ A15-A16 : adjacent_5p upward
127
+ A16-A17 : adjacent_5p upward
128
+ A17-A18 : adjacent_5p upward
129
+ A18-A19 : adjacent_5p upward
130
+ Non-Adjacent stackings ------------------------------------------
131
+ Number of stackings = 13
132
+ Number of adjacent stackings = 13
133
+ Number of non adjacent stackings = 0
134
+ Base-pairs ------------------------------------------------------
135
+ A1-A20 : G-C Ww/Ww pairing antiparallel cis XIX
136
+ A2-A19 : G-C Ww/Ww pairing antiparallel cis XIX
137
+ A3-A18 : A-U Ww/Ww pairing antiparallel cis XX
138
+ A4-A17 : C-G Ww/Ww pairing antiparallel cis XIX
139
+ A5-A16 : U-A Ww/Ww pairing antiparallel cis XX
140
+ A6-A15 : A-U Ww/Ww pairing antiparallel cis XX
141
+ A7-A14 : G-C Ww/Ww pairing antiparallel cis XIX
142
+ A8-A13 : C-G Ww/Ww pairing antiparallel cis XIX
143
+ A10-A11 : G-A O2'/Hh adjacent_5p pairing
144
+ Residue conformations -------------------------------------------
145
+ A1 : G C3p_endo anti
146
+ A2 : G C2p_exo anti
147
+ A3 : A C2p_exo anti
148
+ A4 : C C3p_endo anti
149
+ A5 : U C3p_endo anti
150
+ A6 : A C3p_endo anti
151
+ A7 : G C2p_exo anti
152
+ A8 : C C3p_endo anti
153
+ A9 : G C2p_exo anti
154
+ A10 : G C4p_exo anti
155
+ A11 : A C2p_endo syn
156
+ A12 : G O4p_exo anti
157
+ A13 : G C2p_exo anti
158
+ A14 : C C3p_endo anti
159
+ A15 : U C2p_exo anti
160
+ A16 : A C4p_exo anti
161
+ A17 : G C2p_exo anti
162
+ A18 : U C2p_exo anti
163
+ A19 : C C3p_endo anti
164
+ A20 : C C3p_endo anti
165
+ Adjacent stackings ----------------------------------------------
166
+ A2-A3 : adjacent_5p upward
167
+ A3-A4 : adjacent_5p upward
168
+ A4-A5 : adjacent_5p upward
169
+ A5-A6 : adjacent_5p upward
170
+ A6-A7 : adjacent_5p upward
171
+ A7-A8 : adjacent_5p upward
172
+ A10-A11 : adjacent_5p upward
173
+ A13-A14 : adjacent_5p upward
174
+ A14-A15 : adjacent_5p upward
175
+ A15-A16 : adjacent_5p upward
176
+ A16-A17 : adjacent_5p upward
177
+ A17-A18 : adjacent_5p upward
178
+ A18-A19 : adjacent_5p upward
179
+ Non-Adjacent stackings ------------------------------------------
180
+ A6-A16 : outward
181
+ Number of stackings = 14
182
+ Number of adjacent stackings = 13
183
+ Number of non adjacent stackings = 1
184
+ Base-pairs ------------------------------------------------------
185
+ A1-A20 : G-C Ww/Ww pairing antiparallel cis XIX
186
+ A2-A19 : G-C Ww/Ww pairing antiparallel cis XIX
187
+ A3-A18 : A-U Ww/Ww pairing antiparallel cis XX
188
+ A4-A17 : C-G Ww/Ww pairing antiparallel cis XIX
189
+ A5-A16 : U-A Ww/Ww pairing antiparallel cis XX
190
+ A6-A15 : A-U Ww/Ww pairing antiparallel cis XX
191
+ A7-A14 : G-C Ww/Ww pairing antiparallel cis XIX
192
+ A8-A13 : C-G Ww/Ww pairing antiparallel cis XIX
193
+ Residue conformations -------------------------------------------
194
+ A1 : G C2p_exo anti
195
+ A2 : G C3p_endo anti
196
+ A3 : A C2p_exo anti
197
+ A4 : C C3p_endo anti
198
+ A5 : U C3p_endo anti
199
+ A6 : A C3p_endo anti
200
+ A7 : G C2p_exo anti
201
+ A8 : C C3p_endo anti
202
+ A9 : G C1p_endo anti
203
+ A10 : G C2p_endo syn
204
+ A11 : A O4p_exo syn
205
+ A12 : G C2p_exo anti
206
+ A13 : G C2p_exo anti
207
+ A14 : C C3p_endo anti
208
+ A15 : U C2p_endo anti
209
+ A16 : A C4p_exo anti
210
+ A17 : G C3p_endo anti
211
+ A18 : U C2p_exo anti
212
+ A19 : C C1p_exo anti
213
+ A20 : C C3p_endo anti
214
+ Adjacent stackings ----------------------------------------------
215
+ A2-A3 : adjacent_5p upward
216
+ A3-A4 : adjacent_5p upward
217
+ A5-A6 : adjacent_5p upward
218
+ A6-A7 : adjacent_5p upward
219
+ A7-A8 : adjacent_5p upward
220
+ A13-A14 : adjacent_5p upward
221
+ A14-A15 : adjacent_5p upward
222
+ A15-A16 : adjacent_5p upward
223
+ A16-A17 : adjacent_5p upward
224
+ A17-A18 : adjacent_5p upward
225
+ A18-A19 : adjacent_5p upward
226
+ Non-Adjacent stackings ------------------------------------------
227
+ Number of stackings = 11
228
+ Number of adjacent stackings = 11
229
+ Number of non adjacent stackings = 0
230
+ Base-pairs ------------------------------------------------------
231
+ A1-A20 : G-C Ww/Ww pairing antiparallel cis XIX
232
+ A2-A19 : G-C Ww/Ww pairing antiparallel cis XIX
233
+ A3-A18 : A-U Ww/Ww pairing antiparallel cis XX
234
+ A4-A17 : C-G Ww/Ww pairing antiparallel cis XIX
235
+ A5-A16 : U-A Ww/Ww pairing antiparallel cis XX
236
+ A6-A15 : A-U Ww/Ww pairing antiparallel cis XX
237
+ A7-A14 : G-C Ww/Ww pairing antiparallel cis XIX
238
+ A8-A13 : C-G Ww/Ww pairing antiparallel cis XIX
239
+ A9-A10 : G-G O2'/Ss adjacent_5p pairing
240
+ A10-A11 : G-A O2'/Hh adjacent_5p pairing
241
+ Residue conformations -------------------------------------------
242
+ A1 : G C2p_exo anti
243
+ A2 : G C2p_exo anti
244
+ A3 : A C2p_exo anti
245
+ A4 : C C3p_endo anti
246
+ A5 : U C3p_endo anti
247
+ A6 : A C2p_endo anti
248
+ A7 : G C2p_endo syn
249
+ A8 : C C2p_exo anti
250
+ A9 : G C2p_exo anti
251
+ A10 : G C2p_endo syn
252
+ A11 : A C2p_endo syn
253
+ A12 : G C2p_exo anti
254
+ A13 : G C2p_exo anti
255
+ A14 : C C3p_endo anti
256
+ A15 : U C2p_endo anti
257
+ A16 : A C4p_exo anti
258
+ A17 : G C3p_endo anti
259
+ A18 : U C2p_exo anti
260
+ A19 : C C1p_exo anti
261
+ A20 : C C3p_endo anti
262
+ Adjacent stackings ----------------------------------------------
263
+ A2-A3 : adjacent_5p upward
264
+ A3-A4 : adjacent_5p upward
265
+ A4-A5 : adjacent_5p upward
266
+ A6-A7 : adjacent_5p upward pairing
267
+ A13-A14 : adjacent_5p upward
268
+ A14-A15 : adjacent_5p upward
269
+ A15-A16 : adjacent_5p upward
270
+ A16-A17 : adjacent_5p upward
271
+ A17-A18 : adjacent_5p upward
272
+ A18-A19 : adjacent_5p upward
273
+ Non-Adjacent stackings ------------------------------------------
274
+ A6-A16 : outward
275
+ Number of stackings = 11
276
+ Number of adjacent stackings = 10
277
+ Number of non adjacent stackings = 1
278
+ Base-pairs ------------------------------------------------------
279
+ A1-A20 : G-C Ww/Ww pairing antiparallel cis XIX
280
+ A2-A19 : G-C Ww/Ww pairing antiparallel cis XIX
281
+ A3-A18 : A-U Ww/Ww pairing antiparallel cis XX
282
+ A4-A17 : C-G Ww/Ww pairing antiparallel cis XIX
283
+ A5-A16 : U-A Ww/Ww pairing antiparallel cis XX
284
+ A6-A7 : A-G O2'/C8 adjacent_5p upward pairing
285
+ A6-A15 : A-U Ww/Ww pairing antiparallel cis XX
286
+ A7-A14 : G-C Ww/Ww pairing antiparallel cis XIX
287
+ A8-A13 : C-G Ww/Ww pairing antiparallel cis XIX
288
+ A10-A11 : G-A O2'/Hh adjacent_5p pairing
289
+ Residue conformations -------------------------------------------
290
+ A1 : G C3p_endo anti
291
+ A2 : G C2p_exo anti
292
+ A3 : A C2p_exo anti
293
+ A4 : C C3p_endo anti
294
+ A5 : U C3p_endo anti
295
+ A6 : A C3p_endo anti
296
+ A7 : G C2p_exo anti
297
+ A8 : C C3p_endo anti
298
+ A9 : G C2p_exo anti
299
+ A10 : G C4p_exo anti
300
+ A11 : A C2p_endo syn
301
+ A12 : G O4p_exo anti
302
+ A13 : G C2p_exo anti
303
+ A14 : C C3p_endo anti
304
+ A15 : U C2p_endo anti
305
+ A16 : A C4p_exo anti
306
+ A17 : G C3p_endo anti
307
+ A18 : U C2p_exo anti
308
+ A19 : C C1p_exo anti
309
+ A20 : C C3p_endo anti
310
+ Adjacent stackings ----------------------------------------------
311
+ A2-A3 : adjacent_5p upward
312
+ A3-A4 : adjacent_5p upward
313
+ A4-A5 : adjacent_5p upward
314
+ A5-A6 : adjacent_5p upward
315
+ A6-A7 : adjacent_5p upward
316
+ A7-A8 : adjacent_5p upward
317
+ A8-A9 : adjacent_5p upward
318
+ A13-A14 : adjacent_5p upward
319
+ A14-A15 : adjacent_5p upward
320
+ A15-A16 : adjacent_5p upward
321
+ A16-A17 : adjacent_5p upward
322
+ A17-A18 : adjacent_5p upward
323
+ A18-A19 : adjacent_5p upward
324
+ Non-Adjacent stackings ------------------------------------------
325
+ A9-A11 : inward
326
+ Number of stackings = 14
327
+ Number of adjacent stackings = 13
328
+ Number of non adjacent stackings = 1
329
+ Base-pairs ------------------------------------------------------
330
+ A1-A20 : G-C Ww/Ww pairing antiparallel cis XIX
331
+ A2-A19 : G-C Ww/Ww pairing antiparallel cis XIX
332
+ A3-A18 : A-U Ww/Ww pairing antiparallel cis XX
333
+ A4-A17 : C-G Ww/Ww pairing antiparallel cis XIX
334
+ A5-A16 : U-A Ww/Ww pairing antiparallel cis XX
335
+ A6-A15 : A-U Ww/Ww pairing antiparallel cis XX
336
+ A7-A14 : G-C Ww/Ww pairing antiparallel cis XIX
337
+ A8-A13 : C-G Ww/Ww pairing antiparallel cis XIX
338
+ Residue conformations -------------------------------------------
339
+ A1 : G C3p_endo anti
340
+ A2 : G C3p_endo anti
341
+ A3 : A C2p_exo anti
342
+ A4 : C C3p_endo anti
343
+ A5 : U C3p_endo anti
344
+ A6 : A C3p_endo anti
345
+ A7 : G C2p_exo anti
346
+ A8 : C C3p_endo anti
347
+ A9 : G C3p_endo anti
348
+ A10 : G C2p_endo syn
349
+ A11 : A O4p_endo anti
350
+ A12 : G C4p_endo anti
351
+ A13 : G C2p_exo anti
352
+ A14 : C C2p_exo anti
353
+ A15 : U C2p_endo anti
354
+ A16 : A C4p_exo anti
355
+ A17 : G C2p_exo anti
356
+ A18 : U O4p_exo anti
357
+ A19 : C C4p_exo anti
358
+ A20 : C C3p_endo anti
359
+ Adjacent stackings ----------------------------------------------
360
+ A2-A3 : adjacent_5p upward
361
+ A3-A4 : adjacent_5p upward
362
+ A4-A5 : adjacent_5p upward
363
+ A6-A7 : adjacent_5p upward
364
+ A7-A8 : adjacent_5p upward
365
+ A13-A14 : adjacent_5p upward
366
+ A14-A15 : adjacent_5p upward
367
+ A15-A16 : adjacent_5p upward
368
+ A16-A17 : adjacent_5p upward
369
+ A17-A18 : adjacent_5p upward
370
+ A18-A19 : adjacent_5p upward
371
+ Non-Adjacent stackings ------------------------------------------
372
+ A6-A16 : outward
373
+ Number of stackings = 12
374
+ Number of adjacent stackings = 11
375
+ Number of non adjacent stackings = 1
376
+ Base-pairs ------------------------------------------------------
377
+ A1-A20 : G-C Ww/Ww pairing antiparallel cis XIX
378
+ A2-A19 : G-C Ww/Ww pairing antiparallel cis XIX
379
+ A3-A18 : A-U Ww/Ww pairing antiparallel cis XX
380
+ A4-A17 : C-G Ww/Ww pairing antiparallel cis XIX
381
+ A5-A16 : U-A Ww/Ww pairing antiparallel cis XX
382
+ A6-A15 : A-U Ww/Ww pairing antiparallel cis XX
383
+ A7-A14 : G-C Ww/Ww pairing antiparallel cis XIX
384
+ A8-A13 : C-G Ww/Ww pairing antiparallel cis XIX
385
+ A9-A10 : G-G O2'/Ss adjacent_5p pairing
386
+ A10-A11 : G-A O2'/Hh adjacent_5p pairing
387
+ Residue conformations -------------------------------------------
388
+ A1 : G C1p_endo anti
389
+ A2 : G C3p_endo anti
390
+ A3 : A C2p_exo anti
391
+ A4 : C C3p_endo anti
392
+ A5 : U C3p_endo anti
393
+ A6 : A C3p_endo anti
394
+ A7 : G C2p_exo anti
395
+ A8 : C C3p_endo anti
396
+ A9 : G C3p_endo anti
397
+ A10 : G C3p_exo syn
398
+ A11 : A C2p_endo anti
399
+ A12 : G C4p_endo anti
400
+ A13 : G C2p_exo anti
401
+ A14 : C C2p_exo anti
402
+ A15 : U C2p_endo anti
403
+ A16 : A C4p_exo anti
404
+ A17 : G C2p_exo anti
405
+ A18 : U C2p_exo anti
406
+ A19 : C C2p_endo anti
407
+ A20 : C C3p_endo anti
408
+ Adjacent stackings ----------------------------------------------
409
+ A2-A3 : adjacent_5p upward
410
+ A3-A4 : adjacent_5p upward
411
+ A4-A5 : adjacent_5p upward
412
+ A5-A6 : adjacent_5p upward
413
+ A6-A7 : adjacent_5p upward
414
+ A7-A8 : adjacent_5p upward
415
+ A13-A14 : adjacent_5p upward
416
+ A14-A15 : adjacent_5p upward
417
+ A15-A16 : adjacent_5p upward
418
+ A16-A17 : adjacent_5p upward
419
+ A17-A18 : adjacent_5p upward
420
+ A18-A19 : adjacent_5p upward
421
+ Non-Adjacent stackings ------------------------------------------
422
+ Number of stackings = 12
423
+ Number of adjacent stackings = 12
424
+ Number of non adjacent stackings = 0
425
+ Base-pairs ------------------------------------------------------
426
+ A1-A20 : G-C Ww/Ww pairing antiparallel cis XIX
427
+ A2-A19 : G-C Ww/Ww pairing antiparallel cis XIX
428
+ A3-A18 : A-U Ww/Ww pairing antiparallel cis XX
429
+ A4-A17 : C-G Ww/Ww pairing antiparallel cis XIX
430
+ A5-A16 : U-A Ww/Ww pairing antiparallel cis XX
431
+ A6-A15 : A-U Ww/Ww pairing antiparallel cis XX
432
+ A7-A14 : G-C Ww/Ww pairing antiparallel cis XIX
433
+ A8-A13 : C-G Ww/Ww pairing antiparallel cis XIX
434
+ A10-A11 : G-A O2'/C8 adjacent_5p pairing
435
+ A11-A12 : A-G Ss/O2P adjacent_5p pairing
436
+ Residue conformations -------------------------------------------
437
+ A1 : G C3p_endo anti
438
+ A2 : G C3p_endo anti
439
+ A3 : A C2p_exo anti
440
+ A4 : C C3p_endo anti
441
+ A5 : U C3p_endo anti
442
+ A6 : A C3p_endo anti
443
+ A7 : G C2p_exo anti
444
+ A8 : C C3p_endo anti
445
+ A9 : G C1p_endo anti
446
+ A10 : G C3p_exo syn
447
+ A11 : A O4p_endo anti
448
+ A12 : G C4p_endo anti
449
+ A13 : G C2p_exo anti
450
+ A14 : C C2p_exo anti
451
+ A15 : U C2p_endo anti
452
+ A16 : A C4p_exo anti
453
+ A17 : G C2p_exo anti
454
+ A18 : U C2p_exo anti
455
+ A19 : C C4p_exo anti
456
+ A20 : C C3p_endo anti
457
+ Adjacent stackings ----------------------------------------------
458
+ A2-A3 : adjacent_5p upward
459
+ A3-A4 : adjacent_5p upward
460
+ A4-A5 : adjacent_5p upward
461
+ A6-A7 : adjacent_5p upward
462
+ A7-A8 : adjacent_5p upward
463
+ A13-A14 : adjacent_5p upward
464
+ A14-A15 : adjacent_5p upward
465
+ A15-A16 : adjacent_5p upward
466
+ A16-A17 : adjacent_5p upward
467
+ A17-A18 : adjacent_5p upward
468
+ A18-A19 : adjacent_5p upward
469
+ Non-Adjacent stackings ------------------------------------------
470
+ Number of stackings = 11
471
+ Number of adjacent stackings = 11
472
+ Number of non adjacent stackings = 0
473
+ Base-pairs ------------------------------------------------------
474
+ A1-A20 : G-C Ww/Ww pairing antiparallel cis XIX
475
+ A2-A19 : G-C Ww/Ww pairing antiparallel cis XIX
476
+ A3-A18 : A-U Ww/Ww pairing antiparallel cis XX
477
+ A4-A17 : C-G Ww/Ww pairing antiparallel cis XIX
478
+ A5-A16 : U-A Ww/Ww pairing antiparallel cis XX
479
+ A6-A15 : A-U Ww/Ww pairing antiparallel cis XX
480
+ A7-A14 : G-C Ww/Ww pairing antiparallel cis XIX
481
+ A8-A13 : C-G Ww/Ww pairing antiparallel cis XIX
482
+ A9-A10 : G-G O2'/Hh adjacent_5p pairing
483
+ Residue conformations -------------------------------------------
484
+ A1 : G C2p_exo anti
485
+ A2 : G C3p_endo anti
486
+ A3 : A C2p_exo anti
487
+ A4 : C C3p_endo anti
488
+ A5 : U C3p_endo anti
489
+ A6 : A C3p_endo anti
490
+ A7 : G C2p_exo anti
491
+ A8 : C C3p_endo anti
492
+ A9 : G C1p_endo anti
493
+ A10 : G C2p_endo syn
494
+ A11 : A C1p_exo syn
495
+ A12 : G C4p_endo anti
496
+ A13 : G C2p_exo anti
497
+ A14 : C C3p_endo anti
498
+ A15 : U C2p_endo anti
499
+ A16 : A C4p_exo anti
500
+ A17 : G C3p_endo anti
501
+ A18 : U C2p_exo anti
502
+ A19 : C C1p_exo anti
503
+ A20 : C C3p_endo anti
504
+ Adjacent stackings ----------------------------------------------
505
+ A2-A3 : adjacent_5p upward
506
+ A3-A4 : adjacent_5p upward
507
+ A6-A7 : adjacent_5p upward
508
+ A7-A8 : adjacent_5p upward
509
+ A13-A14 : adjacent_5p upward
510
+ A14-A15 : adjacent_5p upward
511
+ A15-A16 : adjacent_5p upward
512
+ A16-A17 : adjacent_5p upward
513
+ A17-A18 : adjacent_5p upward
514
+ A18-A19 : adjacent_5p upward
515
+ Non-Adjacent stackings ------------------------------------------
516
+ A6-A16 : outward
517
+ Number of stackings = 11
518
+ Number of adjacent stackings = 10
519
+ Number of non adjacent stackings = 1
520
+ Base-pairs ------------------------------------------------------
521
+ A1-A20 : G-C Ww/Ww pairing antiparallel cis XIX
522
+ A2-A19 : G-C Ww/Ww pairing antiparallel cis XIX
523
+ A3-A18 : A-U Ww/Ww pairing antiparallel cis XX
524
+ A4-A17 : C-G Ww/Ww pairing antiparallel cis XIX
525
+ A5-A16 : U-A Ww/Ww pairing antiparallel cis XX
526
+ A6-A15 : A-U Ww/Ww pairing antiparallel cis XX
527
+ A7-A14 : G-C Ww/Ww pairing antiparallel cis XIX
528
+ A8-A13 : C-G Ww/Ww pairing antiparallel cis XIX
529
+ A10-A11 : G-A O2'/C8 adjacent_5p pairing