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a093090
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Upload 1ato_MC with huggingface_hub

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