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  1. README.md +5 -3
  2. data/files/A009R/pocket_01.pdb +411 -0
  3. data/files/A009R/pocket_02.pdb +339 -0
  4. data/files/A009R/pocket_03.pdb +218 -0
  5. data/files/A009R/pocket_04.pdb +155 -0
  6. data/files/A009R/pocket_05.pdb +128 -0
  7. data/files/A009R/pocket_06.pdb +115 -0
  8. data/files/A009R/pocket_07.pdb +108 -0
  9. data/files/A009R/pocket_08.pdb +87 -0
  10. data/files/A009R/pocket_09.pdb +81 -0
  11. data/files/A009R/pocket_10.pdb +61 -0
  12. data/files/A009R/structure.pdb +0 -0
  13. data/files/A00BR/pocket_01.pdb +884 -0
  14. data/files/A00BR/pocket_02.pdb +745 -0
  15. data/files/A00BR/pocket_03.pdb +596 -0
  16. data/files/A00BR/pocket_04.pdb +525 -0
  17. data/files/A00BR/pocket_05.pdb +278 -0
  18. data/files/A00BR/pocket_06.pdb +222 -0
  19. data/files/A00BR/pocket_07.pdb +180 -0
  20. data/files/A00BR/pocket_08.pdb +115 -0
  21. data/files/A00BR/pocket_09.pdb +39 -0
  22. data/files/A00BR/structure.pdb +0 -0
  23. data/files/A00BV/pocket_01.pdb +527 -0
  24. data/files/A00BV/pocket_02.pdb +309 -0
  25. data/files/A00BV/pocket_03.pdb +283 -0
  26. data/files/A00BV/pocket_04.pdb +256 -0
  27. data/files/A00BV/pocket_05.pdb +256 -0
  28. data/files/A00BV/pocket_06.pdb +243 -0
  29. data/files/A00BV/pocket_07.pdb +213 -0
  30. data/files/A00BV/pocket_08.pdb +207 -0
  31. data/files/A00BV/pocket_09.pdb +150 -0
  32. data/files/A00BV/pocket_10.pdb +139 -0
  33. data/files/A00BV/structure.pdb +0 -0
  34. data/files/A00F8/pocket_01.pdb +188 -0
  35. data/files/A00F8/pocket_02.pdb +71 -0
  36. data/files/A00F8/structure.pdb +0 -0
  37. data/files/A00FS/pocket_01.pdb +128 -0
  38. data/files/A00FS/pocket_02.pdb +86 -0
  39. data/files/A00FS/pocket_03.pdb +69 -0
  40. data/files/A00FS/structure.pdb +0 -0
  41. data/files/A00G2/pocket_01.pdb +634 -0
  42. data/files/A00G2/pocket_02.pdb +423 -0
  43. data/files/A00G2/pocket_03.pdb +230 -0
  44. data/files/A00G2/pocket_04.pdb +123 -0
  45. data/files/A00G2/pocket_05.pdb +66 -0
  46. data/files/A00G2/pocket_06.pdb +65 -0
  47. data/files/A00G2/pocket_07.pdb +65 -0
  48. data/files/A00G2/pocket_08.pdb +54 -0
  49. data/files/A00G2/structure.pdb +0 -0
  50. dataset_metadata.json +5 -0
README.md CHANGED
@@ -1,3 +1,5 @@
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- ---
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- license: gpl
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- ---
 
 
 
1
+ # INRIA Dynarepo Flattened Dataset
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+
3
+ This repository contains flattened per-MD records exported from the INRIA Dynarepo.
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+
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+ Data is located under `data/records.jsonl`.
data/files/A009R/pocket_01.pdb ADDED
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230
+ ATOM 230 C PTH 1 64.24 74.08 32.21 0.00 0.00
231
+ ATOM 231 C PTH 1 64.24 74.08 33.21 0.00 0.00
232
+ ATOM 232 C PTH 1 64.24 74.08 34.21 0.00 0.00
233
+ ATOM 233 C PTH 1 64.24 74.08 35.21 0.00 0.00
234
+ ATOM 234 C PTH 1 64.24 75.08 27.21 0.00 0.00
235
+ ATOM 235 C PTH 1 64.24 75.08 28.21 0.00 0.00
236
+ ATOM 236 C PTH 1 64.24 75.08 29.21 0.00 0.00
237
+ ATOM 237 C PTH 1 64.24 75.08 30.21 0.00 0.00
238
+ ATOM 238 C PTH 1 64.24 75.08 31.21 0.00 0.00
239
+ ATOM 239 C PTH 1 64.24 75.08 32.21 0.00 0.00
240
+ ATOM 240 C PTH 1 64.24 75.08 33.21 0.00 0.00
241
+ ATOM 241 C PTH 1 64.24 75.08 34.21 0.00 0.00
242
+ ATOM 242 C PTH 1 64.24 75.08 35.21 0.00 0.00
243
+ ATOM 243 C PTH 1 64.24 76.08 26.21 0.00 0.00
244
+ ATOM 244 C PTH 1 64.24 76.08 27.21 0.00 0.00
245
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246
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247
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248
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249
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250
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251
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252
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253
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254
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255
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256
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257
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258
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259
+ ATOM 259 C PTH 1 64.24 77.08 32.21 0.00 0.00
260
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261
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262
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263
+ ATOM 263 C PTH 1 64.24 78.08 25.21 0.00 0.00
264
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265
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266
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267
+ ATOM 267 C PTH 1 64.24 78.08 29.21 0.00 0.00
268
+ ATOM 268 C PTH 1 64.24 78.08 30.21 0.00 0.00
269
+ ATOM 269 C PTH 1 64.24 78.08 31.21 0.00 0.00
270
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271
+ ATOM 271 C PTH 1 64.24 78.08 33.21 0.00 0.00
272
+ ATOM 272 C PTH 1 64.24 78.08 34.21 0.00 0.00
273
+ ATOM 273 C PTH 1 64.24 78.08 35.21 0.00 0.00
274
+ ATOM 274 C PTH 1 64.24 79.08 25.21 0.00 0.00
275
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276
+ ATOM 276 C PTH 1 64.24 79.08 27.21 0.00 0.00
277
+ ATOM 277 C PTH 1 64.24 79.08 28.21 0.00 0.00
278
+ ATOM 278 C PTH 1 64.24 79.08 29.21 0.00 0.00
279
+ ATOM 279 C PTH 1 64.24 79.08 30.21 0.00 0.00
280
+ ATOM 280 C PTH 1 64.24 79.08 31.21 0.00 0.00
281
+ ATOM 281 C PTH 1 64.24 79.08 32.21 0.00 0.00
282
+ ATOM 282 C PTH 1 64.24 80.08 27.21 0.00 0.00
283
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284
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285
+ ATOM 285 C PTH 1 64.24 80.08 30.21 0.00 0.00
286
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287
+ ATOM 287 C PTH 1 64.24 81.08 28.21 0.00 0.00
288
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289
+ ATOM 289 C PTH 1 64.24 81.08 30.21 0.00 0.00
290
+ ATOM 290 C PTH 1 65.24 70.08 33.21 0.00 0.00
291
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292
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293
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294
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295
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296
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297
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298
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299
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300
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301
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302
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303
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304
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305
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306
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307
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308
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309
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310
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311
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312
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313
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314
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315
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316
+ ATOM 316 C PTH 1 65.24 76.08 26.21 0.00 0.00
317
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318
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319
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320
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321
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322
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323
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324
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325
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326
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327
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328
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329
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330
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331
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332
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333
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334
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335
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336
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337
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338
+ ATOM 338 C PTH 1 65.24 78.08 29.21 0.00 0.00
339
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340
+ ATOM 340 C PTH 1 65.24 78.08 31.21 0.00 0.00
341
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342
+ ATOM 342 C PTH 1 65.24 78.08 33.21 0.00 0.00
343
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344
+ ATOM 344 C PTH 1 65.24 79.08 26.21 0.00 0.00
345
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346
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347
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348
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349
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350
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351
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352
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353
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354
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355
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356
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357
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358
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359
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360
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361
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362
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363
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364
+ ATOM 364 C PTH 1 66.24 73.08 31.21 0.00 0.00
365
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366
+ ATOM 366 C PTH 1 66.24 73.08 33.21 0.00 0.00
367
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368
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369
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370
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371
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372
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373
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374
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375
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376
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377
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378
+ ATOM 378 C PTH 1 66.24 76.08 29.21 0.00 0.00
379
+ ATOM 379 C PTH 1 66.24 76.08 30.21 0.00 0.00
380
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381
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382
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383
+ ATOM 383 C PTH 1 66.24 77.08 29.21 0.00 0.00
384
+ ATOM 384 C PTH 1 66.24 77.08 30.21 0.00 0.00
385
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386
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387
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388
+ ATOM 388 C PTH 1 66.24 78.08 29.21 0.00 0.00
389
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390
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391
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392
+ ATOM 392 C PTH 1 66.24 78.08 33.21 0.00 0.00
393
+ ATOM 393 C PTH 1 66.24 79.08 30.21 0.00 0.00
394
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395
+ ATOM 395 C PTH 1 66.24 79.08 32.21 0.00 0.00
396
+ ATOM 396 C PTH 1 67.24 72.08 33.21 0.00 0.00
397
+ ATOM 397 C PTH 1 67.24 73.08 32.21 0.00 0.00
398
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399
+ ATOM 399 C PTH 1 67.24 74.08 30.21 0.00 0.00
400
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401
+ ATOM 401 C PTH 1 67.24 74.08 32.21 0.00 0.00
402
+ ATOM 402 C PTH 1 67.24 74.08 33.21 0.00 0.00
403
+ ATOM 403 C PTH 1 67.24 75.08 30.21 0.00 0.00
404
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405
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406
+ ATOM 406 C PTH 1 67.24 76.08 30.21 0.00 0.00
407
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408
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409
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410
+ ATOM 410 C PTH 1 67.24 77.08 32.21 0.00 0.00
411
+ ATOM 411 C PTH 1 67.24 78.08 31.21 0.00 0.00
data/files/A009R/pocket_02.pdb ADDED
@@ -0,0 +1,339 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 65.24 59.08 24.21 0.00 0.00
2
+ ATOM 2 C PTH 1 65.24 59.08 25.21 0.00 0.00
3
+ ATOM 3 C PTH 1 65.24 59.08 26.21 0.00 0.00
4
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5
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6
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7
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8
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9
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10
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11
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12
+ ATOM 12 C PTH 1 65.24 62.08 25.21 0.00 0.00
13
+ ATOM 13 C PTH 1 65.24 62.08 26.21 0.00 0.00
14
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15
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16
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17
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18
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19
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20
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21
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22
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23
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24
+ ATOM 24 C PTH 1 66.24 61.08 27.21 0.00 0.00
25
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26
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27
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28
+ ATOM 28 C PTH 1 66.24 62.08 28.21 0.00 0.00
29
+ ATOM 29 C PTH 1 67.24 58.08 26.21 0.00 0.00
30
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31
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32
+ ATOM 32 C PTH 1 67.24 59.08 25.21 0.00 0.00
33
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34
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35
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36
+ ATOM 36 C PTH 1 67.24 60.08 24.21 0.00 0.00
37
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38
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39
+ ATOM 39 C PTH 1 67.24 60.08 27.21 0.00 0.00
40
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41
+ ATOM 41 C PTH 1 67.24 61.08 25.21 0.00 0.00
42
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43
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44
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45
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46
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47
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48
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49
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50
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51
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52
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53
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54
+ ATOM 54 C PTH 1 68.24 59.08 27.21 0.00 0.00
55
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56
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57
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58
+ ATOM 58 C PTH 1 68.24 60.08 27.21 0.00 0.00
59
+ ATOM 59 C PTH 1 68.24 60.08 28.21 0.00 0.00
60
+ ATOM 60 C PTH 1 68.24 61.08 25.21 0.00 0.00
61
+ ATOM 61 C PTH 1 68.24 61.08 26.21 0.00 0.00
62
+ ATOM 62 C PTH 1 68.24 61.08 27.21 0.00 0.00
63
+ ATOM 63 C PTH 1 68.24 61.08 28.21 0.00 0.00
64
+ ATOM 64 C PTH 1 68.24 62.08 26.21 0.00 0.00
65
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66
+ ATOM 66 C PTH 1 68.24 62.08 28.21 0.00 0.00
67
+ ATOM 67 C PTH 1 69.24 55.08 21.21 0.00 0.00
68
+ ATOM 68 C PTH 1 69.24 55.08 22.21 0.00 0.00
69
+ ATOM 69 C PTH 1 69.24 55.08 23.21 0.00 0.00
70
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71
+ ATOM 71 C PTH 1 69.24 56.08 22.21 0.00 0.00
72
+ ATOM 72 C PTH 1 69.24 56.08 23.21 0.00 0.00
73
+ ATOM 73 C PTH 1 69.24 56.08 24.21 0.00 0.00
74
+ ATOM 74 C PTH 1 69.24 56.08 25.21 0.00 0.00
75
+ ATOM 75 C PTH 1 69.24 57.08 22.21 0.00 0.00
76
+ ATOM 76 C PTH 1 69.24 57.08 23.21 0.00 0.00
77
+ ATOM 77 C PTH 1 69.24 57.08 24.21 0.00 0.00
78
+ ATOM 78 C PTH 1 69.24 57.08 25.21 0.00 0.00
79
+ ATOM 79 C PTH 1 69.24 57.08 26.21 0.00 0.00
80
+ ATOM 80 C PTH 1 69.24 58.08 23.21 0.00 0.00
81
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82
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83
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84
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85
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86
+ ATOM 86 C PTH 1 69.24 59.08 26.21 0.00 0.00
87
+ ATOM 87 C PTH 1 69.24 59.08 27.21 0.00 0.00
88
+ ATOM 88 C PTH 1 69.24 60.08 25.21 0.00 0.00
89
+ ATOM 89 C PTH 1 69.24 60.08 26.21 0.00 0.00
90
+ ATOM 90 C PTH 1 69.24 60.08 27.21 0.00 0.00
91
+ ATOM 91 C PTH 1 69.24 60.08 28.21 0.00 0.00
92
+ ATOM 92 C PTH 1 69.24 61.08 25.21 0.00 0.00
93
+ ATOM 93 C PTH 1 69.24 61.08 26.21 0.00 0.00
94
+ ATOM 94 C PTH 1 69.24 61.08 27.21 0.00 0.00
95
+ ATOM 95 C PTH 1 69.24 61.08 28.21 0.00 0.00
96
+ ATOM 96 C PTH 1 69.24 62.08 25.21 0.00 0.00
97
+ ATOM 97 C PTH 1 69.24 62.08 26.21 0.00 0.00
98
+ ATOM 98 C PTH 1 69.24 62.08 27.21 0.00 0.00
99
+ ATOM 99 C PTH 1 69.24 62.08 28.21 0.00 0.00
100
+ ATOM 100 C PTH 1 69.24 63.08 26.21 0.00 0.00
101
+ ATOM 101 C PTH 1 69.24 63.08 27.21 0.00 0.00
102
+ ATOM 102 C PTH 1 69.24 63.08 28.21 0.00 0.00
103
+ ATOM 103 C PTH 1 69.24 64.08 28.21 0.00 0.00
104
+ ATOM 104 C PTH 1 70.24 55.08 20.21 0.00 0.00
105
+ ATOM 105 C PTH 1 70.24 55.08 21.21 0.00 0.00
106
+ ATOM 106 C PTH 1 70.24 55.08 22.21 0.00 0.00
107
+ ATOM 107 C PTH 1 70.24 55.08 23.21 0.00 0.00
108
+ ATOM 108 C PTH 1 70.24 55.08 24.21 0.00 0.00
109
+ ATOM 109 C PTH 1 70.24 56.08 20.21 0.00 0.00
110
+ ATOM 110 C PTH 1 70.24 56.08 21.21 0.00 0.00
111
+ ATOM 111 C PTH 1 70.24 56.08 22.21 0.00 0.00
112
+ ATOM 112 C PTH 1 70.24 56.08 23.21 0.00 0.00
113
+ ATOM 113 C PTH 1 70.24 56.08 24.21 0.00 0.00
114
+ ATOM 114 C PTH 1 70.24 56.08 25.21 0.00 0.00
115
+ ATOM 115 C PTH 1 70.24 56.08 26.21 0.00 0.00
116
+ ATOM 116 C PTH 1 70.24 57.08 20.21 0.00 0.00
117
+ ATOM 117 C PTH 1 70.24 57.08 21.21 0.00 0.00
118
+ ATOM 118 C PTH 1 70.24 57.08 22.21 0.00 0.00
119
+ ATOM 119 C PTH 1 70.24 57.08 23.21 0.00 0.00
120
+ ATOM 120 C PTH 1 70.24 57.08 24.21 0.00 0.00
121
+ ATOM 121 C PTH 1 70.24 57.08 25.21 0.00 0.00
122
+ ATOM 122 C PTH 1 70.24 57.08 26.21 0.00 0.00
123
+ ATOM 123 C PTH 1 70.24 57.08 27.21 0.00 0.00
124
+ ATOM 124 C PTH 1 70.24 58.08 21.21 0.00 0.00
125
+ ATOM 125 C PTH 1 70.24 58.08 22.21 0.00 0.00
126
+ ATOM 126 C PTH 1 70.24 58.08 23.21 0.00 0.00
127
+ ATOM 127 C PTH 1 70.24 58.08 24.21 0.00 0.00
128
+ ATOM 128 C PTH 1 70.24 58.08 25.21 0.00 0.00
129
+ ATOM 129 C PTH 1 70.24 58.08 26.21 0.00 0.00
130
+ ATOM 130 C PTH 1 70.24 58.08 27.21 0.00 0.00
131
+ ATOM 131 C PTH 1 70.24 59.08 23.21 0.00 0.00
132
+ ATOM 132 C PTH 1 70.24 59.08 24.21 0.00 0.00
133
+ ATOM 133 C PTH 1 70.24 59.08 25.21 0.00 0.00
134
+ ATOM 134 C PTH 1 70.24 59.08 26.21 0.00 0.00
135
+ ATOM 135 C PTH 1 70.24 59.08 27.21 0.00 0.00
136
+ ATOM 136 C PTH 1 70.24 60.08 24.21 0.00 0.00
137
+ ATOM 137 C PTH 1 70.24 60.08 25.21 0.00 0.00
138
+ ATOM 138 C PTH 1 70.24 60.08 26.21 0.00 0.00
139
+ ATOM 139 C PTH 1 70.24 60.08 27.21 0.00 0.00
140
+ ATOM 140 C PTH 1 70.24 61.08 24.21 0.00 0.00
141
+ ATOM 141 C PTH 1 70.24 61.08 25.21 0.00 0.00
142
+ ATOM 142 C PTH 1 70.24 61.08 26.21 0.00 0.00
143
+ ATOM 143 C PTH 1 70.24 61.08 27.21 0.00 0.00
144
+ ATOM 144 C PTH 1 70.24 61.08 28.21 0.00 0.00
145
+ ATOM 145 C PTH 1 70.24 62.08 25.21 0.00 0.00
146
+ ATOM 146 C PTH 1 70.24 62.08 26.21 0.00 0.00
147
+ ATOM 147 C PTH 1 70.24 62.08 27.21 0.00 0.00
148
+ ATOM 148 C PTH 1 70.24 62.08 28.21 0.00 0.00
149
+ ATOM 149 C PTH 1 70.24 63.08 26.21 0.00 0.00
150
+ ATOM 150 C PTH 1 70.24 63.08 27.21 0.00 0.00
151
+ ATOM 151 C PTH 1 70.24 63.08 28.21 0.00 0.00
152
+ ATOM 152 C PTH 1 71.24 55.08 20.21 0.00 0.00
153
+ ATOM 153 C PTH 1 71.24 55.08 21.21 0.00 0.00
154
+ ATOM 154 C PTH 1 71.24 55.08 22.21 0.00 0.00
155
+ ATOM 155 C PTH 1 71.24 55.08 23.21 0.00 0.00
156
+ ATOM 156 C PTH 1 71.24 55.08 24.21 0.00 0.00
157
+ ATOM 157 C PTH 1 71.24 55.08 25.21 0.00 0.00
158
+ ATOM 158 C PTH 1 71.24 56.08 20.21 0.00 0.00
159
+ ATOM 159 C PTH 1 71.24 56.08 21.21 0.00 0.00
160
+ ATOM 160 C PTH 1 71.24 56.08 22.21 0.00 0.00
161
+ ATOM 161 C PTH 1 71.24 56.08 23.21 0.00 0.00
162
+ ATOM 162 C PTH 1 71.24 56.08 24.21 0.00 0.00
163
+ ATOM 163 C PTH 1 71.24 56.08 25.21 0.00 0.00
164
+ ATOM 164 C PTH 1 71.24 56.08 26.21 0.00 0.00
165
+ ATOM 165 C PTH 1 71.24 57.08 20.21 0.00 0.00
166
+ ATOM 166 C PTH 1 71.24 57.08 21.21 0.00 0.00
167
+ ATOM 167 C PTH 1 71.24 57.08 22.21 0.00 0.00
168
+ ATOM 168 C PTH 1 71.24 57.08 23.21 0.00 0.00
169
+ ATOM 169 C PTH 1 71.24 57.08 24.21 0.00 0.00
170
+ ATOM 170 C PTH 1 71.24 57.08 25.21 0.00 0.00
171
+ ATOM 171 C PTH 1 71.24 57.08 26.21 0.00 0.00
172
+ ATOM 172 C PTH 1 71.24 57.08 27.21 0.00 0.00
173
+ ATOM 173 C PTH 1 71.24 58.08 20.21 0.00 0.00
174
+ ATOM 174 C PTH 1 71.24 58.08 21.21 0.00 0.00
175
+ ATOM 175 C PTH 1 71.24 58.08 22.21 0.00 0.00
176
+ ATOM 176 C PTH 1 71.24 58.08 23.21 0.00 0.00
177
+ ATOM 177 C PTH 1 71.24 58.08 24.21 0.00 0.00
178
+ ATOM 178 C PTH 1 71.24 58.08 25.21 0.00 0.00
179
+ ATOM 179 C PTH 1 71.24 58.08 26.21 0.00 0.00
180
+ ATOM 180 C PTH 1 71.24 58.08 27.21 0.00 0.00
181
+ ATOM 181 C PTH 1 71.24 58.08 28.21 0.00 0.00
182
+ ATOM 182 C PTH 1 71.24 59.08 23.21 0.00 0.00
183
+ ATOM 183 C PTH 1 71.24 59.08 24.21 0.00 0.00
184
+ ATOM 184 C PTH 1 71.24 59.08 25.21 0.00 0.00
185
+ ATOM 185 C PTH 1 71.24 59.08 26.21 0.00 0.00
186
+ ATOM 186 C PTH 1 71.24 59.08 27.21 0.00 0.00
187
+ ATOM 187 C PTH 1 71.24 59.08 28.21 0.00 0.00
188
+ ATOM 188 C PTH 1 71.24 60.08 24.21 0.00 0.00
189
+ ATOM 189 C PTH 1 71.24 60.08 25.21 0.00 0.00
190
+ ATOM 190 C PTH 1 71.24 60.08 26.21 0.00 0.00
191
+ ATOM 191 C PTH 1 71.24 60.08 27.21 0.00 0.00
192
+ ATOM 192 C PTH 1 71.24 61.08 24.21 0.00 0.00
193
+ ATOM 193 C PTH 1 71.24 61.08 25.21 0.00 0.00
194
+ ATOM 194 C PTH 1 71.24 61.08 26.21 0.00 0.00
195
+ ATOM 195 C PTH 1 71.24 61.08 27.21 0.00 0.00
196
+ ATOM 196 C PTH 1 71.24 61.08 28.21 0.00 0.00
197
+ ATOM 197 C PTH 1 71.24 62.08 24.21 0.00 0.00
198
+ ATOM 198 C PTH 1 71.24 62.08 25.21 0.00 0.00
199
+ ATOM 199 C PTH 1 71.24 62.08 26.21 0.00 0.00
200
+ ATOM 200 C PTH 1 71.24 62.08 27.21 0.00 0.00
201
+ ATOM 201 C PTH 1 71.24 62.08 28.21 0.00 0.00
202
+ ATOM 202 C PTH 1 71.24 63.08 25.21 0.00 0.00
203
+ ATOM 203 C PTH 1 71.24 63.08 26.21 0.00 0.00
204
+ ATOM 204 C PTH 1 71.24 63.08 27.21 0.00 0.00
205
+ ATOM 205 C PTH 1 71.24 63.08 28.21 0.00 0.00
206
+ ATOM 206 C PTH 1 72.24 55.08 20.21 0.00 0.00
207
+ ATOM 207 C PTH 1 72.24 55.08 21.21 0.00 0.00
208
+ ATOM 208 C PTH 1 72.24 55.08 22.21 0.00 0.00
209
+ ATOM 209 C PTH 1 72.24 55.08 23.21 0.00 0.00
210
+ ATOM 210 C PTH 1 72.24 55.08 24.21 0.00 0.00
211
+ ATOM 211 C PTH 1 72.24 55.08 25.21 0.00 0.00
212
+ ATOM 212 C PTH 1 72.24 56.08 20.21 0.00 0.00
213
+ ATOM 213 C PTH 1 72.24 56.08 21.21 0.00 0.00
214
+ ATOM 214 C PTH 1 72.24 56.08 22.21 0.00 0.00
215
+ ATOM 215 C PTH 1 72.24 56.08 23.21 0.00 0.00
216
+ ATOM 216 C PTH 1 72.24 56.08 24.21 0.00 0.00
217
+ ATOM 217 C PTH 1 72.24 56.08 25.21 0.00 0.00
218
+ ATOM 218 C PTH 1 72.24 56.08 26.21 0.00 0.00
219
+ ATOM 219 C PTH 1 72.24 56.08 27.21 0.00 0.00
220
+ ATOM 220 C PTH 1 72.24 57.08 20.21 0.00 0.00
221
+ ATOM 221 C PTH 1 72.24 57.08 21.21 0.00 0.00
222
+ ATOM 222 C PTH 1 72.24 57.08 22.21 0.00 0.00
223
+ ATOM 223 C PTH 1 72.24 57.08 23.21 0.00 0.00
224
+ ATOM 224 C PTH 1 72.24 57.08 24.21 0.00 0.00
225
+ ATOM 225 C PTH 1 72.24 57.08 25.21 0.00 0.00
226
+ ATOM 226 C PTH 1 72.24 57.08 26.21 0.00 0.00
227
+ ATOM 227 C PTH 1 72.24 57.08 27.21 0.00 0.00
228
+ ATOM 228 C PTH 1 72.24 57.08 28.21 0.00 0.00
229
+ ATOM 229 C PTH 1 72.24 58.08 20.21 0.00 0.00
230
+ ATOM 230 C PTH 1 72.24 58.08 21.21 0.00 0.00
231
+ ATOM 231 C PTH 1 72.24 58.08 22.21 0.00 0.00
232
+ ATOM 232 C PTH 1 72.24 58.08 23.21 0.00 0.00
233
+ ATOM 233 C PTH 1 72.24 58.08 24.21 0.00 0.00
234
+ ATOM 234 C PTH 1 72.24 58.08 25.21 0.00 0.00
235
+ ATOM 235 C PTH 1 72.24 58.08 26.21 0.00 0.00
236
+ ATOM 236 C PTH 1 72.24 58.08 27.21 0.00 0.00
237
+ ATOM 237 C PTH 1 72.24 58.08 28.21 0.00 0.00
238
+ ATOM 238 C PTH 1 72.24 59.08 22.21 0.00 0.00
239
+ ATOM 239 C PTH 1 72.24 59.08 23.21 0.00 0.00
240
+ ATOM 240 C PTH 1 72.24 59.08 24.21 0.00 0.00
241
+ ATOM 241 C PTH 1 72.24 59.08 25.21 0.00 0.00
242
+ ATOM 242 C PTH 1 72.24 59.08 26.21 0.00 0.00
243
+ ATOM 243 C PTH 1 72.24 59.08 27.21 0.00 0.00
244
+ ATOM 244 C PTH 1 72.24 59.08 28.21 0.00 0.00
245
+ ATOM 245 C PTH 1 72.24 60.08 24.21 0.00 0.00
246
+ ATOM 246 C PTH 1 72.24 60.08 25.21 0.00 0.00
247
+ ATOM 247 C PTH 1 72.24 60.08 26.21 0.00 0.00
248
+ ATOM 248 C PTH 1 72.24 60.08 27.21 0.00 0.00
249
+ ATOM 249 C PTH 1 72.24 60.08 28.21 0.00 0.00
250
+ ATOM 250 C PTH 1 72.24 61.08 24.21 0.00 0.00
251
+ ATOM 251 C PTH 1 72.24 61.08 25.21 0.00 0.00
252
+ ATOM 252 C PTH 1 72.24 61.08 26.21 0.00 0.00
253
+ ATOM 253 C PTH 1 72.24 61.08 27.21 0.00 0.00
254
+ ATOM 254 C PTH 1 72.24 61.08 28.21 0.00 0.00
255
+ ATOM 255 C PTH 1 72.24 62.08 24.21 0.00 0.00
256
+ ATOM 256 C PTH 1 72.24 62.08 25.21 0.00 0.00
257
+ ATOM 257 C PTH 1 72.24 62.08 26.21 0.00 0.00
258
+ ATOM 258 C PTH 1 72.24 62.08 27.21 0.00 0.00
259
+ ATOM 259 C PTH 1 72.24 62.08 28.21 0.00 0.00
260
+ ATOM 260 C PTH 1 72.24 63.08 27.21 0.00 0.00
261
+ ATOM 261 C PTH 1 73.24 55.08 21.21 0.00 0.00
262
+ ATOM 262 C PTH 1 73.24 55.08 22.21 0.00 0.00
263
+ ATOM 263 C PTH 1 73.24 55.08 23.21 0.00 0.00
264
+ ATOM 264 C PTH 1 73.24 55.08 24.21 0.00 0.00
265
+ ATOM 265 C PTH 1 73.24 55.08 25.21 0.00 0.00
266
+ ATOM 266 C PTH 1 73.24 55.08 26.21 0.00 0.00
267
+ ATOM 267 C PTH 1 73.24 56.08 20.21 0.00 0.00
268
+ ATOM 268 C PTH 1 73.24 56.08 21.21 0.00 0.00
269
+ ATOM 269 C PTH 1 73.24 56.08 22.21 0.00 0.00
270
+ ATOM 270 C PTH 1 73.24 56.08 23.21 0.00 0.00
271
+ ATOM 271 C PTH 1 73.24 56.08 24.21 0.00 0.00
272
+ ATOM 272 C PTH 1 73.24 56.08 25.21 0.00 0.00
273
+ ATOM 273 C PTH 1 73.24 56.08 26.21 0.00 0.00
274
+ ATOM 274 C PTH 1 73.24 56.08 27.21 0.00 0.00
275
+ ATOM 275 C PTH 1 73.24 57.08 20.21 0.00 0.00
276
+ ATOM 276 C PTH 1 73.24 57.08 21.21 0.00 0.00
277
+ ATOM 277 C PTH 1 73.24 57.08 22.21 0.00 0.00
278
+ ATOM 278 C PTH 1 73.24 57.08 23.21 0.00 0.00
279
+ ATOM 279 C PTH 1 73.24 57.08 24.21 0.00 0.00
280
+ ATOM 280 C PTH 1 73.24 57.08 25.21 0.00 0.00
281
+ ATOM 281 C PTH 1 73.24 57.08 26.21 0.00 0.00
282
+ ATOM 282 C PTH 1 73.24 57.08 27.21 0.00 0.00
283
+ ATOM 283 C PTH 1 73.24 58.08 21.21 0.00 0.00
284
+ ATOM 284 C PTH 1 73.24 58.08 22.21 0.00 0.00
285
+ ATOM 285 C PTH 1 73.24 58.08 23.21 0.00 0.00
286
+ ATOM 286 C PTH 1 73.24 58.08 24.21 0.00 0.00
287
+ ATOM 287 C PTH 1 73.24 58.08 25.21 0.00 0.00
288
+ ATOM 288 C PTH 1 73.24 58.08 26.21 0.00 0.00
289
+ ATOM 289 C PTH 1 73.24 58.08 27.21 0.00 0.00
290
+ ATOM 290 C PTH 1 73.24 58.08 28.21 0.00 0.00
291
+ ATOM 291 C PTH 1 73.24 59.08 23.21 0.00 0.00
292
+ ATOM 292 C PTH 1 73.24 59.08 24.21 0.00 0.00
293
+ ATOM 293 C PTH 1 73.24 59.08 25.21 0.00 0.00
294
+ ATOM 294 C PTH 1 73.24 59.08 26.21 0.00 0.00
295
+ ATOM 295 C PTH 1 73.24 59.08 27.21 0.00 0.00
296
+ ATOM 296 C PTH 1 73.24 59.08 28.21 0.00 0.00
297
+ ATOM 297 C PTH 1 73.24 60.08 24.21 0.00 0.00
298
+ ATOM 298 C PTH 1 73.24 60.08 25.21 0.00 0.00
299
+ ATOM 299 C PTH 1 73.24 60.08 26.21 0.00 0.00
300
+ ATOM 300 C PTH 1 73.24 60.08 27.21 0.00 0.00
301
+ ATOM 301 C PTH 1 73.24 60.08 28.21 0.00 0.00
302
+ ATOM 302 C PTH 1 73.24 61.08 24.21 0.00 0.00
303
+ ATOM 303 C PTH 1 73.24 61.08 25.21 0.00 0.00
304
+ ATOM 304 C PTH 1 73.24 61.08 26.21 0.00 0.00
305
+ ATOM 305 C PTH 1 73.24 61.08 27.21 0.00 0.00
306
+ ATOM 306 C PTH 1 73.24 62.08 25.21 0.00 0.00
307
+ ATOM 307 C PTH 1 73.24 62.08 26.21 0.00 0.00
308
+ ATOM 308 C PTH 1 73.24 62.08 27.21 0.00 0.00
309
+ ATOM 309 C PTH 1 74.24 54.08 25.21 0.00 0.00
310
+ ATOM 310 C PTH 1 74.24 55.08 24.21 0.00 0.00
311
+ ATOM 311 C PTH 1 74.24 55.08 25.21 0.00 0.00
312
+ ATOM 312 C PTH 1 74.24 56.08 23.21 0.00 0.00
313
+ ATOM 313 C PTH 1 74.24 56.08 24.21 0.00 0.00
314
+ ATOM 314 C PTH 1 74.24 56.08 25.21 0.00 0.00
315
+ ATOM 315 C PTH 1 74.24 57.08 23.21 0.00 0.00
316
+ ATOM 316 C PTH 1 74.24 57.08 24.21 0.00 0.00
317
+ ATOM 317 C PTH 1 74.24 57.08 25.21 0.00 0.00
318
+ ATOM 318 C PTH 1 74.24 57.08 26.21 0.00 0.00
319
+ ATOM 319 C PTH 1 74.24 57.08 27.21 0.00 0.00
320
+ ATOM 320 C PTH 1 74.24 58.08 23.21 0.00 0.00
321
+ ATOM 321 C PTH 1 74.24 58.08 24.21 0.00 0.00
322
+ ATOM 322 C PTH 1 74.24 58.08 25.21 0.00 0.00
323
+ ATOM 323 C PTH 1 74.24 58.08 26.21 0.00 0.00
324
+ ATOM 324 C PTH 1 74.24 58.08 27.21 0.00 0.00
325
+ ATOM 325 C PTH 1 74.24 58.08 28.21 0.00 0.00
326
+ ATOM 326 C PTH 1 74.24 59.08 24.21 0.00 0.00
327
+ ATOM 327 C PTH 1 74.24 59.08 25.21 0.00 0.00
328
+ ATOM 328 C PTH 1 74.24 59.08 26.21 0.00 0.00
329
+ ATOM 329 C PTH 1 74.24 59.08 27.21 0.00 0.00
330
+ ATOM 330 C PTH 1 74.24 59.08 28.21 0.00 0.00
331
+ ATOM 331 C PTH 1 74.24 60.08 25.21 0.00 0.00
332
+ ATOM 332 C PTH 1 74.24 60.08 26.21 0.00 0.00
333
+ ATOM 333 C PTH 1 74.24 60.08 27.21 0.00 0.00
334
+ ATOM 334 C PTH 1 74.24 60.08 28.21 0.00 0.00
335
+ ATOM 335 C PTH 1 75.24 55.08 25.21 0.00 0.00
336
+ ATOM 336 C PTH 1 75.24 56.08 25.21 0.00 0.00
337
+ ATOM 337 C PTH 1 75.24 57.08 24.21 0.00 0.00
338
+ ATOM 338 C PTH 1 75.24 57.08 25.21 0.00 0.00
339
+ ATOM 339 C PTH 1 75.24 57.08 26.21 0.00 0.00
data/files/A009R/pocket_03.pdb ADDED
@@ -0,0 +1,218 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 52.24 52.08 9.21 0.00 0.00
2
+ ATOM 2 C PTH 1 52.24 52.08 10.21 0.00 0.00
3
+ ATOM 3 C PTH 1 52.24 52.08 11.21 0.00 0.00
4
+ ATOM 4 C PTH 1 52.24 53.08 9.21 0.00 0.00
5
+ ATOM 5 C PTH 1 52.24 53.08 10.21 0.00 0.00
6
+ ATOM 6 C PTH 1 52.24 53.08 11.21 0.00 0.00
7
+ ATOM 7 C PTH 1 52.24 54.08 9.21 0.00 0.00
8
+ ATOM 8 C PTH 1 52.24 54.08 10.21 0.00 0.00
9
+ ATOM 9 C PTH 1 52.24 54.08 11.21 0.00 0.00
10
+ ATOM 10 C PTH 1 53.24 48.08 14.21 0.00 0.00
11
+ ATOM 11 C PTH 1 53.24 49.08 13.21 0.00 0.00
12
+ ATOM 12 C PTH 1 53.24 49.08 14.21 0.00 0.00
13
+ ATOM 13 C PTH 1 53.24 50.08 12.21 0.00 0.00
14
+ ATOM 14 C PTH 1 53.24 50.08 13.21 0.00 0.00
15
+ ATOM 15 C PTH 1 53.24 51.08 10.21 0.00 0.00
16
+ ATOM 16 C PTH 1 53.24 51.08 11.21 0.00 0.00
17
+ ATOM 17 C PTH 1 53.24 51.08 12.21 0.00 0.00
18
+ ATOM 18 C PTH 1 53.24 51.08 13.21 0.00 0.00
19
+ ATOM 19 C PTH 1 53.24 52.08 9.21 0.00 0.00
20
+ ATOM 20 C PTH 1 53.24 52.08 10.21 0.00 0.00
21
+ ATOM 21 C PTH 1 53.24 52.08 11.21 0.00 0.00
22
+ ATOM 22 C PTH 1 53.24 52.08 12.21 0.00 0.00
23
+ ATOM 23 C PTH 1 53.24 52.08 13.21 0.00 0.00
24
+ ATOM 24 C PTH 1 53.24 53.08 9.21 0.00 0.00
25
+ ATOM 25 C PTH 1 53.24 53.08 10.21 0.00 0.00
26
+ ATOM 26 C PTH 1 53.24 53.08 11.21 0.00 0.00
27
+ ATOM 27 C PTH 1 53.24 53.08 12.21 0.00 0.00
28
+ ATOM 28 C PTH 1 53.24 53.08 13.21 0.00 0.00
29
+ ATOM 29 C PTH 1 53.24 54.08 9.21 0.00 0.00
30
+ ATOM 30 C PTH 1 53.24 54.08 10.21 0.00 0.00
31
+ ATOM 31 C PTH 1 53.24 54.08 11.21 0.00 0.00
32
+ ATOM 32 C PTH 1 53.24 54.08 12.21 0.00 0.00
33
+ ATOM 33 C PTH 1 53.24 54.08 13.21 0.00 0.00
34
+ ATOM 34 C PTH 1 53.24 55.08 10.21 0.00 0.00
35
+ ATOM 35 C PTH 1 53.24 55.08 11.21 0.00 0.00
36
+ ATOM 36 C PTH 1 54.24 47.08 14.21 0.00 0.00
37
+ ATOM 37 C PTH 1 54.24 48.08 12.21 0.00 0.00
38
+ ATOM 38 C PTH 1 54.24 48.08 13.21 0.00 0.00
39
+ ATOM 39 C PTH 1 54.24 48.08 14.21 0.00 0.00
40
+ ATOM 40 C PTH 1 54.24 48.08 15.21 0.00 0.00
41
+ ATOM 41 C PTH 1 54.24 49.08 12.21 0.00 0.00
42
+ ATOM 42 C PTH 1 54.24 49.08 13.21 0.00 0.00
43
+ ATOM 43 C PTH 1 54.24 49.08 14.21 0.00 0.00
44
+ ATOM 44 C PTH 1 54.24 49.08 15.21 0.00 0.00
45
+ ATOM 45 C PTH 1 54.24 50.08 11.21 0.00 0.00
46
+ ATOM 46 C PTH 1 54.24 50.08 12.21 0.00 0.00
47
+ ATOM 47 C PTH 1 54.24 50.08 13.21 0.00 0.00
48
+ ATOM 48 C PTH 1 54.24 50.08 14.21 0.00 0.00
49
+ ATOM 49 C PTH 1 54.24 50.08 15.21 0.00 0.00
50
+ ATOM 50 C PTH 1 54.24 51.08 10.21 0.00 0.00
51
+ ATOM 51 C PTH 1 54.24 51.08 11.21 0.00 0.00
52
+ ATOM 52 C PTH 1 54.24 51.08 12.21 0.00 0.00
53
+ ATOM 53 C PTH 1 54.24 51.08 13.21 0.00 0.00
54
+ ATOM 54 C PTH 1 54.24 51.08 14.21 0.00 0.00
55
+ ATOM 55 C PTH 1 54.24 51.08 15.21 0.00 0.00
56
+ ATOM 56 C PTH 1 54.24 52.08 9.21 0.00 0.00
57
+ ATOM 57 C PTH 1 54.24 52.08 10.21 0.00 0.00
58
+ ATOM 58 C PTH 1 54.24 52.08 11.21 0.00 0.00
59
+ ATOM 59 C PTH 1 54.24 52.08 12.21 0.00 0.00
60
+ ATOM 60 C PTH 1 54.24 52.08 13.21 0.00 0.00
61
+ ATOM 61 C PTH 1 54.24 52.08 14.21 0.00 0.00
62
+ ATOM 62 C PTH 1 54.24 52.08 15.21 0.00 0.00
63
+ ATOM 63 C PTH 1 54.24 53.08 9.21 0.00 0.00
64
+ ATOM 64 C PTH 1 54.24 53.08 10.21 0.00 0.00
65
+ ATOM 65 C PTH 1 54.24 53.08 11.21 0.00 0.00
66
+ ATOM 66 C PTH 1 54.24 53.08 12.21 0.00 0.00
67
+ ATOM 67 C PTH 1 54.24 53.08 13.21 0.00 0.00
68
+ ATOM 68 C PTH 1 54.24 53.08 14.21 0.00 0.00
69
+ ATOM 69 C PTH 1 54.24 53.08 15.21 0.00 0.00
70
+ ATOM 70 C PTH 1 54.24 54.08 9.21 0.00 0.00
71
+ ATOM 71 C PTH 1 54.24 54.08 10.21 0.00 0.00
72
+ ATOM 72 C PTH 1 54.24 54.08 11.21 0.00 0.00
73
+ ATOM 73 C PTH 1 54.24 54.08 12.21 0.00 0.00
74
+ ATOM 74 C PTH 1 54.24 54.08 13.21 0.00 0.00
75
+ ATOM 75 C PTH 1 54.24 54.08 14.21 0.00 0.00
76
+ ATOM 76 C PTH 1 54.24 55.08 10.21 0.00 0.00
77
+ ATOM 77 C PTH 1 54.24 55.08 11.21 0.00 0.00
78
+ ATOM 78 C PTH 1 54.24 55.08 12.21 0.00 0.00
79
+ ATOM 79 C PTH 1 54.24 55.08 13.21 0.00 0.00
80
+ ATOM 80 C PTH 1 54.24 55.08 14.21 0.00 0.00
81
+ ATOM 81 C PTH 1 55.24 47.08 14.21 0.00 0.00
82
+ ATOM 82 C PTH 1 55.24 48.08 12.21 0.00 0.00
83
+ ATOM 83 C PTH 1 55.24 48.08 13.21 0.00 0.00
84
+ ATOM 84 C PTH 1 55.24 48.08 14.21 0.00 0.00
85
+ ATOM 85 C PTH 1 55.24 48.08 15.21 0.00 0.00
86
+ ATOM 86 C PTH 1 55.24 49.08 11.21 0.00 0.00
87
+ ATOM 87 C PTH 1 55.24 49.08 12.21 0.00 0.00
88
+ ATOM 88 C PTH 1 55.24 49.08 13.21 0.00 0.00
89
+ ATOM 89 C PTH 1 55.24 49.08 14.21 0.00 0.00
90
+ ATOM 90 C PTH 1 55.24 49.08 15.21 0.00 0.00
91
+ ATOM 91 C PTH 1 55.24 50.08 10.21 0.00 0.00
92
+ ATOM 92 C PTH 1 55.24 50.08 11.21 0.00 0.00
93
+ ATOM 93 C PTH 1 55.24 50.08 12.21 0.00 0.00
94
+ ATOM 94 C PTH 1 55.24 50.08 13.21 0.00 0.00
95
+ ATOM 95 C PTH 1 55.24 50.08 14.21 0.00 0.00
96
+ ATOM 96 C PTH 1 55.24 50.08 15.21 0.00 0.00
97
+ ATOM 97 C PTH 1 55.24 51.08 10.21 0.00 0.00
98
+ ATOM 98 C PTH 1 55.24 51.08 11.21 0.00 0.00
99
+ ATOM 99 C PTH 1 55.24 51.08 12.21 0.00 0.00
100
+ ATOM 100 C PTH 1 55.24 51.08 13.21 0.00 0.00
101
+ ATOM 101 C PTH 1 55.24 51.08 14.21 0.00 0.00
102
+ ATOM 102 C PTH 1 55.24 51.08 15.21 0.00 0.00
103
+ ATOM 103 C PTH 1 55.24 52.08 9.21 0.00 0.00
104
+ ATOM 104 C PTH 1 55.24 52.08 10.21 0.00 0.00
105
+ ATOM 105 C PTH 1 55.24 52.08 11.21 0.00 0.00
106
+ ATOM 106 C PTH 1 55.24 52.08 12.21 0.00 0.00
107
+ ATOM 107 C PTH 1 55.24 52.08 13.21 0.00 0.00
108
+ ATOM 108 C PTH 1 55.24 52.08 14.21 0.00 0.00
109
+ ATOM 109 C PTH 1 55.24 52.08 15.21 0.00 0.00
110
+ ATOM 110 C PTH 1 55.24 53.08 10.21 0.00 0.00
111
+ ATOM 111 C PTH 1 55.24 53.08 11.21 0.00 0.00
112
+ ATOM 112 C PTH 1 55.24 53.08 12.21 0.00 0.00
113
+ ATOM 113 C PTH 1 55.24 53.08 13.21 0.00 0.00
114
+ ATOM 114 C PTH 1 55.24 53.08 14.21 0.00 0.00
115
+ ATOM 115 C PTH 1 55.24 53.08 15.21 0.00 0.00
116
+ ATOM 116 C PTH 1 55.24 54.08 10.21 0.00 0.00
117
+ ATOM 117 C PTH 1 55.24 54.08 11.21 0.00 0.00
118
+ ATOM 118 C PTH 1 55.24 54.08 12.21 0.00 0.00
119
+ ATOM 119 C PTH 1 55.24 54.08 13.21 0.00 0.00
120
+ ATOM 120 C PTH 1 55.24 54.08 14.21 0.00 0.00
121
+ ATOM 121 C PTH 1 55.24 54.08 15.21 0.00 0.00
122
+ ATOM 122 C PTH 1 55.24 55.08 11.21 0.00 0.00
123
+ ATOM 123 C PTH 1 55.24 55.08 12.21 0.00 0.00
124
+ ATOM 124 C PTH 1 55.24 55.08 13.21 0.00 0.00
125
+ ATOM 125 C PTH 1 55.24 55.08 14.21 0.00 0.00
126
+ ATOM 126 C PTH 1 56.24 48.08 12.21 0.00 0.00
127
+ ATOM 127 C PTH 1 56.24 48.08 13.21 0.00 0.00
128
+ ATOM 128 C PTH 1 56.24 48.08 14.21 0.00 0.00
129
+ ATOM 129 C PTH 1 56.24 48.08 15.21 0.00 0.00
130
+ ATOM 130 C PTH 1 56.24 49.08 11.21 0.00 0.00
131
+ ATOM 131 C PTH 1 56.24 49.08 12.21 0.00 0.00
132
+ ATOM 132 C PTH 1 56.24 49.08 13.21 0.00 0.00
133
+ ATOM 133 C PTH 1 56.24 49.08 14.21 0.00 0.00
134
+ ATOM 134 C PTH 1 56.24 49.08 15.21 0.00 0.00
135
+ ATOM 135 C PTH 1 56.24 50.08 10.21 0.00 0.00
136
+ ATOM 136 C PTH 1 56.24 50.08 11.21 0.00 0.00
137
+ ATOM 137 C PTH 1 56.24 50.08 12.21 0.00 0.00
138
+ ATOM 138 C PTH 1 56.24 50.08 13.21 0.00 0.00
139
+ ATOM 139 C PTH 1 56.24 50.08 14.21 0.00 0.00
140
+ ATOM 140 C PTH 1 56.24 50.08 15.21 0.00 0.00
141
+ ATOM 141 C PTH 1 56.24 51.08 10.21 0.00 0.00
142
+ ATOM 142 C PTH 1 56.24 51.08 11.21 0.00 0.00
143
+ ATOM 143 C PTH 1 56.24 51.08 12.21 0.00 0.00
144
+ ATOM 144 C PTH 1 56.24 51.08 13.21 0.00 0.00
145
+ ATOM 145 C PTH 1 56.24 51.08 14.21 0.00 0.00
146
+ ATOM 146 C PTH 1 56.24 51.08 15.21 0.00 0.00
147
+ ATOM 147 C PTH 1 56.24 52.08 10.21 0.00 0.00
148
+ ATOM 148 C PTH 1 56.24 52.08 11.21 0.00 0.00
149
+ ATOM 149 C PTH 1 56.24 52.08 12.21 0.00 0.00
150
+ ATOM 150 C PTH 1 56.24 52.08 13.21 0.00 0.00
151
+ ATOM 151 C PTH 1 56.24 52.08 14.21 0.00 0.00
152
+ ATOM 152 C PTH 1 56.24 52.08 15.21 0.00 0.00
153
+ ATOM 153 C PTH 1 56.24 53.08 10.21 0.00 0.00
154
+ ATOM 154 C PTH 1 56.24 53.08 11.21 0.00 0.00
155
+ ATOM 155 C PTH 1 56.24 53.08 12.21 0.00 0.00
156
+ ATOM 156 C PTH 1 56.24 53.08 13.21 0.00 0.00
157
+ ATOM 157 C PTH 1 56.24 53.08 14.21 0.00 0.00
158
+ ATOM 158 C PTH 1 56.24 53.08 15.21 0.00 0.00
159
+ ATOM 159 C PTH 1 56.24 54.08 10.21 0.00 0.00
160
+ ATOM 160 C PTH 1 56.24 54.08 11.21 0.00 0.00
161
+ ATOM 161 C PTH 1 56.24 54.08 12.21 0.00 0.00
162
+ ATOM 162 C PTH 1 56.24 54.08 13.21 0.00 0.00
163
+ ATOM 163 C PTH 1 56.24 54.08 14.21 0.00 0.00
164
+ ATOM 164 C PTH 1 56.24 54.08 15.21 0.00 0.00
165
+ ATOM 165 C PTH 1 56.24 55.08 11.21 0.00 0.00
166
+ ATOM 166 C PTH 1 56.24 55.08 12.21 0.00 0.00
167
+ ATOM 167 C PTH 1 56.24 55.08 13.21 0.00 0.00
168
+ ATOM 168 C PTH 1 56.24 55.08 14.21 0.00 0.00
169
+ ATOM 169 C PTH 1 56.24 55.08 15.21 0.00 0.00
170
+ ATOM 170 C PTH 1 57.24 49.08 12.21 0.00 0.00
171
+ ATOM 171 C PTH 1 57.24 49.08 13.21 0.00 0.00
172
+ ATOM 172 C PTH 1 57.24 50.08 11.21 0.00 0.00
173
+ ATOM 173 C PTH 1 57.24 50.08 12.21 0.00 0.00
174
+ ATOM 174 C PTH 1 57.24 50.08 13.21 0.00 0.00
175
+ ATOM 175 C PTH 1 57.24 50.08 14.21 0.00 0.00
176
+ ATOM 176 C PTH 1 57.24 51.08 10.21 0.00 0.00
177
+ ATOM 177 C PTH 1 57.24 51.08 11.21 0.00 0.00
178
+ ATOM 178 C PTH 1 57.24 51.08 12.21 0.00 0.00
179
+ ATOM 179 C PTH 1 57.24 51.08 13.21 0.00 0.00
180
+ ATOM 180 C PTH 1 57.24 51.08 14.21 0.00 0.00
181
+ ATOM 181 C PTH 1 57.24 51.08 15.21 0.00 0.00
182
+ ATOM 182 C PTH 1 57.24 52.08 10.21 0.00 0.00
183
+ ATOM 183 C PTH 1 57.24 52.08 11.21 0.00 0.00
184
+ ATOM 184 C PTH 1 57.24 52.08 12.21 0.00 0.00
185
+ ATOM 185 C PTH 1 57.24 52.08 13.21 0.00 0.00
186
+ ATOM 186 C PTH 1 57.24 52.08 14.21 0.00 0.00
187
+ ATOM 187 C PTH 1 57.24 52.08 15.21 0.00 0.00
188
+ ATOM 188 C PTH 1 57.24 53.08 10.21 0.00 0.00
189
+ ATOM 189 C PTH 1 57.24 53.08 11.21 0.00 0.00
190
+ ATOM 190 C PTH 1 57.24 53.08 12.21 0.00 0.00
191
+ ATOM 191 C PTH 1 57.24 53.08 13.21 0.00 0.00
192
+ ATOM 192 C PTH 1 57.24 53.08 14.21 0.00 0.00
193
+ ATOM 193 C PTH 1 57.24 53.08 15.21 0.00 0.00
194
+ ATOM 194 C PTH 1 57.24 54.08 11.21 0.00 0.00
195
+ ATOM 195 C PTH 1 57.24 54.08 12.21 0.00 0.00
196
+ ATOM 196 C PTH 1 57.24 54.08 13.21 0.00 0.00
197
+ ATOM 197 C PTH 1 57.24 54.08 14.21 0.00 0.00
198
+ ATOM 198 C PTH 1 57.24 54.08 15.21 0.00 0.00
199
+ ATOM 199 C PTH 1 57.24 55.08 11.21 0.00 0.00
200
+ ATOM 200 C PTH 1 57.24 55.08 12.21 0.00 0.00
201
+ ATOM 201 C PTH 1 57.24 55.08 13.21 0.00 0.00
202
+ ATOM 202 C PTH 1 57.24 55.08 14.21 0.00 0.00
203
+ ATOM 203 C PTH 1 58.24 51.08 12.21 0.00 0.00
204
+ ATOM 204 C PTH 1 58.24 52.08 11.21 0.00 0.00
205
+ ATOM 205 C PTH 1 58.24 52.08 12.21 0.00 0.00
206
+ ATOM 206 C PTH 1 58.24 52.08 13.21 0.00 0.00
207
+ ATOM 207 C PTH 1 58.24 52.08 14.21 0.00 0.00
208
+ ATOM 208 C PTH 1 58.24 53.08 11.21 0.00 0.00
209
+ ATOM 209 C PTH 1 58.24 53.08 12.21 0.00 0.00
210
+ ATOM 210 C PTH 1 58.24 53.08 13.21 0.00 0.00
211
+ ATOM 211 C PTH 1 58.24 53.08 14.21 0.00 0.00
212
+ ATOM 212 C PTH 1 58.24 54.08 11.21 0.00 0.00
213
+ ATOM 213 C PTH 1 58.24 54.08 12.21 0.00 0.00
214
+ ATOM 214 C PTH 1 58.24 54.08 13.21 0.00 0.00
215
+ ATOM 215 C PTH 1 58.24 54.08 14.21 0.00 0.00
216
+ ATOM 216 C PTH 1 58.24 55.08 11.21 0.00 0.00
217
+ ATOM 217 C PTH 1 58.24 55.08 12.21 0.00 0.00
218
+ ATOM 218 C PTH 1 58.24 55.08 13.21 0.00 0.00
data/files/A009R/pocket_04.pdb ADDED
@@ -0,0 +1,155 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 79.24 65.08 29.21 0.00 0.00
2
+ ATOM 2 C PTH 1 79.24 65.08 30.21 0.00 0.00
3
+ ATOM 3 C PTH 1 79.24 65.08 31.21 0.00 0.00
4
+ ATOM 4 C PTH 1 79.24 66.08 29.21 0.00 0.00
5
+ ATOM 5 C PTH 1 79.24 66.08 30.21 0.00 0.00
6
+ ATOM 6 C PTH 1 79.24 66.08 31.21 0.00 0.00
7
+ ATOM 7 C PTH 1 79.24 67.08 30.21 0.00 0.00
8
+ ATOM 8 C PTH 1 79.24 67.08 31.21 0.00 0.00
9
+ ATOM 9 C PTH 1 80.24 64.08 29.21 0.00 0.00
10
+ ATOM 10 C PTH 1 80.24 64.08 30.21 0.00 0.00
11
+ ATOM 11 C PTH 1 80.24 64.08 31.21 0.00 0.00
12
+ ATOM 12 C PTH 1 80.24 65.08 28.21 0.00 0.00
13
+ ATOM 13 C PTH 1 80.24 65.08 29.21 0.00 0.00
14
+ ATOM 14 C PTH 1 80.24 65.08 30.21 0.00 0.00
15
+ ATOM 15 C PTH 1 80.24 65.08 31.21 0.00 0.00
16
+ ATOM 16 C PTH 1 80.24 65.08 32.21 0.00 0.00
17
+ ATOM 17 C PTH 1 80.24 66.08 28.21 0.00 0.00
18
+ ATOM 18 C PTH 1 80.24 66.08 29.21 0.00 0.00
19
+ ATOM 19 C PTH 1 80.24 66.08 30.21 0.00 0.00
20
+ ATOM 20 C PTH 1 80.24 66.08 31.21 0.00 0.00
21
+ ATOM 21 C PTH 1 80.24 66.08 32.21 0.00 0.00
22
+ ATOM 22 C PTH 1 80.24 67.08 28.21 0.00 0.00
23
+ ATOM 23 C PTH 1 80.24 67.08 29.21 0.00 0.00
24
+ ATOM 24 C PTH 1 80.24 67.08 30.21 0.00 0.00
25
+ ATOM 25 C PTH 1 80.24 67.08 31.21 0.00 0.00
26
+ ATOM 26 C PTH 1 80.24 67.08 32.21 0.00 0.00
27
+ ATOM 27 C PTH 1 81.24 64.08 29.21 0.00 0.00
28
+ ATOM 28 C PTH 1 81.24 64.08 30.21 0.00 0.00
29
+ ATOM 29 C PTH 1 81.24 64.08 31.21 0.00 0.00
30
+ ATOM 30 C PTH 1 81.24 65.08 28.21 0.00 0.00
31
+ ATOM 31 C PTH 1 81.24 65.08 29.21 0.00 0.00
32
+ ATOM 32 C PTH 1 81.24 65.08 30.21 0.00 0.00
33
+ ATOM 33 C PTH 1 81.24 65.08 31.21 0.00 0.00
34
+ ATOM 34 C PTH 1 81.24 65.08 32.21 0.00 0.00
35
+ ATOM 35 C PTH 1 81.24 66.08 28.21 0.00 0.00
36
+ ATOM 36 C PTH 1 81.24 66.08 29.21 0.00 0.00
37
+ ATOM 37 C PTH 1 81.24 66.08 30.21 0.00 0.00
38
+ ATOM 38 C PTH 1 81.24 66.08 31.21 0.00 0.00
39
+ ATOM 39 C PTH 1 81.24 66.08 32.21 0.00 0.00
40
+ ATOM 40 C PTH 1 81.24 67.08 28.21 0.00 0.00
41
+ ATOM 41 C PTH 1 81.24 67.08 29.21 0.00 0.00
42
+ ATOM 42 C PTH 1 81.24 67.08 30.21 0.00 0.00
43
+ ATOM 43 C PTH 1 81.24 67.08 31.21 0.00 0.00
44
+ ATOM 44 C PTH 1 81.24 67.08 32.21 0.00 0.00
45
+ ATOM 45 C PTH 1 81.24 68.08 29.21 0.00 0.00
46
+ ATOM 46 C PTH 1 81.24 68.08 30.21 0.00 0.00
47
+ ATOM 47 C PTH 1 81.24 68.08 31.21 0.00 0.00
48
+ ATOM 48 C PTH 1 82.24 64.08 29.21 0.00 0.00
49
+ ATOM 49 C PTH 1 82.24 64.08 30.21 0.00 0.00
50
+ ATOM 50 C PTH 1 82.24 64.08 31.21 0.00 0.00
51
+ ATOM 51 C PTH 1 82.24 65.08 28.21 0.00 0.00
52
+ ATOM 52 C PTH 1 82.24 65.08 29.21 0.00 0.00
53
+ ATOM 53 C PTH 1 82.24 65.08 30.21 0.00 0.00
54
+ ATOM 54 C PTH 1 82.24 65.08 31.21 0.00 0.00
55
+ ATOM 55 C PTH 1 82.24 65.08 32.21 0.00 0.00
56
+ ATOM 56 C PTH 1 82.24 66.08 27.21 0.00 0.00
57
+ ATOM 57 C PTH 1 82.24 66.08 28.21 0.00 0.00
58
+ ATOM 58 C PTH 1 82.24 66.08 29.21 0.00 0.00
59
+ ATOM 59 C PTH 1 82.24 66.08 30.21 0.00 0.00
60
+ ATOM 60 C PTH 1 82.24 66.08 31.21 0.00 0.00
61
+ ATOM 61 C PTH 1 82.24 66.08 32.21 0.00 0.00
62
+ ATOM 62 C PTH 1 82.24 67.08 27.21 0.00 0.00
63
+ ATOM 63 C PTH 1 82.24 67.08 28.21 0.00 0.00
64
+ ATOM 64 C PTH 1 82.24 67.08 29.21 0.00 0.00
65
+ ATOM 65 C PTH 1 82.24 67.08 30.21 0.00 0.00
66
+ ATOM 66 C PTH 1 82.24 67.08 31.21 0.00 0.00
67
+ ATOM 67 C PTH 1 82.24 67.08 32.21 0.00 0.00
68
+ ATOM 68 C PTH 1 82.24 68.08 27.21 0.00 0.00
69
+ ATOM 69 C PTH 1 82.24 68.08 28.21 0.00 0.00
70
+ ATOM 70 C PTH 1 82.24 68.08 29.21 0.00 0.00
71
+ ATOM 71 C PTH 1 82.24 68.08 30.21 0.00 0.00
72
+ ATOM 72 C PTH 1 82.24 68.08 31.21 0.00 0.00
73
+ ATOM 73 C PTH 1 82.24 69.08 29.21 0.00 0.00
74
+ ATOM 74 C PTH 1 82.24 69.08 30.21 0.00 0.00
75
+ ATOM 75 C PTH 1 83.24 65.08 29.21 0.00 0.00
76
+ ATOM 76 C PTH 1 83.24 65.08 30.21 0.00 0.00
77
+ ATOM 77 C PTH 1 83.24 65.08 31.21 0.00 0.00
78
+ ATOM 78 C PTH 1 83.24 66.08 27.21 0.00 0.00
79
+ ATOM 79 C PTH 1 83.24 66.08 28.21 0.00 0.00
80
+ ATOM 80 C PTH 1 83.24 66.08 29.21 0.00 0.00
81
+ ATOM 81 C PTH 1 83.24 66.08 30.21 0.00 0.00
82
+ ATOM 82 C PTH 1 83.24 66.08 31.21 0.00 0.00
83
+ ATOM 83 C PTH 1 83.24 67.08 27.21 0.00 0.00
84
+ ATOM 84 C PTH 1 83.24 67.08 28.21 0.00 0.00
85
+ ATOM 85 C PTH 1 83.24 67.08 29.21 0.00 0.00
86
+ ATOM 86 C PTH 1 83.24 67.08 30.21 0.00 0.00
87
+ ATOM 87 C PTH 1 83.24 67.08 31.21 0.00 0.00
88
+ ATOM 88 C PTH 1 83.24 68.08 27.21 0.00 0.00
89
+ ATOM 89 C PTH 1 83.24 68.08 28.21 0.00 0.00
90
+ ATOM 90 C PTH 1 83.24 68.08 29.21 0.00 0.00
91
+ ATOM 91 C PTH 1 83.24 68.08 30.21 0.00 0.00
92
+ ATOM 92 C PTH 1 83.24 68.08 31.21 0.00 0.00
93
+ ATOM 93 C PTH 1 83.24 69.08 28.21 0.00 0.00
94
+ ATOM 94 C PTH 1 83.24 69.08 29.21 0.00 0.00
95
+ ATOM 95 C PTH 1 83.24 69.08 30.21 0.00 0.00
96
+ ATOM 96 C PTH 1 83.24 69.08 31.21 0.00 0.00
97
+ ATOM 97 C PTH 1 83.24 70.08 29.21 0.00 0.00
98
+ ATOM 98 C PTH 1 83.24 70.08 30.21 0.00 0.00
99
+ ATOM 99 C PTH 1 83.24 70.08 31.21 0.00 0.00
100
+ ATOM 100 C PTH 1 84.24 66.08 28.21 0.00 0.00
101
+ ATOM 101 C PTH 1 84.24 66.08 29.21 0.00 0.00
102
+ ATOM 102 C PTH 1 84.24 66.08 30.21 0.00 0.00
103
+ ATOM 103 C PTH 1 84.24 67.08 27.21 0.00 0.00
104
+ ATOM 104 C PTH 1 84.24 67.08 28.21 0.00 0.00
105
+ ATOM 105 C PTH 1 84.24 67.08 29.21 0.00 0.00
106
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data/files/A009R/pocket_05.pdb ADDED
@@ -0,0 +1,128 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
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data/files/A009R/pocket_06.pdb ADDED
@@ -0,0 +1,115 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
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+ ATOM 115 C PTH 1 64.24 69.08 26.21 0.00 0.00
data/files/A009R/pocket_07.pdb ADDED
@@ -0,0 +1,108 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
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data/files/A009R/pocket_08.pdb ADDED
@@ -0,0 +1,87 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 70.24 82.08 26.21 0.00 0.00
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+ ATOM 87 C PTH 1 75.24 83.08 29.21 0.00 0.00
data/files/A009R/pocket_09.pdb ADDED
@@ -0,0 +1,81 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
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+ ATOM 81 C PTH 1 57.24 82.08 24.21 0.00 0.00
data/files/A009R/pocket_10.pdb ADDED
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1
+ ATOM 1 C PTH 1 74.24 53.08 27.21 0.00 0.00
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data/files/A009R/structure.pdb ADDED
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data/files/A00BR/pocket_01.pdb ADDED
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1
+ ATOM 1 C PTH 1 44.19 98.67 62.08 0.00 0.00
2
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+ ATOM 182 C PTH 1 49.19 88.67 53.08 0.00 0.00
183
+ ATOM 183 C PTH 1 49.19 88.67 54.08 0.00 0.00
184
+ ATOM 184 C PTH 1 49.19 88.67 55.08 0.00 0.00
185
+ ATOM 185 C PTH 1 49.19 88.67 56.08 0.00 0.00
186
+ ATOM 186 C PTH 1 49.19 89.67 50.08 0.00 0.00
187
+ ATOM 187 C PTH 1 49.19 89.67 51.08 0.00 0.00
188
+ ATOM 188 C PTH 1 49.19 89.67 52.08 0.00 0.00
189
+ ATOM 189 C PTH 1 49.19 89.67 53.08 0.00 0.00
190
+ ATOM 190 C PTH 1 49.19 89.67 54.08 0.00 0.00
191
+ ATOM 191 C PTH 1 49.19 89.67 55.08 0.00 0.00
192
+ ATOM 192 C PTH 1 49.19 89.67 56.08 0.00 0.00
193
+ ATOM 193 C PTH 1 49.19 89.67 57.08 0.00 0.00
194
+ ATOM 194 C PTH 1 49.19 90.67 51.08 0.00 0.00
195
+ ATOM 195 C PTH 1 49.19 90.67 52.08 0.00 0.00
196
+ ATOM 196 C PTH 1 49.19 90.67 53.08 0.00 0.00
197
+ ATOM 197 C PTH 1 49.19 90.67 54.08 0.00 0.00
198
+ ATOM 198 C PTH 1 49.19 90.67 55.08 0.00 0.00
199
+ ATOM 199 C PTH 1 49.19 90.67 56.08 0.00 0.00
200
+ ATOM 200 C PTH 1 49.19 90.67 57.08 0.00 0.00
201
+ ATOM 201 C PTH 1 49.19 91.67 52.08 0.00 0.00
202
+ ATOM 202 C PTH 1 49.19 91.67 53.08 0.00 0.00
203
+ ATOM 203 C PTH 1 49.19 91.67 54.08 0.00 0.00
204
+ ATOM 204 C PTH 1 49.19 91.67 55.08 0.00 0.00
205
+ ATOM 205 C PTH 1 49.19 91.67 56.08 0.00 0.00
206
+ ATOM 206 C PTH 1 49.19 91.67 57.08 0.00 0.00
207
+ ATOM 207 C PTH 1 49.19 91.67 58.08 0.00 0.00
208
+ ATOM 208 C PTH 1 49.19 92.67 53.08 0.00 0.00
209
+ ATOM 209 C PTH 1 49.19 92.67 54.08 0.00 0.00
210
+ ATOM 210 C PTH 1 49.19 92.67 55.08 0.00 0.00
211
+ ATOM 211 C PTH 1 49.19 92.67 56.08 0.00 0.00
212
+ ATOM 212 C PTH 1 49.19 92.67 57.08 0.00 0.00
213
+ ATOM 213 C PTH 1 49.19 92.67 58.08 0.00 0.00
214
+ ATOM 214 C PTH 1 49.19 92.67 59.08 0.00 0.00
215
+ ATOM 215 C PTH 1 49.19 93.67 54.08 0.00 0.00
216
+ ATOM 216 C PTH 1 49.19 93.67 55.08 0.00 0.00
217
+ ATOM 217 C PTH 1 49.19 93.67 56.08 0.00 0.00
218
+ ATOM 218 C PTH 1 49.19 93.67 57.08 0.00 0.00
219
+ ATOM 219 C PTH 1 49.19 93.67 58.08 0.00 0.00
220
+ ATOM 220 C PTH 1 49.19 93.67 59.08 0.00 0.00
221
+ ATOM 221 C PTH 1 49.19 94.67 55.08 0.00 0.00
222
+ ATOM 222 C PTH 1 49.19 94.67 56.08 0.00 0.00
223
+ ATOM 223 C PTH 1 49.19 94.67 57.08 0.00 0.00
224
+ ATOM 224 C PTH 1 49.19 94.67 58.08 0.00 0.00
225
+ ATOM 225 C PTH 1 49.19 94.67 59.08 0.00 0.00
226
+ ATOM 226 C PTH 1 49.19 95.67 55.08 0.00 0.00
227
+ ATOM 227 C PTH 1 49.19 95.67 56.08 0.00 0.00
228
+ ATOM 228 C PTH 1 49.19 95.67 57.08 0.00 0.00
229
+ ATOM 229 C PTH 1 49.19 95.67 58.08 0.00 0.00
230
+ ATOM 230 C PTH 1 49.19 95.67 59.08 0.00 0.00
231
+ ATOM 231 C PTH 1 49.19 96.67 56.08 0.00 0.00
232
+ ATOM 232 C PTH 1 49.19 96.67 57.08 0.00 0.00
233
+ ATOM 233 C PTH 1 49.19 96.67 58.08 0.00 0.00
234
+ ATOM 234 C PTH 1 49.19 96.67 59.08 0.00 0.00
235
+ ATOM 235 C PTH 1 49.19 97.67 56.08 0.00 0.00
236
+ ATOM 236 C PTH 1 49.19 97.67 57.08 0.00 0.00
237
+ ATOM 237 C PTH 1 49.19 97.67 58.08 0.00 0.00
238
+ ATOM 238 C PTH 1 49.19 97.67 59.08 0.00 0.00
239
+ ATOM 239 C PTH 1 49.19 98.67 56.08 0.00 0.00
240
+ ATOM 240 C PTH 1 49.19 98.67 57.08 0.00 0.00
241
+ ATOM 241 C PTH 1 49.19 98.67 58.08 0.00 0.00
242
+ ATOM 242 C PTH 1 49.19 98.67 59.08 0.00 0.00
243
+ ATOM 243 C PTH 1 49.19 99.67 56.08 0.00 0.00
244
+ ATOM 244 C PTH 1 49.19 99.67 57.08 0.00 0.00
245
+ ATOM 245 C PTH 1 49.19 99.67 58.08 0.00 0.00
246
+ ATOM 246 C PTH 1 49.19 99.67 59.08 0.00 0.00
247
+ ATOM 247 C PTH 1 49.19 100.67 56.08 0.00 0.00
248
+ ATOM 248 C PTH 1 49.19 100.67 57.08 0.00 0.00
249
+ ATOM 249 C PTH 1 49.19 100.67 58.08 0.00 0.00
250
+ ATOM 250 C PTH 1 49.19 100.67 59.08 0.00 0.00
251
+ ATOM 251 C PTH 1 49.19 101.67 56.08 0.00 0.00
252
+ ATOM 252 C PTH 1 49.19 101.67 57.08 0.00 0.00
253
+ ATOM 253 C PTH 1 49.19 101.67 58.08 0.00 0.00
254
+ ATOM 254 C PTH 1 49.19 101.67 59.08 0.00 0.00
255
+ ATOM 255 C PTH 1 49.19 102.67 56.08 0.00 0.00
256
+ ATOM 256 C PTH 1 49.19 102.67 57.08 0.00 0.00
257
+ ATOM 257 C PTH 1 49.19 102.67 58.08 0.00 0.00
258
+ ATOM 258 C PTH 1 50.19 86.67 51.08 0.00 0.00
259
+ ATOM 259 C PTH 1 50.19 86.67 52.08 0.00 0.00
260
+ ATOM 260 C PTH 1 50.19 86.67 53.08 0.00 0.00
261
+ ATOM 261 C PTH 1 50.19 87.67 49.08 0.00 0.00
262
+ ATOM 262 C PTH 1 50.19 87.67 50.08 0.00 0.00
263
+ ATOM 263 C PTH 1 50.19 87.67 51.08 0.00 0.00
264
+ ATOM 264 C PTH 1 50.19 87.67 52.08 0.00 0.00
265
+ ATOM 265 C PTH 1 50.19 87.67 53.08 0.00 0.00
266
+ ATOM 266 C PTH 1 50.19 87.67 54.08 0.00 0.00
267
+ ATOM 267 C PTH 1 50.19 87.67 55.08 0.00 0.00
268
+ ATOM 268 C PTH 1 50.19 87.67 56.08 0.00 0.00
269
+ ATOM 269 C PTH 1 50.19 88.67 49.08 0.00 0.00
270
+ ATOM 270 C PTH 1 50.19 88.67 50.08 0.00 0.00
271
+ ATOM 271 C PTH 1 50.19 88.67 51.08 0.00 0.00
272
+ ATOM 272 C PTH 1 50.19 88.67 52.08 0.00 0.00
273
+ ATOM 273 C PTH 1 50.19 88.67 53.08 0.00 0.00
274
+ ATOM 274 C PTH 1 50.19 88.67 54.08 0.00 0.00
275
+ ATOM 275 C PTH 1 50.19 88.67 55.08 0.00 0.00
276
+ ATOM 276 C PTH 1 50.19 88.67 56.08 0.00 0.00
277
+ ATOM 277 C PTH 1 50.19 89.67 49.08 0.00 0.00
278
+ ATOM 278 C PTH 1 50.19 89.67 50.08 0.00 0.00
279
+ ATOM 279 C PTH 1 50.19 89.67 51.08 0.00 0.00
280
+ ATOM 280 C PTH 1 50.19 89.67 52.08 0.00 0.00
281
+ ATOM 281 C PTH 1 50.19 89.67 53.08 0.00 0.00
282
+ ATOM 282 C PTH 1 50.19 89.67 54.08 0.00 0.00
283
+ ATOM 283 C PTH 1 50.19 89.67 55.08 0.00 0.00
284
+ ATOM 284 C PTH 1 50.19 89.67 56.08 0.00 0.00
285
+ ATOM 285 C PTH 1 50.19 89.67 57.08 0.00 0.00
286
+ ATOM 286 C PTH 1 50.19 90.67 50.08 0.00 0.00
287
+ ATOM 287 C PTH 1 50.19 90.67 51.08 0.00 0.00
288
+ ATOM 288 C PTH 1 50.19 90.67 52.08 0.00 0.00
289
+ ATOM 289 C PTH 1 50.19 90.67 53.08 0.00 0.00
290
+ ATOM 290 C PTH 1 50.19 90.67 54.08 0.00 0.00
291
+ ATOM 291 C PTH 1 50.19 90.67 55.08 0.00 0.00
292
+ ATOM 292 C PTH 1 50.19 90.67 56.08 0.00 0.00
293
+ ATOM 293 C PTH 1 50.19 90.67 57.08 0.00 0.00
294
+ ATOM 294 C PTH 1 50.19 90.67 58.08 0.00 0.00
295
+ ATOM 295 C PTH 1 50.19 91.67 50.08 0.00 0.00
296
+ ATOM 296 C PTH 1 50.19 91.67 51.08 0.00 0.00
297
+ ATOM 297 C PTH 1 50.19 91.67 52.08 0.00 0.00
298
+ ATOM 298 C PTH 1 50.19 91.67 53.08 0.00 0.00
299
+ ATOM 299 C PTH 1 50.19 91.67 54.08 0.00 0.00
300
+ ATOM 300 C PTH 1 50.19 91.67 55.08 0.00 0.00
301
+ ATOM 301 C PTH 1 50.19 91.67 56.08 0.00 0.00
302
+ ATOM 302 C PTH 1 50.19 91.67 57.08 0.00 0.00
303
+ ATOM 303 C PTH 1 50.19 91.67 58.08 0.00 0.00
304
+ ATOM 304 C PTH 1 50.19 92.67 53.08 0.00 0.00
305
+ ATOM 305 C PTH 1 50.19 92.67 54.08 0.00 0.00
306
+ ATOM 306 C PTH 1 50.19 92.67 55.08 0.00 0.00
307
+ ATOM 307 C PTH 1 50.19 92.67 56.08 0.00 0.00
308
+ ATOM 308 C PTH 1 50.19 92.67 57.08 0.00 0.00
309
+ ATOM 309 C PTH 1 50.19 92.67 58.08 0.00 0.00
310
+ ATOM 310 C PTH 1 50.19 92.67 59.08 0.00 0.00
311
+ ATOM 311 C PTH 1 50.19 93.67 54.08 0.00 0.00
312
+ ATOM 312 C PTH 1 50.19 93.67 55.08 0.00 0.00
313
+ ATOM 313 C PTH 1 50.19 93.67 56.08 0.00 0.00
314
+ ATOM 314 C PTH 1 50.19 93.67 57.08 0.00 0.00
315
+ ATOM 315 C PTH 1 50.19 93.67 58.08 0.00 0.00
316
+ ATOM 316 C PTH 1 50.19 93.67 59.08 0.00 0.00
317
+ ATOM 317 C PTH 1 50.19 94.67 54.08 0.00 0.00
318
+ ATOM 318 C PTH 1 50.19 94.67 55.08 0.00 0.00
319
+ ATOM 319 C PTH 1 50.19 94.67 56.08 0.00 0.00
320
+ ATOM 320 C PTH 1 50.19 94.67 57.08 0.00 0.00
321
+ ATOM 321 C PTH 1 50.19 94.67 58.08 0.00 0.00
322
+ ATOM 322 C PTH 1 50.19 94.67 59.08 0.00 0.00
323
+ ATOM 323 C PTH 1 50.19 95.67 55.08 0.00 0.00
324
+ ATOM 324 C PTH 1 50.19 95.67 56.08 0.00 0.00
325
+ ATOM 325 C PTH 1 50.19 95.67 57.08 0.00 0.00
326
+ ATOM 326 C PTH 1 50.19 95.67 58.08 0.00 0.00
327
+ ATOM 327 C PTH 1 50.19 95.67 59.08 0.00 0.00
328
+ ATOM 328 C PTH 1 50.19 96.67 56.08 0.00 0.00
329
+ ATOM 329 C PTH 1 50.19 96.67 57.08 0.00 0.00
330
+ ATOM 330 C PTH 1 50.19 96.67 58.08 0.00 0.00
331
+ ATOM 331 C PTH 1 50.19 96.67 59.08 0.00 0.00
332
+ ATOM 332 C PTH 1 50.19 97.67 56.08 0.00 0.00
333
+ ATOM 333 C PTH 1 50.19 97.67 57.08 0.00 0.00
334
+ ATOM 334 C PTH 1 50.19 97.67 58.08 0.00 0.00
335
+ ATOM 335 C PTH 1 50.19 97.67 59.08 0.00 0.00
336
+ ATOM 336 C PTH 1 50.19 98.67 56.08 0.00 0.00
337
+ ATOM 337 C PTH 1 50.19 98.67 57.08 0.00 0.00
338
+ ATOM 338 C PTH 1 50.19 98.67 58.08 0.00 0.00
339
+ ATOM 339 C PTH 1 50.19 98.67 59.08 0.00 0.00
340
+ ATOM 340 C PTH 1 50.19 99.67 55.08 0.00 0.00
341
+ ATOM 341 C PTH 1 50.19 99.67 56.08 0.00 0.00
342
+ ATOM 342 C PTH 1 50.19 99.67 57.08 0.00 0.00
343
+ ATOM 343 C PTH 1 50.19 99.67 58.08 0.00 0.00
344
+ ATOM 344 C PTH 1 50.19 100.67 56.08 0.00 0.00
345
+ ATOM 345 C PTH 1 50.19 100.67 57.08 0.00 0.00
346
+ ATOM 346 C PTH 1 50.19 100.67 58.08 0.00 0.00
347
+ ATOM 347 C PTH 1 50.19 101.67 56.08 0.00 0.00
348
+ ATOM 348 C PTH 1 50.19 101.67 57.08 0.00 0.00
349
+ ATOM 349 C PTH 1 50.19 101.67 58.08 0.00 0.00
350
+ ATOM 350 C PTH 1 51.19 86.67 51.08 0.00 0.00
351
+ ATOM 351 C PTH 1 51.19 86.67 52.08 0.00 0.00
352
+ ATOM 352 C PTH 1 51.19 86.67 53.08 0.00 0.00
353
+ ATOM 353 C PTH 1 51.19 86.67 54.08 0.00 0.00
354
+ ATOM 354 C PTH 1 51.19 86.67 55.08 0.00 0.00
355
+ ATOM 355 C PTH 1 51.19 87.67 49.08 0.00 0.00
356
+ ATOM 356 C PTH 1 51.19 87.67 50.08 0.00 0.00
357
+ ATOM 357 C PTH 1 51.19 87.67 51.08 0.00 0.00
358
+ ATOM 358 C PTH 1 51.19 87.67 52.08 0.00 0.00
359
+ ATOM 359 C PTH 1 51.19 87.67 53.08 0.00 0.00
360
+ ATOM 360 C PTH 1 51.19 87.67 54.08 0.00 0.00
361
+ ATOM 361 C PTH 1 51.19 87.67 55.08 0.00 0.00
362
+ ATOM 362 C PTH 1 51.19 87.67 56.08 0.00 0.00
363
+ ATOM 363 C PTH 1 51.19 88.67 49.08 0.00 0.00
364
+ ATOM 364 C PTH 1 51.19 88.67 50.08 0.00 0.00
365
+ ATOM 365 C PTH 1 51.19 88.67 51.08 0.00 0.00
366
+ ATOM 366 C PTH 1 51.19 88.67 52.08 0.00 0.00
367
+ ATOM 367 C PTH 1 51.19 88.67 53.08 0.00 0.00
368
+ ATOM 368 C PTH 1 51.19 88.67 54.08 0.00 0.00
369
+ ATOM 369 C PTH 1 51.19 88.67 55.08 0.00 0.00
370
+ ATOM 370 C PTH 1 51.19 88.67 56.08 0.00 0.00
371
+ ATOM 371 C PTH 1 51.19 89.67 49.08 0.00 0.00
372
+ ATOM 372 C PTH 1 51.19 89.67 50.08 0.00 0.00
373
+ ATOM 373 C PTH 1 51.19 89.67 51.08 0.00 0.00
374
+ ATOM 374 C PTH 1 51.19 89.67 52.08 0.00 0.00
375
+ ATOM 375 C PTH 1 51.19 89.67 53.08 0.00 0.00
376
+ ATOM 376 C PTH 1 51.19 89.67 54.08 0.00 0.00
377
+ ATOM 377 C PTH 1 51.19 89.67 55.08 0.00 0.00
378
+ ATOM 378 C PTH 1 51.19 89.67 56.08 0.00 0.00
379
+ ATOM 379 C PTH 1 51.19 89.67 57.08 0.00 0.00
380
+ ATOM 380 C PTH 1 51.19 90.67 49.08 0.00 0.00
381
+ ATOM 381 C PTH 1 51.19 90.67 50.08 0.00 0.00
382
+ ATOM 382 C PTH 1 51.19 90.67 51.08 0.00 0.00
383
+ ATOM 383 C PTH 1 51.19 90.67 52.08 0.00 0.00
384
+ ATOM 384 C PTH 1 51.19 90.67 53.08 0.00 0.00
385
+ ATOM 385 C PTH 1 51.19 90.67 54.08 0.00 0.00
386
+ ATOM 386 C PTH 1 51.19 90.67 55.08 0.00 0.00
387
+ ATOM 387 C PTH 1 51.19 90.67 56.08 0.00 0.00
388
+ ATOM 388 C PTH 1 51.19 90.67 57.08 0.00 0.00
389
+ ATOM 389 C PTH 1 51.19 90.67 58.08 0.00 0.00
390
+ ATOM 390 C PTH 1 51.19 91.67 50.08 0.00 0.00
391
+ ATOM 391 C PTH 1 51.19 91.67 51.08 0.00 0.00
392
+ ATOM 392 C PTH 1 51.19 91.67 52.08 0.00 0.00
393
+ ATOM 393 C PTH 1 51.19 91.67 53.08 0.00 0.00
394
+ ATOM 394 C PTH 1 51.19 91.67 54.08 0.00 0.00
395
+ ATOM 395 C PTH 1 51.19 91.67 55.08 0.00 0.00
396
+ ATOM 396 C PTH 1 51.19 91.67 56.08 0.00 0.00
397
+ ATOM 397 C PTH 1 51.19 91.67 57.08 0.00 0.00
398
+ ATOM 398 C PTH 1 51.19 91.67 58.08 0.00 0.00
399
+ ATOM 399 C PTH 1 51.19 91.67 59.08 0.00 0.00
400
+ ATOM 400 C PTH 1 51.19 92.67 52.08 0.00 0.00
401
+ ATOM 401 C PTH 1 51.19 92.67 53.08 0.00 0.00
402
+ ATOM 402 C PTH 1 51.19 92.67 54.08 0.00 0.00
403
+ ATOM 403 C PTH 1 51.19 92.67 55.08 0.00 0.00
404
+ ATOM 404 C PTH 1 51.19 92.67 56.08 0.00 0.00
405
+ ATOM 405 C PTH 1 51.19 92.67 57.08 0.00 0.00
406
+ ATOM 406 C PTH 1 51.19 92.67 58.08 0.00 0.00
407
+ ATOM 407 C PTH 1 51.19 92.67 59.08 0.00 0.00
408
+ ATOM 408 C PTH 1 51.19 93.67 54.08 0.00 0.00
409
+ ATOM 409 C PTH 1 51.19 93.67 55.08 0.00 0.00
410
+ ATOM 410 C PTH 1 51.19 93.67 56.08 0.00 0.00
411
+ ATOM 411 C PTH 1 51.19 93.67 57.08 0.00 0.00
412
+ ATOM 412 C PTH 1 51.19 93.67 58.08 0.00 0.00
413
+ ATOM 413 C PTH 1 51.19 93.67 59.08 0.00 0.00
414
+ ATOM 414 C PTH 1 51.19 94.67 55.08 0.00 0.00
415
+ ATOM 415 C PTH 1 51.19 94.67 56.08 0.00 0.00
416
+ ATOM 416 C PTH 1 51.19 94.67 57.08 0.00 0.00
417
+ ATOM 417 C PTH 1 51.19 94.67 58.08 0.00 0.00
418
+ ATOM 418 C PTH 1 51.19 94.67 59.08 0.00 0.00
419
+ ATOM 419 C PTH 1 51.19 95.67 55.08 0.00 0.00
420
+ ATOM 420 C PTH 1 51.19 95.67 56.08 0.00 0.00
421
+ ATOM 421 C PTH 1 51.19 95.67 57.08 0.00 0.00
422
+ ATOM 422 C PTH 1 51.19 95.67 58.08 0.00 0.00
423
+ ATOM 423 C PTH 1 51.19 95.67 59.08 0.00 0.00
424
+ ATOM 424 C PTH 1 51.19 96.67 56.08 0.00 0.00
425
+ ATOM 425 C PTH 1 51.19 96.67 57.08 0.00 0.00
426
+ ATOM 426 C PTH 1 51.19 96.67 58.08 0.00 0.00
427
+ ATOM 427 C PTH 1 51.19 97.67 56.08 0.00 0.00
428
+ ATOM 428 C PTH 1 51.19 97.67 57.08 0.00 0.00
429
+ ATOM 429 C PTH 1 51.19 97.67 58.08 0.00 0.00
430
+ ATOM 430 C PTH 1 51.19 98.67 56.08 0.00 0.00
431
+ ATOM 431 C PTH 1 51.19 98.67 57.08 0.00 0.00
432
+ ATOM 432 C PTH 1 51.19 98.67 58.08 0.00 0.00
433
+ ATOM 433 C PTH 1 51.19 99.67 56.08 0.00 0.00
434
+ ATOM 434 C PTH 1 51.19 99.67 57.08 0.00 0.00
435
+ ATOM 435 C PTH 1 52.19 86.67 51.08 0.00 0.00
436
+ ATOM 436 C PTH 1 52.19 86.67 52.08 0.00 0.00
437
+ ATOM 437 C PTH 1 52.19 86.67 53.08 0.00 0.00
438
+ ATOM 438 C PTH 1 52.19 86.67 54.08 0.00 0.00
439
+ ATOM 439 C PTH 1 52.19 86.67 55.08 0.00 0.00
440
+ ATOM 440 C PTH 1 52.19 87.67 49.08 0.00 0.00
441
+ ATOM 441 C PTH 1 52.19 87.67 50.08 0.00 0.00
442
+ ATOM 442 C PTH 1 52.19 87.67 51.08 0.00 0.00
443
+ ATOM 443 C PTH 1 52.19 87.67 52.08 0.00 0.00
444
+ ATOM 444 C PTH 1 52.19 87.67 53.08 0.00 0.00
445
+ ATOM 445 C PTH 1 52.19 87.67 54.08 0.00 0.00
446
+ ATOM 446 C PTH 1 52.19 87.67 55.08 0.00 0.00
447
+ ATOM 447 C PTH 1 52.19 88.67 49.08 0.00 0.00
448
+ ATOM 448 C PTH 1 52.19 88.67 50.08 0.00 0.00
449
+ ATOM 449 C PTH 1 52.19 88.67 51.08 0.00 0.00
450
+ ATOM 450 C PTH 1 52.19 88.67 52.08 0.00 0.00
451
+ ATOM 451 C PTH 1 52.19 88.67 53.08 0.00 0.00
452
+ ATOM 452 C PTH 1 52.19 88.67 54.08 0.00 0.00
453
+ ATOM 453 C PTH 1 52.19 88.67 55.08 0.00 0.00
454
+ ATOM 454 C PTH 1 52.19 88.67 56.08 0.00 0.00
455
+ ATOM 455 C PTH 1 52.19 89.67 49.08 0.00 0.00
456
+ ATOM 456 C PTH 1 52.19 89.67 50.08 0.00 0.00
457
+ ATOM 457 C PTH 1 52.19 89.67 51.08 0.00 0.00
458
+ ATOM 458 C PTH 1 52.19 89.67 52.08 0.00 0.00
459
+ ATOM 459 C PTH 1 52.19 89.67 53.08 0.00 0.00
460
+ ATOM 460 C PTH 1 52.19 89.67 54.08 0.00 0.00
461
+ ATOM 461 C PTH 1 52.19 89.67 55.08 0.00 0.00
462
+ ATOM 462 C PTH 1 52.19 89.67 56.08 0.00 0.00
463
+ ATOM 463 C PTH 1 52.19 89.67 57.08 0.00 0.00
464
+ ATOM 464 C PTH 1 52.19 90.67 49.08 0.00 0.00
465
+ ATOM 465 C PTH 1 52.19 90.67 50.08 0.00 0.00
466
+ ATOM 466 C PTH 1 52.19 90.67 51.08 0.00 0.00
467
+ ATOM 467 C PTH 1 52.19 90.67 52.08 0.00 0.00
468
+ ATOM 468 C PTH 1 52.19 90.67 53.08 0.00 0.00
469
+ ATOM 469 C PTH 1 52.19 90.67 54.08 0.00 0.00
470
+ ATOM 470 C PTH 1 52.19 90.67 55.08 0.00 0.00
471
+ ATOM 471 C PTH 1 52.19 90.67 56.08 0.00 0.00
472
+ ATOM 472 C PTH 1 52.19 90.67 57.08 0.00 0.00
473
+ ATOM 473 C PTH 1 52.19 91.67 49.08 0.00 0.00
474
+ ATOM 474 C PTH 1 52.19 91.67 50.08 0.00 0.00
475
+ ATOM 475 C PTH 1 52.19 91.67 51.08 0.00 0.00
476
+ ATOM 476 C PTH 1 52.19 91.67 52.08 0.00 0.00
477
+ ATOM 477 C PTH 1 52.19 91.67 53.08 0.00 0.00
478
+ ATOM 478 C PTH 1 52.19 91.67 54.08 0.00 0.00
479
+ ATOM 479 C PTH 1 52.19 91.67 55.08 0.00 0.00
480
+ ATOM 480 C PTH 1 52.19 91.67 56.08 0.00 0.00
481
+ ATOM 481 C PTH 1 52.19 91.67 57.08 0.00 0.00
482
+ ATOM 482 C PTH 1 52.19 91.67 58.08 0.00 0.00
483
+ ATOM 483 C PTH 1 52.19 91.67 59.08 0.00 0.00
484
+ ATOM 484 C PTH 1 52.19 92.67 52.08 0.00 0.00
485
+ ATOM 485 C PTH 1 52.19 92.67 53.08 0.00 0.00
486
+ ATOM 486 C PTH 1 52.19 92.67 54.08 0.00 0.00
487
+ ATOM 487 C PTH 1 52.19 92.67 55.08 0.00 0.00
488
+ ATOM 488 C PTH 1 52.19 92.67 56.08 0.00 0.00
489
+ ATOM 489 C PTH 1 52.19 92.67 57.08 0.00 0.00
490
+ ATOM 490 C PTH 1 52.19 92.67 58.08 0.00 0.00
491
+ ATOM 491 C PTH 1 52.19 92.67 59.08 0.00 0.00
492
+ ATOM 492 C PTH 1 52.19 92.67 60.08 0.00 0.00
493
+ ATOM 493 C PTH 1 52.19 93.67 54.08 0.00 0.00
494
+ ATOM 494 C PTH 1 52.19 93.67 55.08 0.00 0.00
495
+ ATOM 495 C PTH 1 52.19 93.67 56.08 0.00 0.00
496
+ ATOM 496 C PTH 1 52.19 93.67 57.08 0.00 0.00
497
+ ATOM 497 C PTH 1 52.19 93.67 58.08 0.00 0.00
498
+ ATOM 498 C PTH 1 52.19 93.67 59.08 0.00 0.00
499
+ ATOM 499 C PTH 1 52.19 93.67 60.08 0.00 0.00
500
+ ATOM 500 C PTH 1 52.19 94.67 55.08 0.00 0.00
501
+ ATOM 501 C PTH 1 52.19 94.67 56.08 0.00 0.00
502
+ ATOM 502 C PTH 1 52.19 94.67 57.08 0.00 0.00
503
+ ATOM 503 C PTH 1 52.19 94.67 58.08 0.00 0.00
504
+ ATOM 504 C PTH 1 52.19 94.67 59.08 0.00 0.00
505
+ ATOM 505 C PTH 1 52.19 95.67 56.08 0.00 0.00
506
+ ATOM 506 C PTH 1 52.19 95.67 57.08 0.00 0.00
507
+ ATOM 507 C PTH 1 52.19 95.67 58.08 0.00 0.00
508
+ ATOM 508 C PTH 1 52.19 96.67 56.08 0.00 0.00
509
+ ATOM 509 C PTH 1 52.19 96.67 57.08 0.00 0.00
510
+ ATOM 510 C PTH 1 52.19 96.67 58.08 0.00 0.00
511
+ ATOM 511 C PTH 1 53.19 86.67 51.08 0.00 0.00
512
+ ATOM 512 C PTH 1 53.19 86.67 52.08 0.00 0.00
513
+ ATOM 513 C PTH 1 53.19 86.67 53.08 0.00 0.00
514
+ ATOM 514 C PTH 1 53.19 86.67 54.08 0.00 0.00
515
+ ATOM 515 C PTH 1 53.19 86.67 55.08 0.00 0.00
516
+ ATOM 516 C PTH 1 53.19 87.67 50.08 0.00 0.00
517
+ ATOM 517 C PTH 1 53.19 87.67 51.08 0.00 0.00
518
+ ATOM 518 C PTH 1 53.19 87.67 52.08 0.00 0.00
519
+ ATOM 519 C PTH 1 53.19 87.67 53.08 0.00 0.00
520
+ ATOM 520 C PTH 1 53.19 87.67 54.08 0.00 0.00
521
+ ATOM 521 C PTH 1 53.19 87.67 55.08 0.00 0.00
522
+ ATOM 522 C PTH 1 53.19 88.67 49.08 0.00 0.00
523
+ ATOM 523 C PTH 1 53.19 88.67 50.08 0.00 0.00
524
+ ATOM 524 C PTH 1 53.19 88.67 51.08 0.00 0.00
525
+ ATOM 525 C PTH 1 53.19 88.67 52.08 0.00 0.00
526
+ ATOM 526 C PTH 1 53.19 88.67 53.08 0.00 0.00
527
+ ATOM 527 C PTH 1 53.19 88.67 54.08 0.00 0.00
528
+ ATOM 528 C PTH 1 53.19 88.67 55.08 0.00 0.00
529
+ ATOM 529 C PTH 1 53.19 88.67 56.08 0.00 0.00
530
+ ATOM 530 C PTH 1 53.19 89.67 49.08 0.00 0.00
531
+ ATOM 531 C PTH 1 53.19 89.67 50.08 0.00 0.00
532
+ ATOM 532 C PTH 1 53.19 89.67 51.08 0.00 0.00
533
+ ATOM 533 C PTH 1 53.19 89.67 52.08 0.00 0.00
534
+ ATOM 534 C PTH 1 53.19 89.67 53.08 0.00 0.00
535
+ ATOM 535 C PTH 1 53.19 89.67 54.08 0.00 0.00
536
+ ATOM 536 C PTH 1 53.19 89.67 55.08 0.00 0.00
537
+ ATOM 537 C PTH 1 53.19 89.67 56.08 0.00 0.00
538
+ ATOM 538 C PTH 1 53.19 89.67 57.08 0.00 0.00
539
+ ATOM 539 C PTH 1 53.19 90.67 49.08 0.00 0.00
540
+ ATOM 540 C PTH 1 53.19 90.67 50.08 0.00 0.00
541
+ ATOM 541 C PTH 1 53.19 90.67 51.08 0.00 0.00
542
+ ATOM 542 C PTH 1 53.19 90.67 52.08 0.00 0.00
543
+ ATOM 543 C PTH 1 53.19 90.67 53.08 0.00 0.00
544
+ ATOM 544 C PTH 1 53.19 90.67 54.08 0.00 0.00
545
+ ATOM 545 C PTH 1 53.19 90.67 55.08 0.00 0.00
546
+ ATOM 546 C PTH 1 53.19 90.67 56.08 0.00 0.00
547
+ ATOM 547 C PTH 1 53.19 90.67 57.08 0.00 0.00
548
+ ATOM 548 C PTH 1 53.19 90.67 58.08 0.00 0.00
549
+ ATOM 549 C PTH 1 53.19 90.67 59.08 0.00 0.00
550
+ ATOM 550 C PTH 1 53.19 90.67 60.08 0.00 0.00
551
+ ATOM 551 C PTH 1 53.19 91.67 49.08 0.00 0.00
552
+ ATOM 552 C PTH 1 53.19 91.67 50.08 0.00 0.00
553
+ ATOM 553 C PTH 1 53.19 91.67 51.08 0.00 0.00
554
+ ATOM 554 C PTH 1 53.19 91.67 52.08 0.00 0.00
555
+ ATOM 555 C PTH 1 53.19 91.67 53.08 0.00 0.00
556
+ ATOM 556 C PTH 1 53.19 91.67 54.08 0.00 0.00
557
+ ATOM 557 C PTH 1 53.19 91.67 55.08 0.00 0.00
558
+ ATOM 558 C PTH 1 53.19 91.67 56.08 0.00 0.00
559
+ ATOM 559 C PTH 1 53.19 91.67 57.08 0.00 0.00
560
+ ATOM 560 C PTH 1 53.19 91.67 58.08 0.00 0.00
561
+ ATOM 561 C PTH 1 53.19 91.67 59.08 0.00 0.00
562
+ ATOM 562 C PTH 1 53.19 91.67 60.08 0.00 0.00
563
+ ATOM 563 C PTH 1 53.19 91.67 61.08 0.00 0.00
564
+ ATOM 564 C PTH 1 53.19 92.67 53.08 0.00 0.00
565
+ ATOM 565 C PTH 1 53.19 92.67 54.08 0.00 0.00
566
+ ATOM 566 C PTH 1 53.19 92.67 55.08 0.00 0.00
567
+ ATOM 567 C PTH 1 53.19 92.67 56.08 0.00 0.00
568
+ ATOM 568 C PTH 1 53.19 92.67 57.08 0.00 0.00
569
+ ATOM 569 C PTH 1 53.19 92.67 58.08 0.00 0.00
570
+ ATOM 570 C PTH 1 53.19 92.67 59.08 0.00 0.00
571
+ ATOM 571 C PTH 1 53.19 92.67 60.08 0.00 0.00
572
+ ATOM 572 C PTH 1 53.19 92.67 61.08 0.00 0.00
573
+ ATOM 573 C PTH 1 53.19 93.67 55.08 0.00 0.00
574
+ ATOM 574 C PTH 1 53.19 93.67 56.08 0.00 0.00
575
+ ATOM 575 C PTH 1 53.19 93.67 57.08 0.00 0.00
576
+ ATOM 576 C PTH 1 53.19 93.67 58.08 0.00 0.00
577
+ ATOM 577 C PTH 1 53.19 93.67 59.08 0.00 0.00
578
+ ATOM 578 C PTH 1 53.19 93.67 60.08 0.00 0.00
579
+ ATOM 579 C PTH 1 53.19 93.67 61.08 0.00 0.00
580
+ ATOM 580 C PTH 1 53.19 94.67 56.08 0.00 0.00
581
+ ATOM 581 C PTH 1 53.19 94.67 57.08 0.00 0.00
582
+ ATOM 582 C PTH 1 53.19 94.67 58.08 0.00 0.00
583
+ ATOM 583 C PTH 1 53.19 94.67 59.08 0.00 0.00
584
+ ATOM 584 C PTH 1 53.19 94.67 60.08 0.00 0.00
585
+ ATOM 585 C PTH 1 53.19 95.67 57.08 0.00 0.00
586
+ ATOM 586 C PTH 1 53.19 95.67 58.08 0.00 0.00
587
+ ATOM 587 C PTH 1 54.19 86.67 54.08 0.00 0.00
588
+ ATOM 588 C PTH 1 54.19 86.67 55.08 0.00 0.00
589
+ ATOM 589 C PTH 1 54.19 87.67 50.08 0.00 0.00
590
+ ATOM 590 C PTH 1 54.19 87.67 51.08 0.00 0.00
591
+ ATOM 591 C PTH 1 54.19 87.67 52.08 0.00 0.00
592
+ ATOM 592 C PTH 1 54.19 87.67 54.08 0.00 0.00
593
+ ATOM 593 C PTH 1 54.19 88.67 49.08 0.00 0.00
594
+ ATOM 594 C PTH 1 54.19 88.67 50.08 0.00 0.00
595
+ ATOM 595 C PTH 1 54.19 88.67 51.08 0.00 0.00
596
+ ATOM 596 C PTH 1 54.19 88.67 52.08 0.00 0.00
597
+ ATOM 597 C PTH 1 54.19 88.67 54.08 0.00 0.00
598
+ ATOM 598 C PTH 1 54.19 88.67 55.08 0.00 0.00
599
+ ATOM 599 C PTH 1 54.19 88.67 56.08 0.00 0.00
600
+ ATOM 600 C PTH 1 54.19 88.67 59.08 0.00 0.00
601
+ ATOM 601 C PTH 1 54.19 88.67 60.08 0.00 0.00
602
+ ATOM 602 C PTH 1 54.19 89.67 49.08 0.00 0.00
603
+ ATOM 603 C PTH 1 54.19 89.67 50.08 0.00 0.00
604
+ ATOM 604 C PTH 1 54.19 89.67 51.08 0.00 0.00
605
+ ATOM 605 C PTH 1 54.19 89.67 52.08 0.00 0.00
606
+ ATOM 606 C PTH 1 54.19 89.67 53.08 0.00 0.00
607
+ ATOM 607 C PTH 1 54.19 89.67 54.08 0.00 0.00
608
+ ATOM 608 C PTH 1 54.19 89.67 55.08 0.00 0.00
609
+ ATOM 609 C PTH 1 54.19 89.67 56.08 0.00 0.00
610
+ ATOM 610 C PTH 1 54.19 89.67 57.08 0.00 0.00
611
+ ATOM 611 C PTH 1 54.19 89.67 58.08 0.00 0.00
612
+ ATOM 612 C PTH 1 54.19 89.67 59.08 0.00 0.00
613
+ ATOM 613 C PTH 1 54.19 89.67 60.08 0.00 0.00
614
+ ATOM 614 C PTH 1 54.19 89.67 61.08 0.00 0.00
615
+ ATOM 615 C PTH 1 54.19 90.67 49.08 0.00 0.00
616
+ ATOM 616 C PTH 1 54.19 90.67 50.08 0.00 0.00
617
+ ATOM 617 C PTH 1 54.19 90.67 51.08 0.00 0.00
618
+ ATOM 618 C PTH 1 54.19 90.67 52.08 0.00 0.00
619
+ ATOM 619 C PTH 1 54.19 90.67 55.08 0.00 0.00
620
+ ATOM 620 C PTH 1 54.19 90.67 56.08 0.00 0.00
621
+ ATOM 621 C PTH 1 54.19 90.67 57.08 0.00 0.00
622
+ ATOM 622 C PTH 1 54.19 90.67 58.08 0.00 0.00
623
+ ATOM 623 C PTH 1 54.19 90.67 59.08 0.00 0.00
624
+ ATOM 624 C PTH 1 54.19 90.67 60.08 0.00 0.00
625
+ ATOM 625 C PTH 1 54.19 90.67 61.08 0.00 0.00
626
+ ATOM 626 C PTH 1 54.19 90.67 62.08 0.00 0.00
627
+ ATOM 627 C PTH 1 54.19 91.67 55.08 0.00 0.00
628
+ ATOM 628 C PTH 1 54.19 91.67 56.08 0.00 0.00
629
+ ATOM 629 C PTH 1 54.19 91.67 57.08 0.00 0.00
630
+ ATOM 630 C PTH 1 54.19 91.67 58.08 0.00 0.00
631
+ ATOM 631 C PTH 1 54.19 91.67 59.08 0.00 0.00
632
+ ATOM 632 C PTH 1 54.19 91.67 60.08 0.00 0.00
633
+ ATOM 633 C PTH 1 54.19 91.67 61.08 0.00 0.00
634
+ ATOM 634 C PTH 1 54.19 91.67 62.08 0.00 0.00
635
+ ATOM 635 C PTH 1 54.19 92.67 56.08 0.00 0.00
636
+ ATOM 636 C PTH 1 54.19 92.67 57.08 0.00 0.00
637
+ ATOM 637 C PTH 1 54.19 92.67 58.08 0.00 0.00
638
+ ATOM 638 C PTH 1 54.19 92.67 59.08 0.00 0.00
639
+ ATOM 639 C PTH 1 54.19 92.67 60.08 0.00 0.00
640
+ ATOM 640 C PTH 1 54.19 92.67 61.08 0.00 0.00
641
+ ATOM 641 C PTH 1 54.19 92.67 62.08 0.00 0.00
642
+ ATOM 642 C PTH 1 54.19 93.67 56.08 0.00 0.00
643
+ ATOM 643 C PTH 1 54.19 93.67 57.08 0.00 0.00
644
+ ATOM 644 C PTH 1 54.19 93.67 58.08 0.00 0.00
645
+ ATOM 645 C PTH 1 54.19 93.67 59.08 0.00 0.00
646
+ ATOM 646 C PTH 1 54.19 93.67 60.08 0.00 0.00
647
+ ATOM 647 C PTH 1 54.19 93.67 61.08 0.00 0.00
648
+ ATOM 648 C PTH 1 54.19 93.67 62.08 0.00 0.00
649
+ ATOM 649 C PTH 1 54.19 94.67 56.08 0.00 0.00
650
+ ATOM 650 C PTH 1 54.19 94.67 57.08 0.00 0.00
651
+ ATOM 651 C PTH 1 54.19 94.67 58.08 0.00 0.00
652
+ ATOM 652 C PTH 1 54.19 94.67 59.08 0.00 0.00
653
+ ATOM 653 C PTH 1 54.19 94.67 60.08 0.00 0.00
654
+ ATOM 654 C PTH 1 54.19 94.67 61.08 0.00 0.00
655
+ ATOM 655 C PTH 1 54.19 95.67 57.08 0.00 0.00
656
+ ATOM 656 C PTH 1 54.19 95.67 58.08 0.00 0.00
657
+ ATOM 657 C PTH 1 55.19 87.67 59.08 0.00 0.00
658
+ ATOM 658 C PTH 1 55.19 87.67 60.08 0.00 0.00
659
+ ATOM 659 C PTH 1 55.19 88.67 57.08 0.00 0.00
660
+ ATOM 660 C PTH 1 55.19 88.67 58.08 0.00 0.00
661
+ ATOM 661 C PTH 1 55.19 88.67 59.08 0.00 0.00
662
+ ATOM 662 C PTH 1 55.19 88.67 60.08 0.00 0.00
663
+ ATOM 663 C PTH 1 55.19 88.67 61.08 0.00 0.00
664
+ ATOM 664 C PTH 1 55.19 88.67 62.08 0.00 0.00
665
+ ATOM 665 C PTH 1 55.19 89.67 56.08 0.00 0.00
666
+ ATOM 666 C PTH 1 55.19 89.67 57.08 0.00 0.00
667
+ ATOM 667 C PTH 1 55.19 89.67 58.08 0.00 0.00
668
+ ATOM 668 C PTH 1 55.19 89.67 59.08 0.00 0.00
669
+ ATOM 669 C PTH 1 55.19 89.67 60.08 0.00 0.00
670
+ ATOM 670 C PTH 1 55.19 89.67 61.08 0.00 0.00
671
+ ATOM 671 C PTH 1 55.19 89.67 62.08 0.00 0.00
672
+ ATOM 672 C PTH 1 55.19 90.67 56.08 0.00 0.00
673
+ ATOM 673 C PTH 1 55.19 90.67 57.08 0.00 0.00
674
+ ATOM 674 C PTH 1 55.19 90.67 58.08 0.00 0.00
675
+ ATOM 675 C PTH 1 55.19 90.67 59.08 0.00 0.00
676
+ ATOM 676 C PTH 1 55.19 90.67 60.08 0.00 0.00
677
+ ATOM 677 C PTH 1 55.19 90.67 61.08 0.00 0.00
678
+ ATOM 678 C PTH 1 55.19 90.67 62.08 0.00 0.00
679
+ ATOM 679 C PTH 1 55.19 91.67 56.08 0.00 0.00
680
+ ATOM 680 C PTH 1 55.19 91.67 57.08 0.00 0.00
681
+ ATOM 681 C PTH 1 55.19 91.67 58.08 0.00 0.00
682
+ ATOM 682 C PTH 1 55.19 91.67 59.08 0.00 0.00
683
+ ATOM 683 C PTH 1 55.19 91.67 60.08 0.00 0.00
684
+ ATOM 684 C PTH 1 55.19 91.67 61.08 0.00 0.00
685
+ ATOM 685 C PTH 1 55.19 91.67 62.08 0.00 0.00
686
+ ATOM 686 C PTH 1 55.19 92.67 56.08 0.00 0.00
687
+ ATOM 687 C PTH 1 55.19 92.67 57.08 0.00 0.00
688
+ ATOM 688 C PTH 1 55.19 92.67 58.08 0.00 0.00
689
+ ATOM 689 C PTH 1 55.19 92.67 59.08 0.00 0.00
690
+ ATOM 690 C PTH 1 55.19 92.67 60.08 0.00 0.00
691
+ ATOM 691 C PTH 1 55.19 92.67 61.08 0.00 0.00
692
+ ATOM 692 C PTH 1 55.19 93.67 56.08 0.00 0.00
693
+ ATOM 693 C PTH 1 55.19 93.67 57.08 0.00 0.00
694
+ ATOM 694 C PTH 1 55.19 93.67 58.08 0.00 0.00
695
+ ATOM 695 C PTH 1 55.19 93.67 59.08 0.00 0.00
696
+ ATOM 696 C PTH 1 55.19 93.67 60.08 0.00 0.00
697
+ ATOM 697 C PTH 1 55.19 93.67 61.08 0.00 0.00
698
+ ATOM 698 C PTH 1 55.19 94.67 56.08 0.00 0.00
699
+ ATOM 699 C PTH 1 55.19 94.67 57.08 0.00 0.00
700
+ ATOM 700 C PTH 1 55.19 94.67 58.08 0.00 0.00
701
+ ATOM 701 C PTH 1 55.19 94.67 59.08 0.00 0.00
702
+ ATOM 702 C PTH 1 55.19 94.67 60.08 0.00 0.00
703
+ ATOM 703 C PTH 1 55.19 94.67 61.08 0.00 0.00
704
+ ATOM 704 C PTH 1 55.19 95.67 57.08 0.00 0.00
705
+ ATOM 705 C PTH 1 55.19 95.67 58.08 0.00 0.00
706
+ ATOM 706 C PTH 1 56.19 86.67 59.08 0.00 0.00
707
+ ATOM 707 C PTH 1 56.19 86.67 60.08 0.00 0.00
708
+ ATOM 708 C PTH 1 56.19 87.67 58.08 0.00 0.00
709
+ ATOM 709 C PTH 1 56.19 87.67 59.08 0.00 0.00
710
+ ATOM 710 C PTH 1 56.19 87.67 60.08 0.00 0.00
711
+ ATOM 711 C PTH 1 56.19 87.67 61.08 0.00 0.00
712
+ ATOM 712 C PTH 1 56.19 87.67 62.08 0.00 0.00
713
+ ATOM 713 C PTH 1 56.19 88.67 57.08 0.00 0.00
714
+ ATOM 714 C PTH 1 56.19 88.67 58.08 0.00 0.00
715
+ ATOM 715 C PTH 1 56.19 88.67 59.08 0.00 0.00
716
+ ATOM 716 C PTH 1 56.19 88.67 60.08 0.00 0.00
717
+ ATOM 717 C PTH 1 56.19 88.67 61.08 0.00 0.00
718
+ ATOM 718 C PTH 1 56.19 88.67 62.08 0.00 0.00
719
+ ATOM 719 C PTH 1 56.19 89.67 57.08 0.00 0.00
720
+ ATOM 720 C PTH 1 56.19 89.67 58.08 0.00 0.00
721
+ ATOM 721 C PTH 1 56.19 89.67 59.08 0.00 0.00
722
+ ATOM 722 C PTH 1 56.19 89.67 60.08 0.00 0.00
723
+ ATOM 723 C PTH 1 56.19 89.67 61.08 0.00 0.00
724
+ ATOM 724 C PTH 1 56.19 89.67 62.08 0.00 0.00
725
+ ATOM 725 C PTH 1 56.19 90.67 56.08 0.00 0.00
726
+ ATOM 726 C PTH 1 56.19 90.67 57.08 0.00 0.00
727
+ ATOM 727 C PTH 1 56.19 90.67 58.08 0.00 0.00
728
+ ATOM 728 C PTH 1 56.19 90.67 59.08 0.00 0.00
729
+ ATOM 729 C PTH 1 56.19 90.67 60.08 0.00 0.00
730
+ ATOM 730 C PTH 1 56.19 90.67 61.08 0.00 0.00
731
+ ATOM 731 C PTH 1 56.19 90.67 62.08 0.00 0.00
732
+ ATOM 732 C PTH 1 56.19 91.67 56.08 0.00 0.00
733
+ ATOM 733 C PTH 1 56.19 91.67 57.08 0.00 0.00
734
+ ATOM 734 C PTH 1 56.19 91.67 58.08 0.00 0.00
735
+ ATOM 735 C PTH 1 56.19 91.67 59.08 0.00 0.00
736
+ ATOM 736 C PTH 1 56.19 91.67 60.08 0.00 0.00
737
+ ATOM 737 C PTH 1 56.19 91.67 61.08 0.00 0.00
738
+ ATOM 738 C PTH 1 56.19 91.67 62.08 0.00 0.00
739
+ ATOM 739 C PTH 1 56.19 92.67 56.08 0.00 0.00
740
+ ATOM 740 C PTH 1 56.19 92.67 57.08 0.00 0.00
741
+ ATOM 741 C PTH 1 56.19 92.67 58.08 0.00 0.00
742
+ ATOM 742 C PTH 1 56.19 92.67 59.08 0.00 0.00
743
+ ATOM 743 C PTH 1 56.19 92.67 60.08 0.00 0.00
744
+ ATOM 744 C PTH 1 56.19 92.67 61.08 0.00 0.00
745
+ ATOM 745 C PTH 1 56.19 92.67 62.08 0.00 0.00
746
+ ATOM 746 C PTH 1 56.19 93.67 56.08 0.00 0.00
747
+ ATOM 747 C PTH 1 56.19 93.67 57.08 0.00 0.00
748
+ ATOM 748 C PTH 1 56.19 93.67 58.08 0.00 0.00
749
+ ATOM 749 C PTH 1 56.19 93.67 59.08 0.00 0.00
750
+ ATOM 750 C PTH 1 56.19 93.67 60.08 0.00 0.00
751
+ ATOM 751 C PTH 1 56.19 93.67 61.08 0.00 0.00
752
+ ATOM 752 C PTH 1 56.19 94.67 57.08 0.00 0.00
753
+ ATOM 753 C PTH 1 56.19 94.67 58.08 0.00 0.00
754
+ ATOM 754 C PTH 1 56.19 94.67 59.08 0.00 0.00
755
+ ATOM 755 C PTH 1 56.19 94.67 60.08 0.00 0.00
756
+ ATOM 756 C PTH 1 57.19 86.67 60.08 0.00 0.00
757
+ ATOM 757 C PTH 1 57.19 87.67 57.08 0.00 0.00
758
+ ATOM 758 C PTH 1 57.19 87.67 58.08 0.00 0.00
759
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760
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761
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762
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763
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764
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765
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766
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767
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768
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769
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770
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771
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772
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773
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774
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775
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776
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777
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778
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779
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780
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781
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782
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783
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784
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785
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786
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787
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788
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789
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790
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791
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792
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793
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794
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795
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796
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797
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798
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799
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800
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801
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802
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803
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804
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805
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806
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807
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808
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809
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810
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811
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812
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813
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814
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815
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816
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817
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818
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819
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820
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821
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822
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823
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824
+ ATOM 824 C PTH 1 58.19 91.67 61.08 0.00 0.00
825
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826
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827
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828
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829
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830
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831
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832
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833
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834
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835
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836
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837
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838
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839
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840
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841
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842
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843
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844
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845
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846
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847
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848
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849
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850
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851
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852
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853
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854
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855
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856
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857
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858
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859
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860
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861
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862
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863
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864
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865
+ ATOM 865 C PTH 1 60.19 88.67 58.08 0.00 0.00
866
+ ATOM 866 C PTH 1 60.19 88.67 59.08 0.00 0.00
867
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868
+ ATOM 868 C PTH 1 60.19 89.67 58.08 0.00 0.00
869
+ ATOM 869 C PTH 1 60.19 89.67 59.08 0.00 0.00
870
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871
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872
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873
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874
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875
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876
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877
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878
+ ATOM 878 C PTH 1 60.19 91.67 60.08 0.00 0.00
879
+ ATOM 879 C PTH 1 60.19 91.67 61.08 0.00 0.00
880
+ ATOM 880 C PTH 1 60.19 92.67 59.08 0.00 0.00
881
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882
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883
+ ATOM 883 C PTH 1 60.19 93.67 59.08 0.00 0.00
884
+ ATOM 884 C PTH 1 60.19 93.67 60.08 0.00 0.00
data/files/A00BR/pocket_02.pdb ADDED
@@ -0,0 +1,745 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 3.19 106.67 29.08 0.00 0.00
2
+ ATOM 2 C PTH 1 4.19 104.67 30.08 0.00 0.00
3
+ ATOM 3 C PTH 1 4.19 104.67 31.08 0.00 0.00
4
+ ATOM 4 C PTH 1 4.19 104.67 32.08 0.00 0.00
5
+ ATOM 5 C PTH 1 4.19 104.67 33.08 0.00 0.00
6
+ ATOM 6 C PTH 1 4.19 104.67 34.08 0.00 0.00
7
+ ATOM 7 C PTH 1 4.19 105.67 29.08 0.00 0.00
8
+ ATOM 8 C PTH 1 4.19 105.67 30.08 0.00 0.00
9
+ ATOM 9 C PTH 1 4.19 105.67 31.08 0.00 0.00
10
+ ATOM 10 C PTH 1 4.19 105.67 32.08 0.00 0.00
11
+ ATOM 11 C PTH 1 4.19 105.67 33.08 0.00 0.00
12
+ ATOM 12 C PTH 1 4.19 105.67 34.08 0.00 0.00
13
+ ATOM 13 C PTH 1 4.19 106.67 29.08 0.00 0.00
14
+ ATOM 14 C PTH 1 4.19 106.67 30.08 0.00 0.00
15
+ ATOM 15 C PTH 1 4.19 106.67 31.08 0.00 0.00
16
+ ATOM 16 C PTH 1 4.19 106.67 32.08 0.00 0.00
17
+ ATOM 17 C PTH 1 4.19 106.67 33.08 0.00 0.00
18
+ ATOM 18 C PTH 1 4.19 106.67 34.08 0.00 0.00
19
+ ATOM 19 C PTH 1 4.19 107.67 32.08 0.00 0.00
20
+ ATOM 20 C PTH 1 4.19 107.67 33.08 0.00 0.00
21
+ ATOM 21 C PTH 1 4.19 107.67 34.08 0.00 0.00
22
+ ATOM 22 C PTH 1 5.19 104.67 29.08 0.00 0.00
23
+ ATOM 23 C PTH 1 5.19 104.67 30.08 0.00 0.00
24
+ ATOM 24 C PTH 1 5.19 104.67 31.08 0.00 0.00
25
+ ATOM 25 C PTH 1 5.19 104.67 32.08 0.00 0.00
26
+ ATOM 26 C PTH 1 5.19 104.67 33.08 0.00 0.00
27
+ ATOM 27 C PTH 1 5.19 104.67 34.08 0.00 0.00
28
+ ATOM 28 C PTH 1 5.19 105.67 29.08 0.00 0.00
29
+ ATOM 29 C PTH 1 5.19 105.67 30.08 0.00 0.00
30
+ ATOM 30 C PTH 1 5.19 105.67 31.08 0.00 0.00
31
+ ATOM 31 C PTH 1 5.19 105.67 32.08 0.00 0.00
32
+ ATOM 32 C PTH 1 5.19 105.67 33.08 0.00 0.00
33
+ ATOM 33 C PTH 1 5.19 105.67 34.08 0.00 0.00
34
+ ATOM 34 C PTH 1 5.19 105.67 35.08 0.00 0.00
35
+ ATOM 35 C PTH 1 5.19 106.67 30.08 0.00 0.00
36
+ ATOM 36 C PTH 1 5.19 106.67 31.08 0.00 0.00
37
+ ATOM 37 C PTH 1 5.19 106.67 32.08 0.00 0.00
38
+ ATOM 38 C PTH 1 5.19 106.67 33.08 0.00 0.00
39
+ ATOM 39 C PTH 1 5.19 106.67 34.08 0.00 0.00
40
+ ATOM 40 C PTH 1 5.19 106.67 35.08 0.00 0.00
41
+ ATOM 41 C PTH 1 5.19 106.67 36.08 0.00 0.00
42
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43
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44
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45
+ ATOM 45 C PTH 1 5.19 107.67 34.08 0.00 0.00
46
+ ATOM 46 C PTH 1 5.19 107.67 35.08 0.00 0.00
47
+ ATOM 47 C PTH 1 5.19 107.67 36.08 0.00 0.00
48
+ ATOM 48 C PTH 1 5.19 108.67 32.08 0.00 0.00
49
+ ATOM 49 C PTH 1 5.19 108.67 33.08 0.00 0.00
50
+ ATOM 50 C PTH 1 5.19 108.67 34.08 0.00 0.00
51
+ ATOM 51 C PTH 1 5.19 108.67 35.08 0.00 0.00
52
+ ATOM 52 C PTH 1 6.19 103.67 31.08 0.00 0.00
53
+ ATOM 53 C PTH 1 6.19 103.67 32.08 0.00 0.00
54
+ ATOM 54 C PTH 1 6.19 104.67 30.08 0.00 0.00
55
+ ATOM 55 C PTH 1 6.19 104.67 31.08 0.00 0.00
56
+ ATOM 56 C PTH 1 6.19 104.67 32.08 0.00 0.00
57
+ ATOM 57 C PTH 1 6.19 104.67 33.08 0.00 0.00
58
+ ATOM 58 C PTH 1 6.19 104.67 34.08 0.00 0.00
59
+ ATOM 59 C PTH 1 6.19 104.67 35.08 0.00 0.00
60
+ ATOM 60 C PTH 1 6.19 105.67 30.08 0.00 0.00
61
+ ATOM 61 C PTH 1 6.19 105.67 31.08 0.00 0.00
62
+ ATOM 62 C PTH 1 6.19 105.67 32.08 0.00 0.00
63
+ ATOM 63 C PTH 1 6.19 105.67 33.08 0.00 0.00
64
+ ATOM 64 C PTH 1 6.19 105.67 34.08 0.00 0.00
65
+ ATOM 65 C PTH 1 6.19 105.67 35.08 0.00 0.00
66
+ ATOM 66 C PTH 1 6.19 105.67 36.08 0.00 0.00
67
+ ATOM 67 C PTH 1 6.19 106.67 30.08 0.00 0.00
68
+ ATOM 68 C PTH 1 6.19 106.67 31.08 0.00 0.00
69
+ ATOM 69 C PTH 1 6.19 106.67 32.08 0.00 0.00
70
+ ATOM 70 C PTH 1 6.19 106.67 33.08 0.00 0.00
71
+ ATOM 71 C PTH 1 6.19 106.67 34.08 0.00 0.00
72
+ ATOM 72 C PTH 1 6.19 106.67 35.08 0.00 0.00
73
+ ATOM 73 C PTH 1 6.19 106.67 36.08 0.00 0.00
74
+ ATOM 74 C PTH 1 6.19 107.67 31.08 0.00 0.00
75
+ ATOM 75 C PTH 1 6.19 107.67 32.08 0.00 0.00
76
+ ATOM 76 C PTH 1 6.19 107.67 33.08 0.00 0.00
77
+ ATOM 77 C PTH 1 6.19 107.67 34.08 0.00 0.00
78
+ ATOM 78 C PTH 1 6.19 107.67 35.08 0.00 0.00
79
+ ATOM 79 C PTH 1 6.19 107.67 36.08 0.00 0.00
80
+ ATOM 80 C PTH 1 6.19 108.67 32.08 0.00 0.00
81
+ ATOM 81 C PTH 1 6.19 108.67 33.08 0.00 0.00
82
+ ATOM 82 C PTH 1 6.19 108.67 34.08 0.00 0.00
83
+ ATOM 83 C PTH 1 6.19 108.67 35.08 0.00 0.00
84
+ ATOM 84 C PTH 1 6.19 108.67 36.08 0.00 0.00
85
+ ATOM 85 C PTH 1 6.19 109.67 33.08 0.00 0.00
86
+ ATOM 86 C PTH 1 6.19 109.67 34.08 0.00 0.00
87
+ ATOM 87 C PTH 1 6.19 109.67 35.08 0.00 0.00
88
+ ATOM 88 C PTH 1 6.19 109.67 36.08 0.00 0.00
89
+ ATOM 89 C PTH 1 7.19 103.67 31.08 0.00 0.00
90
+ ATOM 90 C PTH 1 7.19 103.67 32.08 0.00 0.00
91
+ ATOM 91 C PTH 1 7.19 103.67 33.08 0.00 0.00
92
+ ATOM 92 C PTH 1 7.19 104.67 30.08 0.00 0.00
93
+ ATOM 93 C PTH 1 7.19 104.67 31.08 0.00 0.00
94
+ ATOM 94 C PTH 1 7.19 104.67 32.08 0.00 0.00
95
+ ATOM 95 C PTH 1 7.19 104.67 33.08 0.00 0.00
96
+ ATOM 96 C PTH 1 7.19 104.67 34.08 0.00 0.00
97
+ ATOM 97 C PTH 1 7.19 104.67 35.08 0.00 0.00
98
+ ATOM 98 C PTH 1 7.19 104.67 36.08 0.00 0.00
99
+ ATOM 99 C PTH 1 7.19 105.67 30.08 0.00 0.00
100
+ ATOM 100 C PTH 1 7.19 105.67 31.08 0.00 0.00
101
+ ATOM 101 C PTH 1 7.19 105.67 32.08 0.00 0.00
102
+ ATOM 102 C PTH 1 7.19 105.67 33.08 0.00 0.00
103
+ ATOM 103 C PTH 1 7.19 105.67 34.08 0.00 0.00
104
+ ATOM 104 C PTH 1 7.19 105.67 35.08 0.00 0.00
105
+ ATOM 105 C PTH 1 7.19 105.67 36.08 0.00 0.00
106
+ ATOM 106 C PTH 1 7.19 106.67 30.08 0.00 0.00
107
+ ATOM 107 C PTH 1 7.19 106.67 31.08 0.00 0.00
108
+ ATOM 108 C PTH 1 7.19 106.67 32.08 0.00 0.00
109
+ ATOM 109 C PTH 1 7.19 106.67 33.08 0.00 0.00
110
+ ATOM 110 C PTH 1 7.19 106.67 34.08 0.00 0.00
111
+ ATOM 111 C PTH 1 7.19 106.67 35.08 0.00 0.00
112
+ ATOM 112 C PTH 1 7.19 106.67 36.08 0.00 0.00
113
+ ATOM 113 C PTH 1 7.19 106.67 37.08 0.00 0.00
114
+ ATOM 114 C PTH 1 7.19 107.67 31.08 0.00 0.00
115
+ ATOM 115 C PTH 1 7.19 107.67 32.08 0.00 0.00
116
+ ATOM 116 C PTH 1 7.19 107.67 33.08 0.00 0.00
117
+ ATOM 117 C PTH 1 7.19 107.67 34.08 0.00 0.00
118
+ ATOM 118 C PTH 1 7.19 107.67 35.08 0.00 0.00
119
+ ATOM 119 C PTH 1 7.19 107.67 36.08 0.00 0.00
120
+ ATOM 120 C PTH 1 7.19 108.67 32.08 0.00 0.00
121
+ ATOM 121 C PTH 1 7.19 108.67 33.08 0.00 0.00
122
+ ATOM 122 C PTH 1 7.19 108.67 34.08 0.00 0.00
123
+ ATOM 123 C PTH 1 7.19 108.67 35.08 0.00 0.00
124
+ ATOM 124 C PTH 1 7.19 108.67 36.08 0.00 0.00
125
+ ATOM 125 C PTH 1 7.19 109.67 33.08 0.00 0.00
126
+ ATOM 126 C PTH 1 7.19 109.67 34.08 0.00 0.00
127
+ ATOM 127 C PTH 1 7.19 109.67 35.08 0.00 0.00
128
+ ATOM 128 C PTH 1 7.19 109.67 36.08 0.00 0.00
129
+ ATOM 129 C PTH 1 8.19 101.67 33.08 0.00 0.00
130
+ ATOM 130 C PTH 1 8.19 101.67 34.08 0.00 0.00
131
+ ATOM 131 C PTH 1 8.19 101.67 35.08 0.00 0.00
132
+ ATOM 132 C PTH 1 8.19 102.67 32.08 0.00 0.00
133
+ ATOM 133 C PTH 1 8.19 102.67 33.08 0.00 0.00
134
+ ATOM 134 C PTH 1 8.19 102.67 34.08 0.00 0.00
135
+ ATOM 135 C PTH 1 8.19 102.67 35.08 0.00 0.00
136
+ ATOM 136 C PTH 1 8.19 102.67 36.08 0.00 0.00
137
+ ATOM 137 C PTH 1 8.19 103.67 31.08 0.00 0.00
138
+ ATOM 138 C PTH 1 8.19 103.67 32.08 0.00 0.00
139
+ ATOM 139 C PTH 1 8.19 103.67 33.08 0.00 0.00
140
+ ATOM 140 C PTH 1 8.19 103.67 34.08 0.00 0.00
141
+ ATOM 141 C PTH 1 8.19 103.67 35.08 0.00 0.00
142
+ ATOM 142 C PTH 1 8.19 103.67 36.08 0.00 0.00
143
+ ATOM 143 C PTH 1 8.19 103.67 37.08 0.00 0.00
144
+ ATOM 144 C PTH 1 8.19 104.67 31.08 0.00 0.00
145
+ ATOM 145 C PTH 1 8.19 104.67 32.08 0.00 0.00
146
+ ATOM 146 C PTH 1 8.19 104.67 33.08 0.00 0.00
147
+ ATOM 147 C PTH 1 8.19 104.67 34.08 0.00 0.00
148
+ ATOM 148 C PTH 1 8.19 104.67 35.08 0.00 0.00
149
+ ATOM 149 C PTH 1 8.19 104.67 36.08 0.00 0.00
150
+ ATOM 150 C PTH 1 8.19 104.67 37.08 0.00 0.00
151
+ ATOM 151 C PTH 1 8.19 105.67 30.08 0.00 0.00
152
+ ATOM 152 C PTH 1 8.19 105.67 31.08 0.00 0.00
153
+ ATOM 153 C PTH 1 8.19 105.67 32.08 0.00 0.00
154
+ ATOM 154 C PTH 1 8.19 105.67 33.08 0.00 0.00
155
+ ATOM 155 C PTH 1 8.19 105.67 34.08 0.00 0.00
156
+ ATOM 156 C PTH 1 8.19 105.67 35.08 0.00 0.00
157
+ ATOM 157 C PTH 1 8.19 105.67 36.08 0.00 0.00
158
+ ATOM 158 C PTH 1 8.19 105.67 37.08 0.00 0.00
159
+ ATOM 159 C PTH 1 8.19 106.67 31.08 0.00 0.00
160
+ ATOM 160 C PTH 1 8.19 106.67 32.08 0.00 0.00
161
+ ATOM 161 C PTH 1 8.19 106.67 33.08 0.00 0.00
162
+ ATOM 162 C PTH 1 8.19 106.67 34.08 0.00 0.00
163
+ ATOM 163 C PTH 1 8.19 106.67 35.08 0.00 0.00
164
+ ATOM 164 C PTH 1 8.19 106.67 36.08 0.00 0.00
165
+ ATOM 165 C PTH 1 8.19 106.67 37.08 0.00 0.00
166
+ ATOM 166 C PTH 1 8.19 107.67 31.08 0.00 0.00
167
+ ATOM 167 C PTH 1 8.19 107.67 32.08 0.00 0.00
168
+ ATOM 168 C PTH 1 8.19 107.67 33.08 0.00 0.00
169
+ ATOM 169 C PTH 1 8.19 107.67 34.08 0.00 0.00
170
+ ATOM 170 C PTH 1 8.19 107.67 35.08 0.00 0.00
171
+ ATOM 171 C PTH 1 8.19 107.67 36.08 0.00 0.00
172
+ ATOM 172 C PTH 1 8.19 107.67 37.08 0.00 0.00
173
+ ATOM 173 C PTH 1 8.19 108.67 32.08 0.00 0.00
174
+ ATOM 174 C PTH 1 8.19 108.67 33.08 0.00 0.00
175
+ ATOM 175 C PTH 1 8.19 108.67 34.08 0.00 0.00
176
+ ATOM 176 C PTH 1 8.19 108.67 35.08 0.00 0.00
177
+ ATOM 177 C PTH 1 8.19 108.67 36.08 0.00 0.00
178
+ ATOM 178 C PTH 1 8.19 109.67 33.08 0.00 0.00
179
+ ATOM 179 C PTH 1 8.19 109.67 34.08 0.00 0.00
180
+ ATOM 180 C PTH 1 8.19 109.67 35.08 0.00 0.00
181
+ ATOM 181 C PTH 1 8.19 109.67 36.08 0.00 0.00
182
+ ATOM 182 C PTH 1 9.19 100.67 33.08 0.00 0.00
183
+ ATOM 183 C PTH 1 9.19 100.67 34.08 0.00 0.00
184
+ ATOM 184 C PTH 1 9.19 100.67 35.08 0.00 0.00
185
+ ATOM 185 C PTH 1 9.19 100.67 36.08 0.00 0.00
186
+ ATOM 186 C PTH 1 9.19 101.67 32.08 0.00 0.00
187
+ ATOM 187 C PTH 1 9.19 101.67 33.08 0.00 0.00
188
+ ATOM 188 C PTH 1 9.19 101.67 34.08 0.00 0.00
189
+ ATOM 189 C PTH 1 9.19 101.67 35.08 0.00 0.00
190
+ ATOM 190 C PTH 1 9.19 101.67 36.08 0.00 0.00
191
+ ATOM 191 C PTH 1 9.19 101.67 37.08 0.00 0.00
192
+ ATOM 192 C PTH 1 9.19 102.67 31.08 0.00 0.00
193
+ ATOM 193 C PTH 1 9.19 102.67 32.08 0.00 0.00
194
+ ATOM 194 C PTH 1 9.19 102.67 33.08 0.00 0.00
195
+ ATOM 195 C PTH 1 9.19 102.67 34.08 0.00 0.00
196
+ ATOM 196 C PTH 1 9.19 102.67 35.08 0.00 0.00
197
+ ATOM 197 C PTH 1 9.19 102.67 36.08 0.00 0.00
198
+ ATOM 198 C PTH 1 9.19 102.67 37.08 0.00 0.00
199
+ ATOM 199 C PTH 1 9.19 103.67 31.08 0.00 0.00
200
+ ATOM 200 C PTH 1 9.19 103.67 32.08 0.00 0.00
201
+ ATOM 201 C PTH 1 9.19 103.67 33.08 0.00 0.00
202
+ ATOM 202 C PTH 1 9.19 103.67 34.08 0.00 0.00
203
+ ATOM 203 C PTH 1 9.19 103.67 35.08 0.00 0.00
204
+ ATOM 204 C PTH 1 9.19 103.67 36.08 0.00 0.00
205
+ ATOM 205 C PTH 1 9.19 103.67 37.08 0.00 0.00
206
+ ATOM 206 C PTH 1 9.19 104.67 31.08 0.00 0.00
207
+ ATOM 207 C PTH 1 9.19 104.67 32.08 0.00 0.00
208
+ ATOM 208 C PTH 1 9.19 104.67 33.08 0.00 0.00
209
+ ATOM 209 C PTH 1 9.19 104.67 34.08 0.00 0.00
210
+ ATOM 210 C PTH 1 9.19 104.67 35.08 0.00 0.00
211
+ ATOM 211 C PTH 1 9.19 104.67 36.08 0.00 0.00
212
+ ATOM 212 C PTH 1 9.19 104.67 37.08 0.00 0.00
213
+ ATOM 213 C PTH 1 9.19 105.67 30.08 0.00 0.00
214
+ ATOM 214 C PTH 1 9.19 105.67 31.08 0.00 0.00
215
+ ATOM 215 C PTH 1 9.19 105.67 32.08 0.00 0.00
216
+ ATOM 216 C PTH 1 9.19 105.67 33.08 0.00 0.00
217
+ ATOM 217 C PTH 1 9.19 105.67 34.08 0.00 0.00
218
+ ATOM 218 C PTH 1 9.19 105.67 35.08 0.00 0.00
219
+ ATOM 219 C PTH 1 9.19 105.67 36.08 0.00 0.00
220
+ ATOM 220 C PTH 1 9.19 105.67 37.08 0.00 0.00
221
+ ATOM 221 C PTH 1 9.19 106.67 31.08 0.00 0.00
222
+ ATOM 222 C PTH 1 9.19 106.67 32.08 0.00 0.00
223
+ ATOM 223 C PTH 1 9.19 106.67 33.08 0.00 0.00
224
+ ATOM 224 C PTH 1 9.19 106.67 34.08 0.00 0.00
225
+ ATOM 225 C PTH 1 9.19 106.67 35.08 0.00 0.00
226
+ ATOM 226 C PTH 1 9.19 106.67 36.08 0.00 0.00
227
+ ATOM 227 C PTH 1 9.19 106.67 37.08 0.00 0.00
228
+ ATOM 228 C PTH 1 9.19 107.67 31.08 0.00 0.00
229
+ ATOM 229 C PTH 1 9.19 107.67 32.08 0.00 0.00
230
+ ATOM 230 C PTH 1 9.19 107.67 33.08 0.00 0.00
231
+ ATOM 231 C PTH 1 9.19 107.67 34.08 0.00 0.00
232
+ ATOM 232 C PTH 1 9.19 107.67 35.08 0.00 0.00
233
+ ATOM 233 C PTH 1 9.19 107.67 36.08 0.00 0.00
234
+ ATOM 234 C PTH 1 9.19 107.67 37.08 0.00 0.00
235
+ ATOM 235 C PTH 1 9.19 108.67 32.08 0.00 0.00
236
+ ATOM 236 C PTH 1 9.19 108.67 33.08 0.00 0.00
237
+ ATOM 237 C PTH 1 9.19 108.67 34.08 0.00 0.00
238
+ ATOM 238 C PTH 1 9.19 108.67 35.08 0.00 0.00
239
+ ATOM 239 C PTH 1 9.19 108.67 36.08 0.00 0.00
240
+ ATOM 240 C PTH 1 9.19 108.67 37.08 0.00 0.00
241
+ ATOM 241 C PTH 1 9.19 109.67 33.08 0.00 0.00
242
+ ATOM 242 C PTH 1 9.19 109.67 34.08 0.00 0.00
243
+ ATOM 243 C PTH 1 9.19 109.67 35.08 0.00 0.00
244
+ ATOM 244 C PTH 1 9.19 109.67 36.08 0.00 0.00
245
+ ATOM 245 C PTH 1 10.19 100.67 33.08 0.00 0.00
246
+ ATOM 246 C PTH 1 10.19 100.67 34.08 0.00 0.00
247
+ ATOM 247 C PTH 1 10.19 100.67 35.08 0.00 0.00
248
+ ATOM 248 C PTH 1 10.19 100.67 36.08 0.00 0.00
249
+ ATOM 249 C PTH 1 10.19 100.67 37.08 0.00 0.00
250
+ ATOM 250 C PTH 1 10.19 100.67 38.08 0.00 0.00
251
+ ATOM 251 C PTH 1 10.19 101.67 32.08 0.00 0.00
252
+ ATOM 252 C PTH 1 10.19 101.67 33.08 0.00 0.00
253
+ ATOM 253 C PTH 1 10.19 101.67 34.08 0.00 0.00
254
+ ATOM 254 C PTH 1 10.19 101.67 35.08 0.00 0.00
255
+ ATOM 255 C PTH 1 10.19 101.67 36.08 0.00 0.00
256
+ ATOM 256 C PTH 1 10.19 101.67 37.08 0.00 0.00
257
+ ATOM 257 C PTH 1 10.19 101.67 38.08 0.00 0.00
258
+ ATOM 258 C PTH 1 10.19 101.67 39.08 0.00 0.00
259
+ ATOM 259 C PTH 1 10.19 102.67 31.08 0.00 0.00
260
+ ATOM 260 C PTH 1 10.19 102.67 32.08 0.00 0.00
261
+ ATOM 261 C PTH 1 10.19 102.67 33.08 0.00 0.00
262
+ ATOM 262 C PTH 1 10.19 102.67 34.08 0.00 0.00
263
+ ATOM 263 C PTH 1 10.19 102.67 35.08 0.00 0.00
264
+ ATOM 264 C PTH 1 10.19 102.67 36.08 0.00 0.00
265
+ ATOM 265 C PTH 1 10.19 102.67 37.08 0.00 0.00
266
+ ATOM 266 C PTH 1 10.19 102.67 38.08 0.00 0.00
267
+ ATOM 267 C PTH 1 10.19 102.67 39.08 0.00 0.00
268
+ ATOM 268 C PTH 1 10.19 103.67 30.08 0.00 0.00
269
+ ATOM 269 C PTH 1 10.19 103.67 31.08 0.00 0.00
270
+ ATOM 270 C PTH 1 10.19 103.67 32.08 0.00 0.00
271
+ ATOM 271 C PTH 1 10.19 103.67 33.08 0.00 0.00
272
+ ATOM 272 C PTH 1 10.19 103.67 34.08 0.00 0.00
273
+ ATOM 273 C PTH 1 10.19 103.67 35.08 0.00 0.00
274
+ ATOM 274 C PTH 1 10.19 103.67 36.08 0.00 0.00
275
+ ATOM 275 C PTH 1 10.19 103.67 37.08 0.00 0.00
276
+ ATOM 276 C PTH 1 10.19 103.67 38.08 0.00 0.00
277
+ ATOM 277 C PTH 1 10.19 104.67 30.08 0.00 0.00
278
+ ATOM 278 C PTH 1 10.19 104.67 31.08 0.00 0.00
279
+ ATOM 279 C PTH 1 10.19 104.67 32.08 0.00 0.00
280
+ ATOM 280 C PTH 1 10.19 104.67 33.08 0.00 0.00
281
+ ATOM 281 C PTH 1 10.19 104.67 34.08 0.00 0.00
282
+ ATOM 282 C PTH 1 10.19 104.67 35.08 0.00 0.00
283
+ ATOM 283 C PTH 1 10.19 104.67 36.08 0.00 0.00
284
+ ATOM 284 C PTH 1 10.19 104.67 37.08 0.00 0.00
285
+ ATOM 285 C PTH 1 10.19 104.67 38.08 0.00 0.00
286
+ ATOM 286 C PTH 1 10.19 105.67 30.08 0.00 0.00
287
+ ATOM 287 C PTH 1 10.19 105.67 31.08 0.00 0.00
288
+ ATOM 288 C PTH 1 10.19 105.67 32.08 0.00 0.00
289
+ ATOM 289 C PTH 1 10.19 105.67 33.08 0.00 0.00
290
+ ATOM 290 C PTH 1 10.19 105.67 34.08 0.00 0.00
291
+ ATOM 291 C PTH 1 10.19 105.67 35.08 0.00 0.00
292
+ ATOM 292 C PTH 1 10.19 105.67 36.08 0.00 0.00
293
+ ATOM 293 C PTH 1 10.19 105.67 37.08 0.00 0.00
294
+ ATOM 294 C PTH 1 10.19 106.67 30.08 0.00 0.00
295
+ ATOM 295 C PTH 1 10.19 106.67 31.08 0.00 0.00
296
+ ATOM 296 C PTH 1 10.19 106.67 32.08 0.00 0.00
297
+ ATOM 297 C PTH 1 10.19 106.67 33.08 0.00 0.00
298
+ ATOM 298 C PTH 1 10.19 106.67 34.08 0.00 0.00
299
+ ATOM 299 C PTH 1 10.19 106.67 35.08 0.00 0.00
300
+ ATOM 300 C PTH 1 10.19 106.67 36.08 0.00 0.00
301
+ ATOM 301 C PTH 1 10.19 106.67 37.08 0.00 0.00
302
+ ATOM 302 C PTH 1 10.19 106.67 38.08 0.00 0.00
303
+ ATOM 303 C PTH 1 10.19 107.67 31.08 0.00 0.00
304
+ ATOM 304 C PTH 1 10.19 107.67 32.08 0.00 0.00
305
+ ATOM 305 C PTH 1 10.19 107.67 33.08 0.00 0.00
306
+ ATOM 306 C PTH 1 10.19 107.67 34.08 0.00 0.00
307
+ ATOM 307 C PTH 1 10.19 107.67 35.08 0.00 0.00
308
+ ATOM 308 C PTH 1 10.19 107.67 36.08 0.00 0.00
309
+ ATOM 309 C PTH 1 10.19 107.67 37.08 0.00 0.00
310
+ ATOM 310 C PTH 1 10.19 107.67 38.08 0.00 0.00
311
+ ATOM 311 C PTH 1 10.19 108.67 32.08 0.00 0.00
312
+ ATOM 312 C PTH 1 10.19 108.67 33.08 0.00 0.00
313
+ ATOM 313 C PTH 1 10.19 108.67 34.08 0.00 0.00
314
+ ATOM 314 C PTH 1 10.19 108.67 35.08 0.00 0.00
315
+ ATOM 315 C PTH 1 10.19 108.67 36.08 0.00 0.00
316
+ ATOM 316 C PTH 1 10.19 108.67 37.08 0.00 0.00
317
+ ATOM 317 C PTH 1 10.19 108.67 38.08 0.00 0.00
318
+ ATOM 318 C PTH 1 10.19 109.67 34.08 0.00 0.00
319
+ ATOM 319 C PTH 1 10.19 109.67 35.08 0.00 0.00
320
+ ATOM 320 C PTH 1 10.19 109.67 36.08 0.00 0.00
321
+ ATOM 321 C PTH 1 11.19 99.67 36.08 0.00 0.00
322
+ ATOM 322 C PTH 1 11.19 99.67 37.08 0.00 0.00
323
+ ATOM 323 C PTH 1 11.19 99.67 38.08 0.00 0.00
324
+ ATOM 324 C PTH 1 11.19 100.67 33.08 0.00 0.00
325
+ ATOM 325 C PTH 1 11.19 100.67 34.08 0.00 0.00
326
+ ATOM 326 C PTH 1 11.19 100.67 35.08 0.00 0.00
327
+ ATOM 327 C PTH 1 11.19 100.67 36.08 0.00 0.00
328
+ ATOM 328 C PTH 1 11.19 100.67 37.08 0.00 0.00
329
+ ATOM 329 C PTH 1 11.19 100.67 38.08 0.00 0.00
330
+ ATOM 330 C PTH 1 11.19 100.67 39.08 0.00 0.00
331
+ ATOM 331 C PTH 1 11.19 100.67 40.08 0.00 0.00
332
+ ATOM 332 C PTH 1 11.19 100.67 41.08 0.00 0.00
333
+ ATOM 333 C PTH 1 11.19 101.67 33.08 0.00 0.00
334
+ ATOM 334 C PTH 1 11.19 101.67 34.08 0.00 0.00
335
+ ATOM 335 C PTH 1 11.19 101.67 35.08 0.00 0.00
336
+ ATOM 336 C PTH 1 11.19 101.67 36.08 0.00 0.00
337
+ ATOM 337 C PTH 1 11.19 101.67 37.08 0.00 0.00
338
+ ATOM 338 C PTH 1 11.19 101.67 38.08 0.00 0.00
339
+ ATOM 339 C PTH 1 11.19 101.67 39.08 0.00 0.00
340
+ ATOM 340 C PTH 1 11.19 101.67 40.08 0.00 0.00
341
+ ATOM 341 C PTH 1 11.19 101.67 41.08 0.00 0.00
342
+ ATOM 342 C PTH 1 11.19 102.67 32.08 0.00 0.00
343
+ ATOM 343 C PTH 1 11.19 102.67 33.08 0.00 0.00
344
+ ATOM 344 C PTH 1 11.19 102.67 34.08 0.00 0.00
345
+ ATOM 345 C PTH 1 11.19 102.67 35.08 0.00 0.00
346
+ ATOM 346 C PTH 1 11.19 102.67 36.08 0.00 0.00
347
+ ATOM 347 C PTH 1 11.19 102.67 37.08 0.00 0.00
348
+ ATOM 348 C PTH 1 11.19 102.67 38.08 0.00 0.00
349
+ ATOM 349 C PTH 1 11.19 102.67 39.08 0.00 0.00
350
+ ATOM 350 C PTH 1 11.19 102.67 40.08 0.00 0.00
351
+ ATOM 351 C PTH 1 11.19 103.67 30.08 0.00 0.00
352
+ ATOM 352 C PTH 1 11.19 103.67 31.08 0.00 0.00
353
+ ATOM 353 C PTH 1 11.19 103.67 32.08 0.00 0.00
354
+ ATOM 354 C PTH 1 11.19 103.67 33.08 0.00 0.00
355
+ ATOM 355 C PTH 1 11.19 103.67 34.08 0.00 0.00
356
+ ATOM 356 C PTH 1 11.19 103.67 35.08 0.00 0.00
357
+ ATOM 357 C PTH 1 11.19 103.67 36.08 0.00 0.00
358
+ ATOM 358 C PTH 1 11.19 103.67 37.08 0.00 0.00
359
+ ATOM 359 C PTH 1 11.19 103.67 38.08 0.00 0.00
360
+ ATOM 360 C PTH 1 11.19 103.67 39.08 0.00 0.00
361
+ ATOM 361 C PTH 1 11.19 104.67 30.08 0.00 0.00
362
+ ATOM 362 C PTH 1 11.19 104.67 31.08 0.00 0.00
363
+ ATOM 363 C PTH 1 11.19 104.67 32.08 0.00 0.00
364
+ ATOM 364 C PTH 1 11.19 104.67 33.08 0.00 0.00
365
+ ATOM 365 C PTH 1 11.19 104.67 34.08 0.00 0.00
366
+ ATOM 366 C PTH 1 11.19 104.67 35.08 0.00 0.00
367
+ ATOM 367 C PTH 1 11.19 104.67 36.08 0.00 0.00
368
+ ATOM 368 C PTH 1 11.19 104.67 37.08 0.00 0.00
369
+ ATOM 369 C PTH 1 11.19 104.67 38.08 0.00 0.00
370
+ ATOM 370 C PTH 1 11.19 105.67 30.08 0.00 0.00
371
+ ATOM 371 C PTH 1 11.19 105.67 31.08 0.00 0.00
372
+ ATOM 372 C PTH 1 11.19 105.67 32.08 0.00 0.00
373
+ ATOM 373 C PTH 1 11.19 105.67 33.08 0.00 0.00
374
+ ATOM 374 C PTH 1 11.19 105.67 34.08 0.00 0.00
375
+ ATOM 375 C PTH 1 11.19 105.67 35.08 0.00 0.00
376
+ ATOM 376 C PTH 1 11.19 105.67 36.08 0.00 0.00
377
+ ATOM 377 C PTH 1 11.19 105.67 37.08 0.00 0.00
378
+ ATOM 378 C PTH 1 11.19 105.67 38.08 0.00 0.00
379
+ ATOM 379 C PTH 1 11.19 106.67 30.08 0.00 0.00
380
+ ATOM 380 C PTH 1 11.19 106.67 31.08 0.00 0.00
381
+ ATOM 381 C PTH 1 11.19 106.67 32.08 0.00 0.00
382
+ ATOM 382 C PTH 1 11.19 106.67 33.08 0.00 0.00
383
+ ATOM 383 C PTH 1 11.19 106.67 34.08 0.00 0.00
384
+ ATOM 384 C PTH 1 11.19 106.67 35.08 0.00 0.00
385
+ ATOM 385 C PTH 1 11.19 106.67 36.08 0.00 0.00
386
+ ATOM 386 C PTH 1 11.19 106.67 37.08 0.00 0.00
387
+ ATOM 387 C PTH 1 11.19 106.67 38.08 0.00 0.00
388
+ ATOM 388 C PTH 1 11.19 107.67 31.08 0.00 0.00
389
+ ATOM 389 C PTH 1 11.19 107.67 32.08 0.00 0.00
390
+ ATOM 390 C PTH 1 11.19 107.67 33.08 0.00 0.00
391
+ ATOM 391 C PTH 1 11.19 107.67 34.08 0.00 0.00
392
+ ATOM 392 C PTH 1 11.19 107.67 35.08 0.00 0.00
393
+ ATOM 393 C PTH 1 11.19 107.67 36.08 0.00 0.00
394
+ ATOM 394 C PTH 1 11.19 107.67 37.08 0.00 0.00
395
+ ATOM 395 C PTH 1 11.19 107.67 38.08 0.00 0.00
396
+ ATOM 396 C PTH 1 11.19 108.67 32.08 0.00 0.00
397
+ ATOM 397 C PTH 1 11.19 108.67 33.08 0.00 0.00
398
+ ATOM 398 C PTH 1 11.19 108.67 34.08 0.00 0.00
399
+ ATOM 399 C PTH 1 11.19 108.67 35.08 0.00 0.00
400
+ ATOM 400 C PTH 1 11.19 108.67 36.08 0.00 0.00
401
+ ATOM 401 C PTH 1 11.19 108.67 37.08 0.00 0.00
402
+ ATOM 402 C PTH 1 11.19 108.67 38.08 0.00 0.00
403
+ ATOM 403 C PTH 1 11.19 109.67 34.08 0.00 0.00
404
+ ATOM 404 C PTH 1 11.19 109.67 35.08 0.00 0.00
405
+ ATOM 405 C PTH 1 11.19 109.67 36.08 0.00 0.00
406
+ ATOM 406 C PTH 1 11.19 109.67 37.08 0.00 0.00
407
+ ATOM 407 C PTH 1 12.19 99.67 35.08 0.00 0.00
408
+ ATOM 408 C PTH 1 12.19 99.67 36.08 0.00 0.00
409
+ ATOM 409 C PTH 1 12.19 99.67 37.08 0.00 0.00
410
+ ATOM 410 C PTH 1 12.19 99.67 38.08 0.00 0.00
411
+ ATOM 411 C PTH 1 12.19 99.67 39.08 0.00 0.00
412
+ ATOM 412 C PTH 1 12.19 100.67 35.08 0.00 0.00
413
+ ATOM 413 C PTH 1 12.19 100.67 36.08 0.00 0.00
414
+ ATOM 414 C PTH 1 12.19 100.67 37.08 0.00 0.00
415
+ ATOM 415 C PTH 1 12.19 100.67 38.08 0.00 0.00
416
+ ATOM 416 C PTH 1 12.19 100.67 39.08 0.00 0.00
417
+ ATOM 417 C PTH 1 12.19 100.67 40.08 0.00 0.00
418
+ ATOM 418 C PTH 1 12.19 100.67 41.08 0.00 0.00
419
+ ATOM 419 C PTH 1 12.19 101.67 34.08 0.00 0.00
420
+ ATOM 420 C PTH 1 12.19 101.67 35.08 0.00 0.00
421
+ ATOM 421 C PTH 1 12.19 101.67 36.08 0.00 0.00
422
+ ATOM 422 C PTH 1 12.19 101.67 37.08 0.00 0.00
423
+ ATOM 423 C PTH 1 12.19 101.67 38.08 0.00 0.00
424
+ ATOM 424 C PTH 1 12.19 101.67 39.08 0.00 0.00
425
+ ATOM 425 C PTH 1 12.19 101.67 40.08 0.00 0.00
426
+ ATOM 426 C PTH 1 12.19 101.67 41.08 0.00 0.00
427
+ ATOM 427 C PTH 1 12.19 102.67 34.08 0.00 0.00
428
+ ATOM 428 C PTH 1 12.19 102.67 35.08 0.00 0.00
429
+ ATOM 429 C PTH 1 12.19 102.67 36.08 0.00 0.00
430
+ ATOM 430 C PTH 1 12.19 102.67 37.08 0.00 0.00
431
+ ATOM 431 C PTH 1 12.19 102.67 38.08 0.00 0.00
432
+ ATOM 432 C PTH 1 12.19 102.67 39.08 0.00 0.00
433
+ ATOM 433 C PTH 1 12.19 102.67 40.08 0.00 0.00
434
+ ATOM 434 C PTH 1 12.19 103.67 34.08 0.00 0.00
435
+ ATOM 435 C PTH 1 12.19 103.67 35.08 0.00 0.00
436
+ ATOM 436 C PTH 1 12.19 103.67 36.08 0.00 0.00
437
+ ATOM 437 C PTH 1 12.19 103.67 37.08 0.00 0.00
438
+ ATOM 438 C PTH 1 12.19 103.67 38.08 0.00 0.00
439
+ ATOM 439 C PTH 1 12.19 103.67 39.08 0.00 0.00
440
+ ATOM 440 C PTH 1 12.19 104.67 30.08 0.00 0.00
441
+ ATOM 441 C PTH 1 12.19 104.67 31.08 0.00 0.00
442
+ ATOM 442 C PTH 1 12.19 104.67 32.08 0.00 0.00
443
+ ATOM 443 C PTH 1 12.19 104.67 34.08 0.00 0.00
444
+ ATOM 444 C PTH 1 12.19 104.67 35.08 0.00 0.00
445
+ ATOM 445 C PTH 1 12.19 104.67 36.08 0.00 0.00
446
+ ATOM 446 C PTH 1 12.19 104.67 37.08 0.00 0.00
447
+ ATOM 447 C PTH 1 12.19 104.67 38.08 0.00 0.00
448
+ ATOM 448 C PTH 1 12.19 104.67 39.08 0.00 0.00
449
+ ATOM 449 C PTH 1 12.19 105.67 30.08 0.00 0.00
450
+ ATOM 450 C PTH 1 12.19 105.67 31.08 0.00 0.00
451
+ ATOM 451 C PTH 1 12.19 105.67 32.08 0.00 0.00
452
+ ATOM 452 C PTH 1 12.19 105.67 33.08 0.00 0.00
453
+ ATOM 453 C PTH 1 12.19 105.67 34.08 0.00 0.00
454
+ ATOM 454 C PTH 1 12.19 105.67 35.08 0.00 0.00
455
+ ATOM 455 C PTH 1 12.19 105.67 36.08 0.00 0.00
456
+ ATOM 456 C PTH 1 12.19 105.67 37.08 0.00 0.00
457
+ ATOM 457 C PTH 1 12.19 105.67 38.08 0.00 0.00
458
+ ATOM 458 C PTH 1 12.19 106.67 30.08 0.00 0.00
459
+ ATOM 459 C PTH 1 12.19 106.67 31.08 0.00 0.00
460
+ ATOM 460 C PTH 1 12.19 106.67 32.08 0.00 0.00
461
+ ATOM 461 C PTH 1 12.19 106.67 33.08 0.00 0.00
462
+ ATOM 462 C PTH 1 12.19 106.67 34.08 0.00 0.00
463
+ ATOM 463 C PTH 1 12.19 106.67 35.08 0.00 0.00
464
+ ATOM 464 C PTH 1 12.19 106.67 36.08 0.00 0.00
465
+ ATOM 465 C PTH 1 12.19 106.67 37.08 0.00 0.00
466
+ ATOM 466 C PTH 1 12.19 106.67 38.08 0.00 0.00
467
+ ATOM 467 C PTH 1 12.19 106.67 39.08 0.00 0.00
468
+ ATOM 468 C PTH 1 12.19 107.67 31.08 0.00 0.00
469
+ ATOM 469 C PTH 1 12.19 107.67 32.08 0.00 0.00
470
+ ATOM 470 C PTH 1 12.19 107.67 33.08 0.00 0.00
471
+ ATOM 471 C PTH 1 12.19 107.67 34.08 0.00 0.00
472
+ ATOM 472 C PTH 1 12.19 107.67 35.08 0.00 0.00
473
+ ATOM 473 C PTH 1 12.19 107.67 36.08 0.00 0.00
474
+ ATOM 474 C PTH 1 12.19 107.67 37.08 0.00 0.00
475
+ ATOM 475 C PTH 1 12.19 107.67 38.08 0.00 0.00
476
+ ATOM 476 C PTH 1 12.19 108.67 33.08 0.00 0.00
477
+ ATOM 477 C PTH 1 12.19 108.67 34.08 0.00 0.00
478
+ ATOM 478 C PTH 1 12.19 108.67 35.08 0.00 0.00
479
+ ATOM 479 C PTH 1 12.19 108.67 36.08 0.00 0.00
480
+ ATOM 480 C PTH 1 12.19 108.67 37.08 0.00 0.00
481
+ ATOM 481 C PTH 1 12.19 108.67 38.08 0.00 0.00
482
+ ATOM 482 C PTH 1 12.19 109.67 35.08 0.00 0.00
483
+ ATOM 483 C PTH 1 13.19 99.67 35.08 0.00 0.00
484
+ ATOM 484 C PTH 1 13.19 99.67 36.08 0.00 0.00
485
+ ATOM 485 C PTH 1 13.19 99.67 37.08 0.00 0.00
486
+ ATOM 486 C PTH 1 13.19 99.67 38.08 0.00 0.00
487
+ ATOM 487 C PTH 1 13.19 99.67 39.08 0.00 0.00
488
+ ATOM 488 C PTH 1 13.19 100.67 34.08 0.00 0.00
489
+ ATOM 489 C PTH 1 13.19 100.67 35.08 0.00 0.00
490
+ ATOM 490 C PTH 1 13.19 100.67 36.08 0.00 0.00
491
+ ATOM 491 C PTH 1 13.19 100.67 37.08 0.00 0.00
492
+ ATOM 492 C PTH 1 13.19 100.67 38.08 0.00 0.00
493
+ ATOM 493 C PTH 1 13.19 100.67 39.08 0.00 0.00
494
+ ATOM 494 C PTH 1 13.19 100.67 40.08 0.00 0.00
495
+ ATOM 495 C PTH 1 13.19 100.67 41.08 0.00 0.00
496
+ ATOM 496 C PTH 1 13.19 101.67 34.08 0.00 0.00
497
+ ATOM 497 C PTH 1 13.19 101.67 35.08 0.00 0.00
498
+ ATOM 498 C PTH 1 13.19 101.67 36.08 0.00 0.00
499
+ ATOM 499 C PTH 1 13.19 101.67 37.08 0.00 0.00
500
+ ATOM 500 C PTH 1 13.19 101.67 38.08 0.00 0.00
501
+ ATOM 501 C PTH 1 13.19 101.67 39.08 0.00 0.00
502
+ ATOM 502 C PTH 1 13.19 101.67 40.08 0.00 0.00
503
+ ATOM 503 C PTH 1 13.19 101.67 41.08 0.00 0.00
504
+ ATOM 504 C PTH 1 13.19 102.67 35.08 0.00 0.00
505
+ ATOM 505 C PTH 1 13.19 102.67 36.08 0.00 0.00
506
+ ATOM 506 C PTH 1 13.19 102.67 37.08 0.00 0.00
507
+ ATOM 507 C PTH 1 13.19 102.67 38.08 0.00 0.00
508
+ ATOM 508 C PTH 1 13.19 102.67 39.08 0.00 0.00
509
+ ATOM 509 C PTH 1 13.19 102.67 40.08 0.00 0.00
510
+ ATOM 510 C PTH 1 13.19 103.67 34.08 0.00 0.00
511
+ ATOM 511 C PTH 1 13.19 103.67 35.08 0.00 0.00
512
+ ATOM 512 C PTH 1 13.19 103.67 36.08 0.00 0.00
513
+ ATOM 513 C PTH 1 13.19 103.67 37.08 0.00 0.00
514
+ ATOM 514 C PTH 1 13.19 103.67 38.08 0.00 0.00
515
+ ATOM 515 C PTH 1 13.19 103.67 39.08 0.00 0.00
516
+ ATOM 516 C PTH 1 13.19 104.67 30.08 0.00 0.00
517
+ ATOM 517 C PTH 1 13.19 104.67 35.08 0.00 0.00
518
+ ATOM 518 C PTH 1 13.19 104.67 36.08 0.00 0.00
519
+ ATOM 519 C PTH 1 13.19 104.67 37.08 0.00 0.00
520
+ ATOM 520 C PTH 1 13.19 104.67 38.08 0.00 0.00
521
+ ATOM 521 C PTH 1 13.19 105.67 30.08 0.00 0.00
522
+ ATOM 522 C PTH 1 13.19 105.67 31.08 0.00 0.00
523
+ ATOM 523 C PTH 1 13.19 105.67 34.08 0.00 0.00
524
+ ATOM 524 C PTH 1 13.19 105.67 35.08 0.00 0.00
525
+ ATOM 525 C PTH 1 13.19 105.67 36.08 0.00 0.00
526
+ ATOM 526 C PTH 1 13.19 105.67 37.08 0.00 0.00
527
+ ATOM 527 C PTH 1 13.19 105.67 38.08 0.00 0.00
528
+ ATOM 528 C PTH 1 13.19 106.67 30.08 0.00 0.00
529
+ ATOM 529 C PTH 1 13.19 106.67 31.08 0.00 0.00
530
+ ATOM 530 C PTH 1 13.19 106.67 33.08 0.00 0.00
531
+ ATOM 531 C PTH 1 13.19 106.67 34.08 0.00 0.00
532
+ ATOM 532 C PTH 1 13.19 106.67 35.08 0.00 0.00
533
+ ATOM 533 C PTH 1 13.19 106.67 36.08 0.00 0.00
534
+ ATOM 534 C PTH 1 13.19 106.67 37.08 0.00 0.00
535
+ ATOM 535 C PTH 1 13.19 106.67 38.08 0.00 0.00
536
+ ATOM 536 C PTH 1 13.19 106.67 39.08 0.00 0.00
537
+ ATOM 537 C PTH 1 13.19 107.67 35.08 0.00 0.00
538
+ ATOM 538 C PTH 1 13.19 107.67 36.08 0.00 0.00
539
+ ATOM 539 C PTH 1 13.19 107.67 37.08 0.00 0.00
540
+ ATOM 540 C PTH 1 13.19 107.67 38.08 0.00 0.00
541
+ ATOM 541 C PTH 1 13.19 107.67 39.08 0.00 0.00
542
+ ATOM 542 C PTH 1 13.19 108.67 35.08 0.00 0.00
543
+ ATOM 543 C PTH 1 13.19 108.67 36.08 0.00 0.00
544
+ ATOM 544 C PTH 1 13.19 108.67 37.08 0.00 0.00
545
+ ATOM 545 C PTH 1 13.19 108.67 38.08 0.00 0.00
546
+ ATOM 546 C PTH 1 14.19 99.67 35.08 0.00 0.00
547
+ ATOM 547 C PTH 1 14.19 99.67 36.08 0.00 0.00
548
+ ATOM 548 C PTH 1 14.19 99.67 37.08 0.00 0.00
549
+ ATOM 549 C PTH 1 14.19 99.67 38.08 0.00 0.00
550
+ ATOM 550 C PTH 1 14.19 99.67 39.08 0.00 0.00
551
+ ATOM 551 C PTH 1 14.19 100.67 34.08 0.00 0.00
552
+ ATOM 552 C PTH 1 14.19 100.67 35.08 0.00 0.00
553
+ ATOM 553 C PTH 1 14.19 100.67 36.08 0.00 0.00
554
+ ATOM 554 C PTH 1 14.19 100.67 37.08 0.00 0.00
555
+ ATOM 555 C PTH 1 14.19 100.67 38.08 0.00 0.00
556
+ ATOM 556 C PTH 1 14.19 100.67 39.08 0.00 0.00
557
+ ATOM 557 C PTH 1 14.19 101.67 34.08 0.00 0.00
558
+ ATOM 558 C PTH 1 14.19 101.67 35.08 0.00 0.00
559
+ ATOM 559 C PTH 1 14.19 101.67 36.08 0.00 0.00
560
+ ATOM 560 C PTH 1 14.19 101.67 37.08 0.00 0.00
561
+ ATOM 561 C PTH 1 14.19 101.67 38.08 0.00 0.00
562
+ ATOM 562 C PTH 1 14.19 101.67 39.08 0.00 0.00
563
+ ATOM 563 C PTH 1 14.19 102.67 34.08 0.00 0.00
564
+ ATOM 564 C PTH 1 14.19 102.67 35.08 0.00 0.00
565
+ ATOM 565 C PTH 1 14.19 102.67 36.08 0.00 0.00
566
+ ATOM 566 C PTH 1 14.19 102.67 37.08 0.00 0.00
567
+ ATOM 567 C PTH 1 14.19 102.67 38.08 0.00 0.00
568
+ ATOM 568 C PTH 1 14.19 102.67 39.08 0.00 0.00
569
+ ATOM 569 C PTH 1 14.19 103.67 34.08 0.00 0.00
570
+ ATOM 570 C PTH 1 14.19 103.67 35.08 0.00 0.00
571
+ ATOM 571 C PTH 1 14.19 103.67 36.08 0.00 0.00
572
+ ATOM 572 C PTH 1 14.19 103.67 37.08 0.00 0.00
573
+ ATOM 573 C PTH 1 14.19 103.67 38.08 0.00 0.00
574
+ ATOM 574 C PTH 1 14.19 103.67 39.08 0.00 0.00
575
+ ATOM 575 C PTH 1 14.19 104.67 34.08 0.00 0.00
576
+ ATOM 576 C PTH 1 14.19 104.67 35.08 0.00 0.00
577
+ ATOM 577 C PTH 1 14.19 104.67 36.08 0.00 0.00
578
+ ATOM 578 C PTH 1 14.19 104.67 37.08 0.00 0.00
579
+ ATOM 579 C PTH 1 14.19 104.67 38.08 0.00 0.00
580
+ ATOM 580 C PTH 1 14.19 105.67 34.08 0.00 0.00
581
+ ATOM 581 C PTH 1 14.19 105.67 35.08 0.00 0.00
582
+ ATOM 582 C PTH 1 14.19 105.67 36.08 0.00 0.00
583
+ ATOM 583 C PTH 1 14.19 105.67 37.08 0.00 0.00
584
+ ATOM 584 C PTH 1 14.19 105.67 38.08 0.00 0.00
585
+ ATOM 585 C PTH 1 14.19 105.67 39.08 0.00 0.00
586
+ ATOM 586 C PTH 1 14.19 106.67 34.08 0.00 0.00
587
+ ATOM 587 C PTH 1 14.19 106.67 35.08 0.00 0.00
588
+ ATOM 588 C PTH 1 14.19 106.67 36.08 0.00 0.00
589
+ ATOM 589 C PTH 1 14.19 106.67 37.08 0.00 0.00
590
+ ATOM 590 C PTH 1 14.19 106.67 38.08 0.00 0.00
591
+ ATOM 591 C PTH 1 14.19 106.67 39.08 0.00 0.00
592
+ ATOM 592 C PTH 1 14.19 107.67 35.08 0.00 0.00
593
+ ATOM 593 C PTH 1 14.19 107.67 36.08 0.00 0.00
594
+ ATOM 594 C PTH 1 14.19 107.67 37.08 0.00 0.00
595
+ ATOM 595 C PTH 1 14.19 107.67 38.08 0.00 0.00
596
+ ATOM 596 C PTH 1 14.19 107.67 39.08 0.00 0.00
597
+ ATOM 597 C PTH 1 14.19 108.67 37.08 0.00 0.00
598
+ ATOM 598 C PTH 1 14.19 108.67 38.08 0.00 0.00
599
+ ATOM 599 C PTH 1 14.19 108.67 39.08 0.00 0.00
600
+ ATOM 600 C PTH 1 15.19 99.67 34.08 0.00 0.00
601
+ ATOM 601 C PTH 1 15.19 99.67 35.08 0.00 0.00
602
+ ATOM 602 C PTH 1 15.19 99.67 36.08 0.00 0.00
603
+ ATOM 603 C PTH 1 15.19 99.67 37.08 0.00 0.00
604
+ ATOM 604 C PTH 1 15.19 99.67 38.08 0.00 0.00
605
+ ATOM 605 C PTH 1 15.19 99.67 39.08 0.00 0.00
606
+ ATOM 606 C PTH 1 15.19 100.67 34.08 0.00 0.00
607
+ ATOM 607 C PTH 1 15.19 100.67 35.08 0.00 0.00
608
+ ATOM 608 C PTH 1 15.19 100.67 36.08 0.00 0.00
609
+ ATOM 609 C PTH 1 15.19 100.67 37.08 0.00 0.00
610
+ ATOM 610 C PTH 1 15.19 100.67 38.08 0.00 0.00
611
+ ATOM 611 C PTH 1 15.19 100.67 39.08 0.00 0.00
612
+ ATOM 612 C PTH 1 15.19 101.67 34.08 0.00 0.00
613
+ ATOM 613 C PTH 1 15.19 101.67 35.08 0.00 0.00
614
+ ATOM 614 C PTH 1 15.19 101.67 36.08 0.00 0.00
615
+ ATOM 615 C PTH 1 15.19 101.67 37.08 0.00 0.00
616
+ ATOM 616 C PTH 1 15.19 101.67 38.08 0.00 0.00
617
+ ATOM 617 C PTH 1 15.19 101.67 39.08 0.00 0.00
618
+ ATOM 618 C PTH 1 15.19 102.67 34.08 0.00 0.00
619
+ ATOM 619 C PTH 1 15.19 102.67 35.08 0.00 0.00
620
+ ATOM 620 C PTH 1 15.19 102.67 36.08 0.00 0.00
621
+ ATOM 621 C PTH 1 15.19 102.67 37.08 0.00 0.00
622
+ ATOM 622 C PTH 1 15.19 102.67 38.08 0.00 0.00
623
+ ATOM 623 C PTH 1 15.19 102.67 39.08 0.00 0.00
624
+ ATOM 624 C PTH 1 15.19 103.67 34.08 0.00 0.00
625
+ ATOM 625 C PTH 1 15.19 103.67 35.08 0.00 0.00
626
+ ATOM 626 C PTH 1 15.19 103.67 36.08 0.00 0.00
627
+ ATOM 627 C PTH 1 15.19 103.67 37.08 0.00 0.00
628
+ ATOM 628 C PTH 1 15.19 103.67 38.08 0.00 0.00
629
+ ATOM 629 C PTH 1 15.19 104.67 34.08 0.00 0.00
630
+ ATOM 630 C PTH 1 15.19 104.67 35.08 0.00 0.00
631
+ ATOM 631 C PTH 1 15.19 104.67 36.08 0.00 0.00
632
+ ATOM 632 C PTH 1 15.19 104.67 37.08 0.00 0.00
633
+ ATOM 633 C PTH 1 15.19 104.67 38.08 0.00 0.00
634
+ ATOM 634 C PTH 1 15.19 105.67 34.08 0.00 0.00
635
+ ATOM 635 C PTH 1 15.19 105.67 35.08 0.00 0.00
636
+ ATOM 636 C PTH 1 15.19 105.67 36.08 0.00 0.00
637
+ ATOM 637 C PTH 1 15.19 105.67 37.08 0.00 0.00
638
+ ATOM 638 C PTH 1 15.19 105.67 38.08 0.00 0.00
639
+ ATOM 639 C PTH 1 15.19 106.67 34.08 0.00 0.00
640
+ ATOM 640 C PTH 1 15.19 106.67 35.08 0.00 0.00
641
+ ATOM 641 C PTH 1 15.19 106.67 36.08 0.00 0.00
642
+ ATOM 642 C PTH 1 15.19 106.67 37.08 0.00 0.00
643
+ ATOM 643 C PTH 1 15.19 106.67 38.08 0.00 0.00
644
+ ATOM 644 C PTH 1 15.19 106.67 39.08 0.00 0.00
645
+ ATOM 645 C PTH 1 15.19 107.67 35.08 0.00 0.00
646
+ ATOM 646 C PTH 1 15.19 107.67 36.08 0.00 0.00
647
+ ATOM 647 C PTH 1 15.19 107.67 37.08 0.00 0.00
648
+ ATOM 648 C PTH 1 15.19 107.67 38.08 0.00 0.00
649
+ ATOM 649 C PTH 1 15.19 107.67 39.08 0.00 0.00
650
+ ATOM 650 C PTH 1 15.19 108.67 36.08 0.00 0.00
651
+ ATOM 651 C PTH 1 15.19 108.67 37.08 0.00 0.00
652
+ ATOM 652 C PTH 1 15.19 108.67 38.08 0.00 0.00
653
+ ATOM 653 C PTH 1 15.19 108.67 39.08 0.00 0.00
654
+ ATOM 654 C PTH 1 15.19 109.67 38.08 0.00 0.00
655
+ ATOM 655 C PTH 1 15.19 109.67 39.08 0.00 0.00
656
+ ATOM 656 C PTH 1 16.19 99.67 35.08 0.00 0.00
657
+ ATOM 657 C PTH 1 16.19 99.67 36.08 0.00 0.00
658
+ ATOM 658 C PTH 1 16.19 99.67 37.08 0.00 0.00
659
+ ATOM 659 C PTH 1 16.19 99.67 38.08 0.00 0.00
660
+ ATOM 660 C PTH 1 16.19 100.67 34.08 0.00 0.00
661
+ ATOM 661 C PTH 1 16.19 100.67 35.08 0.00 0.00
662
+ ATOM 662 C PTH 1 16.19 100.67 36.08 0.00 0.00
663
+ ATOM 663 C PTH 1 16.19 100.67 37.08 0.00 0.00
664
+ ATOM 664 C PTH 1 16.19 100.67 38.08 0.00 0.00
665
+ ATOM 665 C PTH 1 16.19 100.67 39.08 0.00 0.00
666
+ ATOM 666 C PTH 1 16.19 101.67 34.08 0.00 0.00
667
+ ATOM 667 C PTH 1 16.19 101.67 35.08 0.00 0.00
668
+ ATOM 668 C PTH 1 16.19 101.67 36.08 0.00 0.00
669
+ ATOM 669 C PTH 1 16.19 101.67 37.08 0.00 0.00
670
+ ATOM 670 C PTH 1 16.19 101.67 38.08 0.00 0.00
671
+ ATOM 671 C PTH 1 16.19 101.67 39.08 0.00 0.00
672
+ ATOM 672 C PTH 1 16.19 102.67 34.08 0.00 0.00
673
+ ATOM 673 C PTH 1 16.19 102.67 35.08 0.00 0.00
674
+ ATOM 674 C PTH 1 16.19 102.67 36.08 0.00 0.00
675
+ ATOM 675 C PTH 1 16.19 102.67 37.08 0.00 0.00
676
+ ATOM 676 C PTH 1 16.19 102.67 38.08 0.00 0.00
677
+ ATOM 677 C PTH 1 16.19 102.67 39.08 0.00 0.00
678
+ ATOM 678 C PTH 1 16.19 103.67 34.08 0.00 0.00
679
+ ATOM 679 C PTH 1 16.19 103.67 35.08 0.00 0.00
680
+ ATOM 680 C PTH 1 16.19 103.67 36.08 0.00 0.00
681
+ ATOM 681 C PTH 1 16.19 103.67 37.08 0.00 0.00
682
+ ATOM 682 C PTH 1 16.19 103.67 38.08 0.00 0.00
683
+ ATOM 683 C PTH 1 16.19 104.67 35.08 0.00 0.00
684
+ ATOM 684 C PTH 1 16.19 104.67 36.08 0.00 0.00
685
+ ATOM 685 C PTH 1 16.19 104.67 37.08 0.00 0.00
686
+ ATOM 686 C PTH 1 16.19 104.67 38.08 0.00 0.00
687
+ ATOM 687 C PTH 1 16.19 105.67 35.08 0.00 0.00
688
+ ATOM 688 C PTH 1 16.19 105.67 36.08 0.00 0.00
689
+ ATOM 689 C PTH 1 16.19 105.67 37.08 0.00 0.00
690
+ ATOM 690 C PTH 1 16.19 105.67 38.08 0.00 0.00
691
+ ATOM 691 C PTH 1 16.19 106.67 35.08 0.00 0.00
692
+ ATOM 692 C PTH 1 16.19 106.67 36.08 0.00 0.00
693
+ ATOM 693 C PTH 1 16.19 106.67 37.08 0.00 0.00
694
+ ATOM 694 C PTH 1 16.19 106.67 38.08 0.00 0.00
695
+ ATOM 695 C PTH 1 16.19 107.67 35.08 0.00 0.00
696
+ ATOM 696 C PTH 1 16.19 107.67 36.08 0.00 0.00
697
+ ATOM 697 C PTH 1 16.19 107.67 37.08 0.00 0.00
698
+ ATOM 698 C PTH 1 16.19 107.67 38.08 0.00 0.00
699
+ ATOM 699 C PTH 1 16.19 107.67 39.08 0.00 0.00
700
+ ATOM 700 C PTH 1 16.19 108.67 36.08 0.00 0.00
701
+ ATOM 701 C PTH 1 16.19 108.67 37.08 0.00 0.00
702
+ ATOM 702 C PTH 1 17.19 99.67 36.08 0.00 0.00
703
+ ATOM 703 C PTH 1 17.19 99.67 37.08 0.00 0.00
704
+ ATOM 704 C PTH 1 17.19 100.67 35.08 0.00 0.00
705
+ ATOM 705 C PTH 1 17.19 100.67 36.08 0.00 0.00
706
+ ATOM 706 C PTH 1 17.19 100.67 37.08 0.00 0.00
707
+ ATOM 707 C PTH 1 17.19 100.67 38.08 0.00 0.00
708
+ ATOM 708 C PTH 1 17.19 101.67 35.08 0.00 0.00
709
+ ATOM 709 C PTH 1 17.19 101.67 36.08 0.00 0.00
710
+ ATOM 710 C PTH 1 17.19 101.67 37.08 0.00 0.00
711
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712
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713
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714
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715
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716
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717
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718
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719
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720
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721
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722
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723
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724
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725
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726
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727
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728
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729
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730
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731
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732
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733
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734
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735
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736
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737
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738
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739
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740
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741
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742
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743
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744
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745
+ ATOM 745 C PTH 1 18.19 109.67 36.08 0.00 0.00
data/files/A00BR/pocket_03.pdb ADDED
@@ -0,0 +1,596 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 11.19 89.67 41.08 0.00 0.00
2
+ ATOM 2 C PTH 1 11.19 89.67 42.08 0.00 0.00
3
+ ATOM 3 C PTH 1 11.19 89.67 43.08 0.00 0.00
4
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5
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6
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7
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8
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9
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10
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11
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12
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13
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14
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15
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16
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17
+ ATOM 17 C PTH 1 12.19 89.67 41.08 0.00 0.00
18
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19
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20
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21
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23
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24
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25
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26
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27
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28
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29
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30
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31
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32
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33
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34
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35
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36
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37
+ ATOM 37 C PTH 1 13.19 89.67 41.08 0.00 0.00
38
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39
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40
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41
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42
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43
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44
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45
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46
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47
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48
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49
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50
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51
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52
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53
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54
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55
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56
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57
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58
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59
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60
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61
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62
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63
+ ATOM 63 C PTH 1 14.19 89.67 43.08 0.00 0.00
64
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65
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66
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67
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68
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69
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70
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71
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72
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73
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74
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75
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76
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77
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78
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79
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80
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81
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82
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83
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84
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85
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86
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87
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88
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89
+ ATOM 89 C PTH 1 14.19 93.67 46.08 0.00 0.00
90
+ ATOM 90 C PTH 1 14.19 94.67 41.08 0.00 0.00
91
+ ATOM 91 C PTH 1 14.19 94.67 42.08 0.00 0.00
92
+ ATOM 92 C PTH 1 14.19 94.67 43.08 0.00 0.00
93
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94
+ ATOM 94 C PTH 1 14.19 94.67 45.08 0.00 0.00
95
+ ATOM 95 C PTH 1 14.19 94.67 46.08 0.00 0.00
96
+ ATOM 96 C PTH 1 14.19 95.67 42.08 0.00 0.00
97
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98
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99
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100
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101
+ ATOM 101 C PTH 1 14.19 96.67 45.08 0.00 0.00
102
+ ATOM 102 C PTH 1 15.19 90.67 40.08 0.00 0.00
103
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104
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105
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106
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107
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108
+ ATOM 108 C PTH 1 15.19 91.67 41.08 0.00 0.00
109
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110
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111
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112
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113
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114
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115
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116
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117
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118
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119
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120
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121
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122
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123
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124
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125
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126
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127
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128
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129
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130
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131
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132
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133
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134
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135
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136
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137
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138
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139
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140
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141
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142
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143
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144
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146
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147
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148
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149
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150
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151
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152
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153
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154
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155
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156
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157
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158
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159
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160
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161
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162
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163
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164
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165
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166
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167
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168
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169
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170
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171
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172
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173
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174
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175
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176
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177
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178
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179
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180
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181
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182
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185
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187
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188
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189
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194
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195
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197
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198
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199
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201
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203
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204
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205
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207
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208
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209
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210
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211
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212
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213
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214
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215
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216
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217
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218
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219
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220
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221
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222
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223
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224
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225
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226
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227
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228
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229
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230
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231
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232
+ ATOM 232 C PTH 1 17.19 92.67 41.08 0.00 0.00
233
+ ATOM 233 C PTH 1 17.19 92.67 42.08 0.00 0.00
234
+ ATOM 234 C PTH 1 17.19 92.67 43.08 0.00 0.00
235
+ ATOM 235 C PTH 1 17.19 92.67 44.08 0.00 0.00
236
+ ATOM 236 C PTH 1 17.19 92.67 45.08 0.00 0.00
237
+ ATOM 237 C PTH 1 17.19 92.67 46.08 0.00 0.00
238
+ ATOM 238 C PTH 1 17.19 92.67 47.08 0.00 0.00
239
+ ATOM 239 C PTH 1 17.19 92.67 48.08 0.00 0.00
240
+ ATOM 240 C PTH 1 17.19 93.67 39.08 0.00 0.00
241
+ ATOM 241 C PTH 1 17.19 93.67 40.08 0.00 0.00
242
+ ATOM 242 C PTH 1 17.19 93.67 41.08 0.00 0.00
243
+ ATOM 243 C PTH 1 17.19 93.67 42.08 0.00 0.00
244
+ ATOM 244 C PTH 1 17.19 93.67 43.08 0.00 0.00
245
+ ATOM 245 C PTH 1 17.19 93.67 44.08 0.00 0.00
246
+ ATOM 246 C PTH 1 17.19 93.67 45.08 0.00 0.00
247
+ ATOM 247 C PTH 1 17.19 93.67 46.08 0.00 0.00
248
+ ATOM 248 C PTH 1 17.19 93.67 47.08 0.00 0.00
249
+ ATOM 249 C PTH 1 17.19 93.67 48.08 0.00 0.00
250
+ ATOM 250 C PTH 1 17.19 93.67 49.08 0.00 0.00
251
+ ATOM 251 C PTH 1 17.19 94.67 40.08 0.00 0.00
252
+ ATOM 252 C PTH 1 17.19 94.67 41.08 0.00 0.00
253
+ ATOM 253 C PTH 1 17.19 94.67 42.08 0.00 0.00
254
+ ATOM 254 C PTH 1 17.19 94.67 43.08 0.00 0.00
255
+ ATOM 255 C PTH 1 17.19 94.67 44.08 0.00 0.00
256
+ ATOM 256 C PTH 1 17.19 94.67 45.08 0.00 0.00
257
+ ATOM 257 C PTH 1 17.19 94.67 46.08 0.00 0.00
258
+ ATOM 258 C PTH 1 17.19 94.67 47.08 0.00 0.00
259
+ ATOM 259 C PTH 1 17.19 94.67 48.08 0.00 0.00
260
+ ATOM 260 C PTH 1 17.19 94.67 49.08 0.00 0.00
261
+ ATOM 261 C PTH 1 17.19 94.67 50.08 0.00 0.00
262
+ ATOM 262 C PTH 1 17.19 95.67 42.08 0.00 0.00
263
+ ATOM 263 C PTH 1 17.19 95.67 43.08 0.00 0.00
264
+ ATOM 264 C PTH 1 17.19 95.67 44.08 0.00 0.00
265
+ ATOM 265 C PTH 1 17.19 95.67 45.08 0.00 0.00
266
+ ATOM 266 C PTH 1 17.19 95.67 46.08 0.00 0.00
267
+ ATOM 267 C PTH 1 17.19 95.67 47.08 0.00 0.00
268
+ ATOM 268 C PTH 1 17.19 95.67 48.08 0.00 0.00
269
+ ATOM 269 C PTH 1 17.19 95.67 49.08 0.00 0.00
270
+ ATOM 270 C PTH 1 17.19 95.67 50.08 0.00 0.00
271
+ ATOM 271 C PTH 1 17.19 95.67 51.08 0.00 0.00
272
+ ATOM 272 C PTH 1 17.19 96.67 44.08 0.00 0.00
273
+ ATOM 273 C PTH 1 17.19 96.67 45.08 0.00 0.00
274
+ ATOM 274 C PTH 1 17.19 96.67 46.08 0.00 0.00
275
+ ATOM 275 C PTH 1 17.19 96.67 47.08 0.00 0.00
276
+ ATOM 276 C PTH 1 17.19 96.67 48.08 0.00 0.00
277
+ ATOM 277 C PTH 1 17.19 96.67 49.08 0.00 0.00
278
+ ATOM 278 C PTH 1 17.19 96.67 50.08 0.00 0.00
279
+ ATOM 279 C PTH 1 17.19 96.67 51.08 0.00 0.00
280
+ ATOM 280 C PTH 1 17.19 96.67 52.08 0.00 0.00
281
+ ATOM 281 C PTH 1 17.19 97.67 45.08 0.00 0.00
282
+ ATOM 282 C PTH 1 17.19 97.67 46.08 0.00 0.00
283
+ ATOM 283 C PTH 1 17.19 97.67 47.08 0.00 0.00
284
+ ATOM 284 C PTH 1 17.19 97.67 48.08 0.00 0.00
285
+ ATOM 285 C PTH 1 17.19 97.67 49.08 0.00 0.00
286
+ ATOM 286 C PTH 1 17.19 97.67 50.08 0.00 0.00
287
+ ATOM 287 C PTH 1 17.19 97.67 51.08 0.00 0.00
288
+ ATOM 288 C PTH 1 17.19 97.67 52.08 0.00 0.00
289
+ ATOM 289 C PTH 1 17.19 98.67 45.08 0.00 0.00
290
+ ATOM 290 C PTH 1 17.19 98.67 46.08 0.00 0.00
291
+ ATOM 291 C PTH 1 17.19 98.67 47.08 0.00 0.00
292
+ ATOM 292 C PTH 1 17.19 98.67 48.08 0.00 0.00
293
+ ATOM 293 C PTH 1 17.19 98.67 49.08 0.00 0.00
294
+ ATOM 294 C PTH 1 17.19 98.67 50.08 0.00 0.00
295
+ ATOM 295 C PTH 1 17.19 98.67 51.08 0.00 0.00
296
+ ATOM 296 C PTH 1 17.19 98.67 52.08 0.00 0.00
297
+ ATOM 297 C PTH 1 17.19 98.67 53.08 0.00 0.00
298
+ ATOM 298 C PTH 1 17.19 99.67 50.08 0.00 0.00
299
+ ATOM 299 C PTH 1 17.19 99.67 51.08 0.00 0.00
300
+ ATOM 300 C PTH 1 17.19 99.67 52.08 0.00 0.00
301
+ ATOM 301 C PTH 1 17.19 99.67 53.08 0.00 0.00
302
+ ATOM 302 C PTH 1 17.19 100.67 51.08 0.00 0.00
303
+ ATOM 303 C PTH 1 17.19 100.67 52.08 0.00 0.00
304
+ ATOM 304 C PTH 1 17.19 100.67 53.08 0.00 0.00
305
+ ATOM 305 C PTH 1 18.19 92.67 41.08 0.00 0.00
306
+ ATOM 306 C PTH 1 18.19 92.67 42.08 0.00 0.00
307
+ ATOM 307 C PTH 1 18.19 92.67 43.08 0.00 0.00
308
+ ATOM 308 C PTH 1 18.19 92.67 44.08 0.00 0.00
309
+ ATOM 309 C PTH 1 18.19 92.67 45.08 0.00 0.00
310
+ ATOM 310 C PTH 1 18.19 92.67 46.08 0.00 0.00
311
+ ATOM 311 C PTH 1 18.19 92.67 47.08 0.00 0.00
312
+ ATOM 312 C PTH 1 18.19 92.67 48.08 0.00 0.00
313
+ ATOM 313 C PTH 1 18.19 93.67 40.08 0.00 0.00
314
+ ATOM 314 C PTH 1 18.19 93.67 41.08 0.00 0.00
315
+ ATOM 315 C PTH 1 18.19 93.67 42.08 0.00 0.00
316
+ ATOM 316 C PTH 1 18.19 93.67 43.08 0.00 0.00
317
+ ATOM 317 C PTH 1 18.19 93.67 44.08 0.00 0.00
318
+ ATOM 318 C PTH 1 18.19 93.67 45.08 0.00 0.00
319
+ ATOM 319 C PTH 1 18.19 93.67 46.08 0.00 0.00
320
+ ATOM 320 C PTH 1 18.19 93.67 47.08 0.00 0.00
321
+ ATOM 321 C PTH 1 18.19 93.67 48.08 0.00 0.00
322
+ ATOM 322 C PTH 1 18.19 93.67 49.08 0.00 0.00
323
+ ATOM 323 C PTH 1 18.19 94.67 40.08 0.00 0.00
324
+ ATOM 324 C PTH 1 18.19 94.67 41.08 0.00 0.00
325
+ ATOM 325 C PTH 1 18.19 94.67 42.08 0.00 0.00
326
+ ATOM 326 C PTH 1 18.19 94.67 43.08 0.00 0.00
327
+ ATOM 327 C PTH 1 18.19 94.67 44.08 0.00 0.00
328
+ ATOM 328 C PTH 1 18.19 94.67 45.08 0.00 0.00
329
+ ATOM 329 C PTH 1 18.19 94.67 46.08 0.00 0.00
330
+ ATOM 330 C PTH 1 18.19 94.67 47.08 0.00 0.00
331
+ ATOM 331 C PTH 1 18.19 94.67 48.08 0.00 0.00
332
+ ATOM 332 C PTH 1 18.19 94.67 49.08 0.00 0.00
333
+ ATOM 333 C PTH 1 18.19 94.67 50.08 0.00 0.00
334
+ ATOM 334 C PTH 1 18.19 95.67 42.08 0.00 0.00
335
+ ATOM 335 C PTH 1 18.19 95.67 43.08 0.00 0.00
336
+ ATOM 336 C PTH 1 18.19 95.67 44.08 0.00 0.00
337
+ ATOM 337 C PTH 1 18.19 95.67 45.08 0.00 0.00
338
+ ATOM 338 C PTH 1 18.19 95.67 46.08 0.00 0.00
339
+ ATOM 339 C PTH 1 18.19 95.67 47.08 0.00 0.00
340
+ ATOM 340 C PTH 1 18.19 95.67 48.08 0.00 0.00
341
+ ATOM 341 C PTH 1 18.19 95.67 49.08 0.00 0.00
342
+ ATOM 342 C PTH 1 18.19 95.67 50.08 0.00 0.00
343
+ ATOM 343 C PTH 1 18.19 95.67 51.08 0.00 0.00
344
+ ATOM 344 C PTH 1 18.19 96.67 44.08 0.00 0.00
345
+ ATOM 345 C PTH 1 18.19 96.67 45.08 0.00 0.00
346
+ ATOM 346 C PTH 1 18.19 96.67 46.08 0.00 0.00
347
+ ATOM 347 C PTH 1 18.19 96.67 47.08 0.00 0.00
348
+ ATOM 348 C PTH 1 18.19 96.67 48.08 0.00 0.00
349
+ ATOM 349 C PTH 1 18.19 96.67 49.08 0.00 0.00
350
+ ATOM 350 C PTH 1 18.19 96.67 50.08 0.00 0.00
351
+ ATOM 351 C PTH 1 18.19 96.67 51.08 0.00 0.00
352
+ ATOM 352 C PTH 1 18.19 96.67 52.08 0.00 0.00
353
+ ATOM 353 C PTH 1 18.19 97.67 44.08 0.00 0.00
354
+ ATOM 354 C PTH 1 18.19 97.67 45.08 0.00 0.00
355
+ ATOM 355 C PTH 1 18.19 97.67 46.08 0.00 0.00
356
+ ATOM 356 C PTH 1 18.19 97.67 47.08 0.00 0.00
357
+ ATOM 357 C PTH 1 18.19 97.67 48.08 0.00 0.00
358
+ ATOM 358 C PTH 1 18.19 97.67 49.08 0.00 0.00
359
+ ATOM 359 C PTH 1 18.19 97.67 50.08 0.00 0.00
360
+ ATOM 360 C PTH 1 18.19 97.67 51.08 0.00 0.00
361
+ ATOM 361 C PTH 1 18.19 97.67 52.08 0.00 0.00
362
+ ATOM 362 C PTH 1 18.19 98.67 45.08 0.00 0.00
363
+ ATOM 363 C PTH 1 18.19 98.67 46.08 0.00 0.00
364
+ ATOM 364 C PTH 1 18.19 98.67 47.08 0.00 0.00
365
+ ATOM 365 C PTH 1 18.19 98.67 48.08 0.00 0.00
366
+ ATOM 366 C PTH 1 18.19 98.67 49.08 0.00 0.00
367
+ ATOM 367 C PTH 1 18.19 98.67 50.08 0.00 0.00
368
+ ATOM 368 C PTH 1 18.19 98.67 51.08 0.00 0.00
369
+ ATOM 369 C PTH 1 18.19 98.67 52.08 0.00 0.00
370
+ ATOM 370 C PTH 1 18.19 98.67 53.08 0.00 0.00
371
+ ATOM 371 C PTH 1 18.19 99.67 46.08 0.00 0.00
372
+ ATOM 372 C PTH 1 18.19 99.67 47.08 0.00 0.00
373
+ ATOM 373 C PTH 1 18.19 99.67 48.08 0.00 0.00
374
+ ATOM 374 C PTH 1 18.19 99.67 49.08 0.00 0.00
375
+ ATOM 375 C PTH 1 18.19 99.67 50.08 0.00 0.00
376
+ ATOM 376 C PTH 1 18.19 99.67 51.08 0.00 0.00
377
+ ATOM 377 C PTH 1 18.19 99.67 52.08 0.00 0.00
378
+ ATOM 378 C PTH 1 18.19 99.67 53.08 0.00 0.00
379
+ ATOM 379 C PTH 1 18.19 100.67 47.08 0.00 0.00
380
+ ATOM 380 C PTH 1 18.19 100.67 48.08 0.00 0.00
381
+ ATOM 381 C PTH 1 18.19 100.67 49.08 0.00 0.00
382
+ ATOM 382 C PTH 1 18.19 100.67 50.08 0.00 0.00
383
+ ATOM 383 C PTH 1 18.19 100.67 51.08 0.00 0.00
384
+ ATOM 384 C PTH 1 18.19 100.67 52.08 0.00 0.00
385
+ ATOM 385 C PTH 1 18.19 100.67 53.08 0.00 0.00
386
+ ATOM 386 C PTH 1 18.19 101.67 52.08 0.00 0.00
387
+ ATOM 387 C PTH 1 18.19 101.67 53.08 0.00 0.00
388
+ ATOM 388 C PTH 1 19.19 93.67 45.08 0.00 0.00
389
+ ATOM 389 C PTH 1 19.19 93.67 46.08 0.00 0.00
390
+ ATOM 390 C PTH 1 19.19 93.67 47.08 0.00 0.00
391
+ ATOM 391 C PTH 1 19.19 93.67 48.08 0.00 0.00
392
+ ATOM 392 C PTH 1 19.19 94.67 44.08 0.00 0.00
393
+ ATOM 393 C PTH 1 19.19 94.67 45.08 0.00 0.00
394
+ ATOM 394 C PTH 1 19.19 94.67 46.08 0.00 0.00
395
+ ATOM 395 C PTH 1 19.19 94.67 47.08 0.00 0.00
396
+ ATOM 396 C PTH 1 19.19 94.67 48.08 0.00 0.00
397
+ ATOM 397 C PTH 1 19.19 94.67 49.08 0.00 0.00
398
+ ATOM 398 C PTH 1 19.19 95.67 43.08 0.00 0.00
399
+ ATOM 399 C PTH 1 19.19 95.67 44.08 0.00 0.00
400
+ ATOM 400 C PTH 1 19.19 95.67 45.08 0.00 0.00
401
+ ATOM 401 C PTH 1 19.19 95.67 46.08 0.00 0.00
402
+ ATOM 402 C PTH 1 19.19 95.67 47.08 0.00 0.00
403
+ ATOM 403 C PTH 1 19.19 95.67 48.08 0.00 0.00
404
+ ATOM 404 C PTH 1 19.19 95.67 49.08 0.00 0.00
405
+ ATOM 405 C PTH 1 19.19 95.67 50.08 0.00 0.00
406
+ ATOM 406 C PTH 1 19.19 95.67 51.08 0.00 0.00
407
+ ATOM 407 C PTH 1 19.19 96.67 44.08 0.00 0.00
408
+ ATOM 408 C PTH 1 19.19 96.67 45.08 0.00 0.00
409
+ ATOM 409 C PTH 1 19.19 96.67 46.08 0.00 0.00
410
+ ATOM 410 C PTH 1 19.19 96.67 47.08 0.00 0.00
411
+ ATOM 411 C PTH 1 19.19 96.67 48.08 0.00 0.00
412
+ ATOM 412 C PTH 1 19.19 96.67 49.08 0.00 0.00
413
+ ATOM 413 C PTH 1 19.19 96.67 50.08 0.00 0.00
414
+ ATOM 414 C PTH 1 19.19 96.67 51.08 0.00 0.00
415
+ ATOM 415 C PTH 1 19.19 96.67 52.08 0.00 0.00
416
+ ATOM 416 C PTH 1 19.19 97.67 44.08 0.00 0.00
417
+ ATOM 417 C PTH 1 19.19 97.67 45.08 0.00 0.00
418
+ ATOM 418 C PTH 1 19.19 97.67 46.08 0.00 0.00
419
+ ATOM 419 C PTH 1 19.19 97.67 47.08 0.00 0.00
420
+ ATOM 420 C PTH 1 19.19 97.67 48.08 0.00 0.00
421
+ ATOM 421 C PTH 1 19.19 97.67 49.08 0.00 0.00
422
+ ATOM 422 C PTH 1 19.19 97.67 50.08 0.00 0.00
423
+ ATOM 423 C PTH 1 19.19 97.67 51.08 0.00 0.00
424
+ ATOM 424 C PTH 1 19.19 97.67 52.08 0.00 0.00
425
+ ATOM 425 C PTH 1 19.19 98.67 44.08 0.00 0.00
426
+ ATOM 426 C PTH 1 19.19 98.67 45.08 0.00 0.00
427
+ ATOM 427 C PTH 1 19.19 98.67 46.08 0.00 0.00
428
+ ATOM 428 C PTH 1 19.19 98.67 47.08 0.00 0.00
429
+ ATOM 429 C PTH 1 19.19 98.67 48.08 0.00 0.00
430
+ ATOM 430 C PTH 1 19.19 98.67 49.08 0.00 0.00
431
+ ATOM 431 C PTH 1 19.19 98.67 50.08 0.00 0.00
432
+ ATOM 432 C PTH 1 19.19 98.67 51.08 0.00 0.00
433
+ ATOM 433 C PTH 1 19.19 98.67 52.08 0.00 0.00
434
+ ATOM 434 C PTH 1 19.19 98.67 53.08 0.00 0.00
435
+ ATOM 435 C PTH 1 19.19 99.67 45.08 0.00 0.00
436
+ ATOM 436 C PTH 1 19.19 99.67 46.08 0.00 0.00
437
+ ATOM 437 C PTH 1 19.19 99.67 47.08 0.00 0.00
438
+ ATOM 438 C PTH 1 19.19 99.67 48.08 0.00 0.00
439
+ ATOM 439 C PTH 1 19.19 99.67 49.08 0.00 0.00
440
+ ATOM 440 C PTH 1 19.19 99.67 50.08 0.00 0.00
441
+ ATOM 441 C PTH 1 19.19 99.67 51.08 0.00 0.00
442
+ ATOM 442 C PTH 1 19.19 99.67 52.08 0.00 0.00
443
+ ATOM 443 C PTH 1 19.19 99.67 53.08 0.00 0.00
444
+ ATOM 444 C PTH 1 19.19 100.67 46.08 0.00 0.00
445
+ ATOM 445 C PTH 1 19.19 100.67 47.08 0.00 0.00
446
+ ATOM 446 C PTH 1 19.19 100.67 48.08 0.00 0.00
447
+ ATOM 447 C PTH 1 19.19 100.67 49.08 0.00 0.00
448
+ ATOM 448 C PTH 1 19.19 100.67 50.08 0.00 0.00
449
+ ATOM 449 C PTH 1 19.19 100.67 51.08 0.00 0.00
450
+ ATOM 450 C PTH 1 19.19 100.67 52.08 0.00 0.00
451
+ ATOM 451 C PTH 1 19.19 100.67 53.08 0.00 0.00
452
+ ATOM 452 C PTH 1 20.19 95.67 43.08 0.00 0.00
453
+ ATOM 453 C PTH 1 20.19 95.67 44.08 0.00 0.00
454
+ ATOM 454 C PTH 1 20.19 95.67 45.08 0.00 0.00
455
+ ATOM 455 C PTH 1 20.19 95.67 46.08 0.00 0.00
456
+ ATOM 456 C PTH 1 20.19 95.67 47.08 0.00 0.00
457
+ ATOM 457 C PTH 1 20.19 95.67 48.08 0.00 0.00
458
+ ATOM 458 C PTH 1 20.19 95.67 49.08 0.00 0.00
459
+ ATOM 459 C PTH 1 20.19 95.67 50.08 0.00 0.00
460
+ ATOM 460 C PTH 1 20.19 96.67 43.08 0.00 0.00
461
+ ATOM 461 C PTH 1 20.19 96.67 44.08 0.00 0.00
462
+ ATOM 462 C PTH 1 20.19 96.67 45.08 0.00 0.00
463
+ ATOM 463 C PTH 1 20.19 96.67 46.08 0.00 0.00
464
+ ATOM 464 C PTH 1 20.19 96.67 47.08 0.00 0.00
465
+ ATOM 465 C PTH 1 20.19 96.67 48.08 0.00 0.00
466
+ ATOM 466 C PTH 1 20.19 96.67 49.08 0.00 0.00
467
+ ATOM 467 C PTH 1 20.19 96.67 50.08 0.00 0.00
468
+ ATOM 468 C PTH 1 20.19 96.67 51.08 0.00 0.00
469
+ ATOM 469 C PTH 1 20.19 97.67 43.08 0.00 0.00
470
+ ATOM 470 C PTH 1 20.19 97.67 44.08 0.00 0.00
471
+ ATOM 471 C PTH 1 20.19 97.67 45.08 0.00 0.00
472
+ ATOM 472 C PTH 1 20.19 97.67 46.08 0.00 0.00
473
+ ATOM 473 C PTH 1 20.19 97.67 47.08 0.00 0.00
474
+ ATOM 474 C PTH 1 20.19 97.67 48.08 0.00 0.00
475
+ ATOM 475 C PTH 1 20.19 97.67 49.08 0.00 0.00
476
+ ATOM 476 C PTH 1 20.19 97.67 50.08 0.00 0.00
477
+ ATOM 477 C PTH 1 20.19 97.67 51.08 0.00 0.00
478
+ ATOM 478 C PTH 1 20.19 97.67 52.08 0.00 0.00
479
+ ATOM 479 C PTH 1 20.19 98.67 44.08 0.00 0.00
480
+ ATOM 480 C PTH 1 20.19 98.67 45.08 0.00 0.00
481
+ ATOM 481 C PTH 1 20.19 98.67 46.08 0.00 0.00
482
+ ATOM 482 C PTH 1 20.19 98.67 47.08 0.00 0.00
483
+ ATOM 483 C PTH 1 20.19 98.67 48.08 0.00 0.00
484
+ ATOM 484 C PTH 1 20.19 98.67 49.08 0.00 0.00
485
+ ATOM 485 C PTH 1 20.19 98.67 50.08 0.00 0.00
486
+ ATOM 486 C PTH 1 20.19 98.67 51.08 0.00 0.00
487
+ ATOM 487 C PTH 1 20.19 98.67 52.08 0.00 0.00
488
+ ATOM 488 C PTH 1 20.19 99.67 44.08 0.00 0.00
489
+ ATOM 489 C PTH 1 20.19 99.67 45.08 0.00 0.00
490
+ ATOM 490 C PTH 1 20.19 99.67 46.08 0.00 0.00
491
+ ATOM 491 C PTH 1 20.19 99.67 47.08 0.00 0.00
492
+ ATOM 492 C PTH 1 20.19 99.67 48.08 0.00 0.00
493
+ ATOM 493 C PTH 1 20.19 99.67 49.08 0.00 0.00
494
+ ATOM 494 C PTH 1 20.19 99.67 50.08 0.00 0.00
495
+ ATOM 495 C PTH 1 20.19 99.67 51.08 0.00 0.00
496
+ ATOM 496 C PTH 1 20.19 99.67 52.08 0.00 0.00
497
+ ATOM 497 C PTH 1 20.19 100.67 45.08 0.00 0.00
498
+ ATOM 498 C PTH 1 20.19 100.67 46.08 0.00 0.00
499
+ ATOM 499 C PTH 1 20.19 100.67 47.08 0.00 0.00
500
+ ATOM 500 C PTH 1 20.19 100.67 48.08 0.00 0.00
501
+ ATOM 501 C PTH 1 20.19 100.67 49.08 0.00 0.00
502
+ ATOM 502 C PTH 1 20.19 100.67 50.08 0.00 0.00
503
+ ATOM 503 C PTH 1 20.19 100.67 51.08 0.00 0.00
504
+ ATOM 504 C PTH 1 20.19 100.67 52.08 0.00 0.00
505
+ ATOM 505 C PTH 1 21.19 95.67 43.08 0.00 0.00
506
+ ATOM 506 C PTH 1 21.19 95.67 44.08 0.00 0.00
507
+ ATOM 507 C PTH 1 21.19 95.67 45.08 0.00 0.00
508
+ ATOM 508 C PTH 1 21.19 95.67 46.08 0.00 0.00
509
+ ATOM 509 C PTH 1 21.19 95.67 47.08 0.00 0.00
510
+ ATOM 510 C PTH 1 21.19 95.67 48.08 0.00 0.00
511
+ ATOM 511 C PTH 1 21.19 96.67 43.08 0.00 0.00
512
+ ATOM 512 C PTH 1 21.19 96.67 44.08 0.00 0.00
513
+ ATOM 513 C PTH 1 21.19 96.67 45.08 0.00 0.00
514
+ ATOM 514 C PTH 1 21.19 96.67 46.08 0.00 0.00
515
+ ATOM 515 C PTH 1 21.19 96.67 47.08 0.00 0.00
516
+ ATOM 516 C PTH 1 21.19 96.67 48.08 0.00 0.00
517
+ ATOM 517 C PTH 1 21.19 96.67 49.08 0.00 0.00
518
+ ATOM 518 C PTH 1 21.19 97.67 43.08 0.00 0.00
519
+ ATOM 519 C PTH 1 21.19 97.67 44.08 0.00 0.00
520
+ ATOM 520 C PTH 1 21.19 97.67 45.08 0.00 0.00
521
+ ATOM 521 C PTH 1 21.19 97.67 46.08 0.00 0.00
522
+ ATOM 522 C PTH 1 21.19 97.67 47.08 0.00 0.00
523
+ ATOM 523 C PTH 1 21.19 97.67 48.08 0.00 0.00
524
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525
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526
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527
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528
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529
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530
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531
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532
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533
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535
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539
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540
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541
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542
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544
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545
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566
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567
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568
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569
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570
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579
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580
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581
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582
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583
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584
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585
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593
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596
+ ATOM 596 C PTH 1 23.19 99.67 48.08 0.00 0.00
data/files/A00BR/pocket_04.pdb ADDED
@@ -0,0 +1,525 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
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2
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3
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+ ATOM 197 C PTH 1 44.19 98.67 43.08 0.00 0.00
198
+ ATOM 198 C PTH 1 44.19 98.67 44.08 0.00 0.00
199
+ ATOM 199 C PTH 1 45.19 84.67 44.08 0.00 0.00
200
+ ATOM 200 C PTH 1 45.19 84.67 45.08 0.00 0.00
201
+ ATOM 201 C PTH 1 45.19 84.67 46.08 0.00 0.00
202
+ ATOM 202 C PTH 1 45.19 85.67 43.08 0.00 0.00
203
+ ATOM 203 C PTH 1 45.19 85.67 44.08 0.00 0.00
204
+ ATOM 204 C PTH 1 45.19 85.67 45.08 0.00 0.00
205
+ ATOM 205 C PTH 1 45.19 85.67 46.08 0.00 0.00
206
+ ATOM 206 C PTH 1 45.19 85.67 47.08 0.00 0.00
207
+ ATOM 207 C PTH 1 45.19 86.67 43.08 0.00 0.00
208
+ ATOM 208 C PTH 1 45.19 86.67 44.08 0.00 0.00
209
+ ATOM 209 C PTH 1 45.19 86.67 45.08 0.00 0.00
210
+ ATOM 210 C PTH 1 45.19 86.67 46.08 0.00 0.00
211
+ ATOM 211 C PTH 1 45.19 86.67 47.08 0.00 0.00
212
+ ATOM 212 C PTH 1 45.19 87.67 42.08 0.00 0.00
213
+ ATOM 213 C PTH 1 45.19 87.67 43.08 0.00 0.00
214
+ ATOM 214 C PTH 1 45.19 87.67 44.08 0.00 0.00
215
+ ATOM 215 C PTH 1 45.19 87.67 45.08 0.00 0.00
216
+ ATOM 216 C PTH 1 45.19 87.67 46.08 0.00 0.00
217
+ ATOM 217 C PTH 1 45.19 88.67 42.08 0.00 0.00
218
+ ATOM 218 C PTH 1 45.19 88.67 43.08 0.00 0.00
219
+ ATOM 219 C PTH 1 45.19 88.67 44.08 0.00 0.00
220
+ ATOM 220 C PTH 1 45.19 88.67 45.08 0.00 0.00
221
+ ATOM 221 C PTH 1 45.19 88.67 46.08 0.00 0.00
222
+ ATOM 222 C PTH 1 45.19 89.67 41.08 0.00 0.00
223
+ ATOM 223 C PTH 1 45.19 89.67 42.08 0.00 0.00
224
+ ATOM 224 C PTH 1 45.19 89.67 43.08 0.00 0.00
225
+ ATOM 225 C PTH 1 45.19 89.67 44.08 0.00 0.00
226
+ ATOM 226 C PTH 1 45.19 89.67 45.08 0.00 0.00
227
+ ATOM 227 C PTH 1 45.19 89.67 46.08 0.00 0.00
228
+ ATOM 228 C PTH 1 45.19 90.67 40.08 0.00 0.00
229
+ ATOM 229 C PTH 1 45.19 90.67 41.08 0.00 0.00
230
+ ATOM 230 C PTH 1 45.19 90.67 42.08 0.00 0.00
231
+ ATOM 231 C PTH 1 45.19 90.67 43.08 0.00 0.00
232
+ ATOM 232 C PTH 1 45.19 90.67 44.08 0.00 0.00
233
+ ATOM 233 C PTH 1 45.19 90.67 45.08 0.00 0.00
234
+ ATOM 234 C PTH 1 45.19 90.67 46.08 0.00 0.00
235
+ ATOM 235 C PTH 1 45.19 91.67 38.08 0.00 0.00
236
+ ATOM 236 C PTH 1 45.19 91.67 39.08 0.00 0.00
237
+ ATOM 237 C PTH 1 45.19 91.67 40.08 0.00 0.00
238
+ ATOM 238 C PTH 1 45.19 91.67 41.08 0.00 0.00
239
+ ATOM 239 C PTH 1 45.19 91.67 42.08 0.00 0.00
240
+ ATOM 240 C PTH 1 45.19 91.67 43.08 0.00 0.00
241
+ ATOM 241 C PTH 1 45.19 91.67 44.08 0.00 0.00
242
+ ATOM 242 C PTH 1 45.19 91.67 45.08 0.00 0.00
243
+ ATOM 243 C PTH 1 45.19 91.67 46.08 0.00 0.00
244
+ ATOM 244 C PTH 1 45.19 92.67 38.08 0.00 0.00
245
+ ATOM 245 C PTH 1 45.19 92.67 39.08 0.00 0.00
246
+ ATOM 246 C PTH 1 45.19 92.67 40.08 0.00 0.00
247
+ ATOM 247 C PTH 1 45.19 92.67 41.08 0.00 0.00
248
+ ATOM 248 C PTH 1 45.19 92.67 42.08 0.00 0.00
249
+ ATOM 249 C PTH 1 45.19 92.67 43.08 0.00 0.00
250
+ ATOM 250 C PTH 1 45.19 92.67 44.08 0.00 0.00
251
+ ATOM 251 C PTH 1 45.19 92.67 45.08 0.00 0.00
252
+ ATOM 252 C PTH 1 45.19 92.67 46.08 0.00 0.00
253
+ ATOM 253 C PTH 1 45.19 93.67 37.08 0.00 0.00
254
+ ATOM 254 C PTH 1 45.19 93.67 38.08 0.00 0.00
255
+ ATOM 255 C PTH 1 45.19 93.67 39.08 0.00 0.00
256
+ ATOM 256 C PTH 1 45.19 93.67 40.08 0.00 0.00
257
+ ATOM 257 C PTH 1 45.19 93.67 41.08 0.00 0.00
258
+ ATOM 258 C PTH 1 45.19 93.67 42.08 0.00 0.00
259
+ ATOM 259 C PTH 1 45.19 93.67 43.08 0.00 0.00
260
+ ATOM 260 C PTH 1 45.19 93.67 44.08 0.00 0.00
261
+ ATOM 261 C PTH 1 45.19 93.67 45.08 0.00 0.00
262
+ ATOM 262 C PTH 1 45.19 93.67 46.08 0.00 0.00
263
+ ATOM 263 C PTH 1 45.19 94.67 37.08 0.00 0.00
264
+ ATOM 264 C PTH 1 45.19 94.67 38.08 0.00 0.00
265
+ ATOM 265 C PTH 1 45.19 94.67 39.08 0.00 0.00
266
+ ATOM 266 C PTH 1 45.19 94.67 40.08 0.00 0.00
267
+ ATOM 267 C PTH 1 45.19 94.67 41.08 0.00 0.00
268
+ ATOM 268 C PTH 1 45.19 94.67 42.08 0.00 0.00
269
+ ATOM 269 C PTH 1 45.19 94.67 43.08 0.00 0.00
270
+ ATOM 270 C PTH 1 45.19 94.67 44.08 0.00 0.00
271
+ ATOM 271 C PTH 1 45.19 94.67 45.08 0.00 0.00
272
+ ATOM 272 C PTH 1 45.19 94.67 46.08 0.00 0.00
273
+ ATOM 273 C PTH 1 45.19 95.67 37.08 0.00 0.00
274
+ ATOM 274 C PTH 1 45.19 95.67 38.08 0.00 0.00
275
+ ATOM 275 C PTH 1 45.19 95.67 39.08 0.00 0.00
276
+ ATOM 276 C PTH 1 45.19 95.67 40.08 0.00 0.00
277
+ ATOM 277 C PTH 1 45.19 95.67 41.08 0.00 0.00
278
+ ATOM 278 C PTH 1 45.19 95.67 42.08 0.00 0.00
279
+ ATOM 279 C PTH 1 45.19 95.67 43.08 0.00 0.00
280
+ ATOM 280 C PTH 1 45.19 95.67 44.08 0.00 0.00
281
+ ATOM 281 C PTH 1 45.19 95.67 45.08 0.00 0.00
282
+ ATOM 282 C PTH 1 45.19 96.67 37.08 0.00 0.00
283
+ ATOM 283 C PTH 1 45.19 96.67 38.08 0.00 0.00
284
+ ATOM 284 C PTH 1 45.19 96.67 39.08 0.00 0.00
285
+ ATOM 285 C PTH 1 45.19 96.67 40.08 0.00 0.00
286
+ ATOM 286 C PTH 1 45.19 96.67 41.08 0.00 0.00
287
+ ATOM 287 C PTH 1 45.19 96.67 42.08 0.00 0.00
288
+ ATOM 288 C PTH 1 45.19 96.67 43.08 0.00 0.00
289
+ ATOM 289 C PTH 1 45.19 96.67 44.08 0.00 0.00
290
+ ATOM 290 C PTH 1 45.19 96.67 45.08 0.00 0.00
291
+ ATOM 291 C PTH 1 45.19 97.67 38.08 0.00 0.00
292
+ ATOM 292 C PTH 1 45.19 97.67 39.08 0.00 0.00
293
+ ATOM 293 C PTH 1 45.19 97.67 40.08 0.00 0.00
294
+ ATOM 294 C PTH 1 45.19 97.67 41.08 0.00 0.00
295
+ ATOM 295 C PTH 1 45.19 97.67 42.08 0.00 0.00
296
+ ATOM 296 C PTH 1 45.19 97.67 43.08 0.00 0.00
297
+ ATOM 297 C PTH 1 45.19 98.67 40.08 0.00 0.00
298
+ ATOM 298 C PTH 1 45.19 98.67 41.08 0.00 0.00
299
+ ATOM 299 C PTH 1 45.19 98.67 42.08 0.00 0.00
300
+ ATOM 300 C PTH 1 45.19 98.67 43.08 0.00 0.00
301
+ ATOM 301 C PTH 1 46.19 83.67 46.08 0.00 0.00
302
+ ATOM 302 C PTH 1 46.19 84.67 43.08 0.00 0.00
303
+ ATOM 303 C PTH 1 46.19 84.67 44.08 0.00 0.00
304
+ ATOM 304 C PTH 1 46.19 84.67 45.08 0.00 0.00
305
+ ATOM 305 C PTH 1 46.19 84.67 46.08 0.00 0.00
306
+ ATOM 306 C PTH 1 46.19 85.67 43.08 0.00 0.00
307
+ ATOM 307 C PTH 1 46.19 85.67 44.08 0.00 0.00
308
+ ATOM 308 C PTH 1 46.19 85.67 45.08 0.00 0.00
309
+ ATOM 309 C PTH 1 46.19 85.67 46.08 0.00 0.00
310
+ ATOM 310 C PTH 1 46.19 85.67 47.08 0.00 0.00
311
+ ATOM 311 C PTH 1 46.19 86.67 43.08 0.00 0.00
312
+ ATOM 312 C PTH 1 46.19 86.67 44.08 0.00 0.00
313
+ ATOM 313 C PTH 1 46.19 86.67 45.08 0.00 0.00
314
+ ATOM 314 C PTH 1 46.19 86.67 46.08 0.00 0.00
315
+ ATOM 315 C PTH 1 46.19 86.67 47.08 0.00 0.00
316
+ ATOM 316 C PTH 1 46.19 87.67 42.08 0.00 0.00
317
+ ATOM 317 C PTH 1 46.19 87.67 43.08 0.00 0.00
318
+ ATOM 318 C PTH 1 46.19 87.67 44.08 0.00 0.00
319
+ ATOM 319 C PTH 1 46.19 87.67 45.08 0.00 0.00
320
+ ATOM 320 C PTH 1 46.19 87.67 46.08 0.00 0.00
321
+ ATOM 321 C PTH 1 46.19 87.67 47.08 0.00 0.00
322
+ ATOM 322 C PTH 1 46.19 88.67 41.08 0.00 0.00
323
+ ATOM 323 C PTH 1 46.19 88.67 42.08 0.00 0.00
324
+ ATOM 324 C PTH 1 46.19 88.67 43.08 0.00 0.00
325
+ ATOM 325 C PTH 1 46.19 88.67 44.08 0.00 0.00
326
+ ATOM 326 C PTH 1 46.19 88.67 45.08 0.00 0.00
327
+ ATOM 327 C PTH 1 46.19 88.67 46.08 0.00 0.00
328
+ ATOM 328 C PTH 1 46.19 89.67 41.08 0.00 0.00
329
+ ATOM 329 C PTH 1 46.19 89.67 42.08 0.00 0.00
330
+ ATOM 330 C PTH 1 46.19 89.67 43.08 0.00 0.00
331
+ ATOM 331 C PTH 1 46.19 89.67 44.08 0.00 0.00
332
+ ATOM 332 C PTH 1 46.19 89.67 45.08 0.00 0.00
333
+ ATOM 333 C PTH 1 46.19 89.67 46.08 0.00 0.00
334
+ ATOM 334 C PTH 1 46.19 90.67 39.08 0.00 0.00
335
+ ATOM 335 C PTH 1 46.19 90.67 40.08 0.00 0.00
336
+ ATOM 336 C PTH 1 46.19 90.67 41.08 0.00 0.00
337
+ ATOM 337 C PTH 1 46.19 90.67 42.08 0.00 0.00
338
+ ATOM 338 C PTH 1 46.19 90.67 43.08 0.00 0.00
339
+ ATOM 339 C PTH 1 46.19 90.67 44.08 0.00 0.00
340
+ ATOM 340 C PTH 1 46.19 90.67 45.08 0.00 0.00
341
+ ATOM 341 C PTH 1 46.19 91.67 38.08 0.00 0.00
342
+ ATOM 342 C PTH 1 46.19 91.67 39.08 0.00 0.00
343
+ ATOM 343 C PTH 1 46.19 91.67 40.08 0.00 0.00
344
+ ATOM 344 C PTH 1 46.19 91.67 41.08 0.00 0.00
345
+ ATOM 345 C PTH 1 46.19 91.67 42.08 0.00 0.00
346
+ ATOM 346 C PTH 1 46.19 91.67 43.08 0.00 0.00
347
+ ATOM 347 C PTH 1 46.19 91.67 44.08 0.00 0.00
348
+ ATOM 348 C PTH 1 46.19 91.67 45.08 0.00 0.00
349
+ ATOM 349 C PTH 1 46.19 92.67 38.08 0.00 0.00
350
+ ATOM 350 C PTH 1 46.19 92.67 39.08 0.00 0.00
351
+ ATOM 351 C PTH 1 46.19 92.67 40.08 0.00 0.00
352
+ ATOM 352 C PTH 1 46.19 92.67 41.08 0.00 0.00
353
+ ATOM 353 C PTH 1 46.19 92.67 42.08 0.00 0.00
354
+ ATOM 354 C PTH 1 46.19 92.67 43.08 0.00 0.00
355
+ ATOM 355 C PTH 1 46.19 92.67 44.08 0.00 0.00
356
+ ATOM 356 C PTH 1 46.19 92.67 45.08 0.00 0.00
357
+ ATOM 357 C PTH 1 46.19 93.67 38.08 0.00 0.00
358
+ ATOM 358 C PTH 1 46.19 93.67 39.08 0.00 0.00
359
+ ATOM 359 C PTH 1 46.19 93.67 40.08 0.00 0.00
360
+ ATOM 360 C PTH 1 46.19 93.67 41.08 0.00 0.00
361
+ ATOM 361 C PTH 1 46.19 93.67 42.08 0.00 0.00
362
+ ATOM 362 C PTH 1 46.19 93.67 43.08 0.00 0.00
363
+ ATOM 363 C PTH 1 46.19 93.67 44.08 0.00 0.00
364
+ ATOM 364 C PTH 1 46.19 93.67 45.08 0.00 0.00
365
+ ATOM 365 C PTH 1 46.19 94.67 37.08 0.00 0.00
366
+ ATOM 366 C PTH 1 46.19 94.67 38.08 0.00 0.00
367
+ ATOM 367 C PTH 1 46.19 94.67 39.08 0.00 0.00
368
+ ATOM 368 C PTH 1 46.19 94.67 40.08 0.00 0.00
369
+ ATOM 369 C PTH 1 46.19 94.67 41.08 0.00 0.00
370
+ ATOM 370 C PTH 1 46.19 94.67 42.08 0.00 0.00
371
+ ATOM 371 C PTH 1 46.19 94.67 43.08 0.00 0.00
372
+ ATOM 372 C PTH 1 46.19 94.67 44.08 0.00 0.00
373
+ ATOM 373 C PTH 1 46.19 95.67 37.08 0.00 0.00
374
+ ATOM 374 C PTH 1 46.19 95.67 38.08 0.00 0.00
375
+ ATOM 375 C PTH 1 46.19 95.67 39.08 0.00 0.00
376
+ ATOM 376 C PTH 1 46.19 95.67 40.08 0.00 0.00
377
+ ATOM 377 C PTH 1 46.19 95.67 41.08 0.00 0.00
378
+ ATOM 378 C PTH 1 46.19 95.67 42.08 0.00 0.00
379
+ ATOM 379 C PTH 1 46.19 95.67 43.08 0.00 0.00
380
+ ATOM 380 C PTH 1 46.19 96.67 38.08 0.00 0.00
381
+ ATOM 381 C PTH 1 46.19 96.67 39.08 0.00 0.00
382
+ ATOM 382 C PTH 1 46.19 96.67 40.08 0.00 0.00
383
+ ATOM 383 C PTH 1 46.19 96.67 41.08 0.00 0.00
384
+ ATOM 384 C PTH 1 46.19 96.67 42.08 0.00 0.00
385
+ ATOM 385 C PTH 1 46.19 96.67 43.08 0.00 0.00
386
+ ATOM 386 C PTH 1 46.19 97.67 38.08 0.00 0.00
387
+ ATOM 387 C PTH 1 46.19 97.67 39.08 0.00 0.00
388
+ ATOM 388 C PTH 1 46.19 97.67 40.08 0.00 0.00
389
+ ATOM 389 C PTH 1 46.19 97.67 41.08 0.00 0.00
390
+ ATOM 390 C PTH 1 46.19 97.67 42.08 0.00 0.00
391
+ ATOM 391 C PTH 1 46.19 98.67 40.08 0.00 0.00
392
+ ATOM 392 C PTH 1 46.19 98.67 41.08 0.00 0.00
393
+ ATOM 393 C PTH 1 47.19 84.67 43.08 0.00 0.00
394
+ ATOM 394 C PTH 1 47.19 84.67 44.08 0.00 0.00
395
+ ATOM 395 C PTH 1 47.19 84.67 45.08 0.00 0.00
396
+ ATOM 396 C PTH 1 47.19 84.67 46.08 0.00 0.00
397
+ ATOM 397 C PTH 1 47.19 85.67 43.08 0.00 0.00
398
+ ATOM 398 C PTH 1 47.19 85.67 44.08 0.00 0.00
399
+ ATOM 399 C PTH 1 47.19 85.67 45.08 0.00 0.00
400
+ ATOM 400 C PTH 1 47.19 85.67 46.08 0.00 0.00
401
+ ATOM 401 C PTH 1 47.19 85.67 47.08 0.00 0.00
402
+ ATOM 402 C PTH 1 47.19 86.67 43.08 0.00 0.00
403
+ ATOM 403 C PTH 1 47.19 86.67 44.08 0.00 0.00
404
+ ATOM 404 C PTH 1 47.19 86.67 45.08 0.00 0.00
405
+ ATOM 405 C PTH 1 47.19 86.67 46.08 0.00 0.00
406
+ ATOM 406 C PTH 1 47.19 86.67 47.08 0.00 0.00
407
+ ATOM 407 C PTH 1 47.19 87.67 42.08 0.00 0.00
408
+ ATOM 408 C PTH 1 47.19 87.67 43.08 0.00 0.00
409
+ ATOM 409 C PTH 1 47.19 87.67 44.08 0.00 0.00
410
+ ATOM 410 C PTH 1 47.19 87.67 45.08 0.00 0.00
411
+ ATOM 411 C PTH 1 47.19 87.67 46.08 0.00 0.00
412
+ ATOM 412 C PTH 1 47.19 87.67 47.08 0.00 0.00
413
+ ATOM 413 C PTH 1 47.19 88.67 42.08 0.00 0.00
414
+ ATOM 414 C PTH 1 47.19 88.67 43.08 0.00 0.00
415
+ ATOM 415 C PTH 1 47.19 88.67 44.08 0.00 0.00
416
+ ATOM 416 C PTH 1 47.19 88.67 45.08 0.00 0.00
417
+ ATOM 417 C PTH 1 47.19 88.67 46.08 0.00 0.00
418
+ ATOM 418 C PTH 1 47.19 88.67 47.08 0.00 0.00
419
+ ATOM 419 C PTH 1 47.19 89.67 41.08 0.00 0.00
420
+ ATOM 420 C PTH 1 47.19 89.67 42.08 0.00 0.00
421
+ ATOM 421 C PTH 1 47.19 89.67 43.08 0.00 0.00
422
+ ATOM 422 C PTH 1 47.19 89.67 44.08 0.00 0.00
423
+ ATOM 423 C PTH 1 47.19 89.67 45.08 0.00 0.00
424
+ ATOM 424 C PTH 1 47.19 89.67 46.08 0.00 0.00
425
+ ATOM 425 C PTH 1 47.19 90.67 41.08 0.00 0.00
426
+ ATOM 426 C PTH 1 47.19 90.67 42.08 0.00 0.00
427
+ ATOM 427 C PTH 1 47.19 90.67 43.08 0.00 0.00
428
+ ATOM 428 C PTH 1 47.19 90.67 44.08 0.00 0.00
429
+ ATOM 429 C PTH 1 47.19 90.67 45.08 0.00 0.00
430
+ ATOM 430 C PTH 1 47.19 91.67 39.08 0.00 0.00
431
+ ATOM 431 C PTH 1 47.19 91.67 40.08 0.00 0.00
432
+ ATOM 432 C PTH 1 47.19 91.67 41.08 0.00 0.00
433
+ ATOM 433 C PTH 1 47.19 91.67 42.08 0.00 0.00
434
+ ATOM 434 C PTH 1 47.19 91.67 43.08 0.00 0.00
435
+ ATOM 435 C PTH 1 47.19 91.67 44.08 0.00 0.00
436
+ ATOM 436 C PTH 1 47.19 91.67 45.08 0.00 0.00
437
+ ATOM 437 C PTH 1 47.19 92.67 39.08 0.00 0.00
438
+ ATOM 438 C PTH 1 47.19 92.67 40.08 0.00 0.00
439
+ ATOM 439 C PTH 1 47.19 92.67 41.08 0.00 0.00
440
+ ATOM 440 C PTH 1 47.19 92.67 42.08 0.00 0.00
441
+ ATOM 441 C PTH 1 47.19 92.67 43.08 0.00 0.00
442
+ ATOM 442 C PTH 1 47.19 92.67 44.08 0.00 0.00
443
+ ATOM 443 C PTH 1 47.19 92.67 45.08 0.00 0.00
444
+ ATOM 444 C PTH 1 47.19 93.67 39.08 0.00 0.00
445
+ ATOM 445 C PTH 1 47.19 93.67 40.08 0.00 0.00
446
+ ATOM 446 C PTH 1 47.19 93.67 41.08 0.00 0.00
447
+ ATOM 447 C PTH 1 47.19 93.67 42.08 0.00 0.00
448
+ ATOM 448 C PTH 1 47.19 93.67 43.08 0.00 0.00
449
+ ATOM 449 C PTH 1 47.19 93.67 44.08 0.00 0.00
450
+ ATOM 450 C PTH 1 47.19 94.67 39.08 0.00 0.00
451
+ ATOM 451 C PTH 1 47.19 94.67 40.08 0.00 0.00
452
+ ATOM 452 C PTH 1 47.19 94.67 41.08 0.00 0.00
453
+ ATOM 453 C PTH 1 47.19 94.67 42.08 0.00 0.00
454
+ ATOM 454 C PTH 1 47.19 94.67 43.08 0.00 0.00
455
+ ATOM 455 C PTH 1 47.19 95.67 39.08 0.00 0.00
456
+ ATOM 456 C PTH 1 47.19 95.67 40.08 0.00 0.00
457
+ ATOM 457 C PTH 1 47.19 95.67 41.08 0.00 0.00
458
+ ATOM 458 C PTH 1 47.19 95.67 42.08 0.00 0.00
459
+ ATOM 459 C PTH 1 47.19 96.67 39.08 0.00 0.00
460
+ ATOM 460 C PTH 1 47.19 96.67 40.08 0.00 0.00
461
+ ATOM 461 C PTH 1 47.19 96.67 41.08 0.00 0.00
462
+ ATOM 462 C PTH 1 47.19 96.67 42.08 0.00 0.00
463
+ ATOM 463 C PTH 1 47.19 97.67 39.08 0.00 0.00
464
+ ATOM 464 C PTH 1 47.19 97.67 40.08 0.00 0.00
465
+ ATOM 465 C PTH 1 47.19 97.67 41.08 0.00 0.00
466
+ ATOM 466 C PTH 1 47.19 97.67 42.08 0.00 0.00
467
+ ATOM 467 C PTH 1 47.19 98.67 40.08 0.00 0.00
468
+ ATOM 468 C PTH 1 47.19 98.67 41.08 0.00 0.00
469
+ ATOM 469 C PTH 1 48.19 84.67 44.08 0.00 0.00
470
+ ATOM 470 C PTH 1 48.19 84.67 45.08 0.00 0.00
471
+ ATOM 471 C PTH 1 48.19 85.67 44.08 0.00 0.00
472
+ ATOM 472 C PTH 1 48.19 85.67 45.08 0.00 0.00
473
+ ATOM 473 C PTH 1 48.19 85.67 46.08 0.00 0.00
474
+ ATOM 474 C PTH 1 48.19 86.67 43.08 0.00 0.00
475
+ ATOM 475 C PTH 1 48.19 86.67 44.08 0.00 0.00
476
+ ATOM 476 C PTH 1 48.19 86.67 45.08 0.00 0.00
477
+ ATOM 477 C PTH 1 48.19 86.67 46.08 0.00 0.00
478
+ ATOM 478 C PTH 1 48.19 86.67 47.08 0.00 0.00
479
+ ATOM 479 C PTH 1 48.19 87.67 43.08 0.00 0.00
480
+ ATOM 480 C PTH 1 48.19 87.67 44.08 0.00 0.00
481
+ ATOM 481 C PTH 1 48.19 87.67 45.08 0.00 0.00
482
+ ATOM 482 C PTH 1 48.19 87.67 46.08 0.00 0.00
483
+ ATOM 483 C PTH 1 48.19 87.67 47.08 0.00 0.00
484
+ ATOM 484 C PTH 1 48.19 88.67 43.08 0.00 0.00
485
+ ATOM 485 C PTH 1 48.19 88.67 44.08 0.00 0.00
486
+ ATOM 486 C PTH 1 48.19 88.67 45.08 0.00 0.00
487
+ ATOM 487 C PTH 1 48.19 88.67 46.08 0.00 0.00
488
+ ATOM 488 C PTH 1 48.19 89.67 42.08 0.00 0.00
489
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490
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491
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492
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493
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494
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495
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496
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497
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498
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499
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500
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501
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502
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503
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504
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505
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506
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507
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508
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509
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510
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511
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512
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513
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514
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515
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516
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517
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518
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519
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520
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521
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522
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523
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524
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525
+ ATOM 525 C PTH 1 49.19 90.67 45.08 0.00 0.00
data/files/A00BR/pocket_05.pdb ADDED
@@ -0,0 +1,278 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 13.19 96.67 26.08 0.00 0.00
2
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3
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4
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7
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9
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12
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14
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15
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16
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17
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18
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19
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30
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31
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51
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53
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71
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81
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83
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91
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92
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93
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94
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95
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96
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97
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98
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99
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100
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101
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102
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103
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106
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107
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110
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111
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112
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115
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141
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147
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148
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151
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157
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158
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159
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160
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161
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163
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166
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167
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168
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169
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170
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172
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174
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176
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177
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179
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180
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185
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187
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188
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189
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191
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192
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195
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215
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219
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224
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226
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227
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231
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232
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233
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234
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235
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236
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237
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238
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239
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240
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241
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242
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243
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+ ATOM 278 C PTH 1 21.19 101.67 29.08 0.00 0.00
data/files/A00BR/pocket_06.pdb ADDED
@@ -0,0 +1,222 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 16.19 108.67 38.08 0.00 0.00
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data/files/A00BR/pocket_07.pdb ADDED
@@ -0,0 +1,180 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 42.19 80.67 60.08 0.00 0.00
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18
+ ATOM 18 C PTH 1 42.19 85.67 60.08 0.00 0.00
19
+ ATOM 19 C PTH 1 43.19 79.67 59.08 0.00 0.00
20
+ ATOM 20 C PTH 1 43.19 79.67 60.08 0.00 0.00
21
+ ATOM 21 C PTH 1 43.19 80.67 58.08 0.00 0.00
22
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23
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24
+ ATOM 24 C PTH 1 43.19 80.67 61.08 0.00 0.00
25
+ ATOM 25 C PTH 1 43.19 81.67 58.08 0.00 0.00
26
+ ATOM 26 C PTH 1 43.19 81.67 59.08 0.00 0.00
27
+ ATOM 27 C PTH 1 43.19 81.67 60.08 0.00 0.00
28
+ ATOM 28 C PTH 1 43.19 81.67 61.08 0.00 0.00
29
+ ATOM 29 C PTH 1 43.19 81.67 62.08 0.00 0.00
30
+ ATOM 30 C PTH 1 43.19 82.67 58.08 0.00 0.00
31
+ ATOM 31 C PTH 1 43.19 82.67 59.08 0.00 0.00
32
+ ATOM 32 C PTH 1 43.19 82.67 60.08 0.00 0.00
33
+ ATOM 33 C PTH 1 43.19 82.67 61.08 0.00 0.00
34
+ ATOM 34 C PTH 1 43.19 82.67 62.08 0.00 0.00
35
+ ATOM 35 C PTH 1 43.19 82.67 63.08 0.00 0.00
36
+ ATOM 36 C PTH 1 43.19 83.67 58.08 0.00 0.00
37
+ ATOM 37 C PTH 1 43.19 83.67 59.08 0.00 0.00
38
+ ATOM 38 C PTH 1 43.19 83.67 60.08 0.00 0.00
39
+ ATOM 39 C PTH 1 43.19 83.67 61.08 0.00 0.00
40
+ ATOM 40 C PTH 1 43.19 83.67 62.08 0.00 0.00
41
+ ATOM 41 C PTH 1 43.19 83.67 63.08 0.00 0.00
42
+ ATOM 42 C PTH 1 43.19 84.67 58.08 0.00 0.00
43
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44
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45
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46
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47
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48
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49
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50
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51
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52
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53
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54
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55
+ ATOM 55 C PTH 1 44.19 79.67 58.08 0.00 0.00
56
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57
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58
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59
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60
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61
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62
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63
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64
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65
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66
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67
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68
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69
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70
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71
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72
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73
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74
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75
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76
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77
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78
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79
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80
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81
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82
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83
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84
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85
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86
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87
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88
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89
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90
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91
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93
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95
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99
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100
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105
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108
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111
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113
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114
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117
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118
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119
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120
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122
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125
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126
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131
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135
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136
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137
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138
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139
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140
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141
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148
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149
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150
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151
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152
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153
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154
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155
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156
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157
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158
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159
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160
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161
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162
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163
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164
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165
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166
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167
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168
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169
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170
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171
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172
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173
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174
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175
+ ATOM 175 C PTH 1 47.19 81.67 59.08 0.00 0.00
176
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177
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178
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+ ATOM 179 C PTH 1 47.19 82.67 60.08 0.00 0.00
180
+ ATOM 180 C PTH 1 47.19 82.67 61.08 0.00 0.00
data/files/A00BR/pocket_08.pdb ADDED
@@ -0,0 +1,115 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 13.19 101.67 52.08 0.00 0.00
2
+ ATOM 2 C PTH 1 13.19 102.67 52.08 0.00 0.00
3
+ ATOM 3 C PTH 1 13.19 102.67 53.08 0.00 0.00
4
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5
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6
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7
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8
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9
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12
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13
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14
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15
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16
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17
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18
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19
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21
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22
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23
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27
+ ATOM 27 C PTH 1 14.19 101.67 52.08 0.00 0.00
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31
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51
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53
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67
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68
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86
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88
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89
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90
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91
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92
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93
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94
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95
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96
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97
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98
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99
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100
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101
+ ATOM 101 C PTH 1 16.19 104.67 52.08 0.00 0.00
102
+ ATOM 102 C PTH 1 16.19 104.67 53.08 0.00 0.00
103
+ ATOM 103 C PTH 1 16.19 104.67 54.08 0.00 0.00
104
+ ATOM 104 C PTH 1 16.19 105.67 53.08 0.00 0.00
105
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106
+ ATOM 106 C PTH 1 17.19 101.67 51.08 0.00 0.00
107
+ ATOM 107 C PTH 1 17.19 101.67 52.08 0.00 0.00
108
+ ATOM 108 C PTH 1 17.19 101.67 53.08 0.00 0.00
109
+ ATOM 109 C PTH 1 17.19 102.67 51.08 0.00 0.00
110
+ ATOM 110 C PTH 1 17.19 102.67 52.08 0.00 0.00
111
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112
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113
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114
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115
+ ATOM 115 C PTH 1 17.19 103.67 54.08 0.00 0.00
data/files/A00BR/pocket_09.pdb ADDED
@@ -0,0 +1,39 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 15.19 108.67 40.08 0.00 0.00
2
+ ATOM 2 C PTH 1 15.19 109.67 40.08 0.00 0.00
3
+ ATOM 3 C PTH 1 15.19 109.67 42.08 0.00 0.00
4
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5
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6
+ ATOM 6 C PTH 1 15.19 110.67 43.08 0.00 0.00
7
+ ATOM 7 C PTH 1 15.19 110.67 44.08 0.00 0.00
8
+ ATOM 8 C PTH 1 15.19 111.67 43.08 0.00 0.00
9
+ ATOM 9 C PTH 1 15.19 111.67 44.08 0.00 0.00
10
+ ATOM 10 C PTH 1 16.19 109.67 43.08 0.00 0.00
11
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12
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13
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14
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16
+ ATOM 16 C PTH 1 16.19 111.67 43.08 0.00 0.00
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24
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25
+ ATOM 25 C PTH 1 17.19 111.67 43.08 0.00 0.00
26
+ ATOM 26 C PTH 1 17.19 111.67 44.08 0.00 0.00
27
+ ATOM 27 C PTH 1 17.19 111.67 45.08 0.00 0.00
28
+ ATOM 28 C PTH 1 17.19 112.67 43.08 0.00 0.00
29
+ ATOM 29 C PTH 1 17.19 112.67 44.08 0.00 0.00
30
+ ATOM 30 C PTH 1 18.19 109.67 43.08 0.00 0.00
31
+ ATOM 31 C PTH 1 18.19 109.67 44.08 0.00 0.00
32
+ ATOM 32 C PTH 1 18.19 110.67 43.08 0.00 0.00
33
+ ATOM 33 C PTH 1 18.19 110.67 44.08 0.00 0.00
34
+ ATOM 34 C PTH 1 18.19 111.67 43.08 0.00 0.00
35
+ ATOM 35 C PTH 1 18.19 111.67 44.08 0.00 0.00
36
+ ATOM 36 C PTH 1 18.19 112.67 43.08 0.00 0.00
37
+ ATOM 37 C PTH 1 18.19 112.67 44.08 0.00 0.00
38
+ ATOM 38 C PTH 1 19.19 111.67 43.08 0.00 0.00
39
+ ATOM 39 C PTH 1 19.19 112.67 43.08 0.00 0.00
data/files/A00BR/structure.pdb ADDED
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data/files/A00BV/pocket_01.pdb ADDED
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1
+ ATOM 1 C PTH 1 114.24 81.17 54.87 0.00 0.00
2
+ ATOM 2 C PTH 1 114.24 81.17 55.87 0.00 0.00
3
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154
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157
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158
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160
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169
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171
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176
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177
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180
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188
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189
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209
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211
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212
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213
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214
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215
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216
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217
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218
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219
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220
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221
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222
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223
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224
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225
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226
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227
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228
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229
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230
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231
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232
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233
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234
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235
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236
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237
+ ATOM 237 C PTH 1 119.24 87.17 49.87 0.00 0.00
238
+ ATOM 238 C PTH 1 119.24 87.17 50.87 0.00 0.00
239
+ ATOM 239 C PTH 1 119.24 87.17 51.87 0.00 0.00
240
+ ATOM 240 C PTH 1 119.24 87.17 52.87 0.00 0.00
241
+ ATOM 241 C PTH 1 119.24 87.17 53.87 0.00 0.00
242
+ ATOM 242 C PTH 1 119.24 87.17 54.87 0.00 0.00
243
+ ATOM 243 C PTH 1 119.24 87.17 55.87 0.00 0.00
244
+ ATOM 244 C PTH 1 119.24 87.17 56.87 0.00 0.00
245
+ ATOM 245 C PTH 1 119.24 88.17 46.87 0.00 0.00
246
+ ATOM 246 C PTH 1 119.24 88.17 47.87 0.00 0.00
247
+ ATOM 247 C PTH 1 119.24 88.17 48.87 0.00 0.00
248
+ ATOM 248 C PTH 1 119.24 88.17 49.87 0.00 0.00
249
+ ATOM 249 C PTH 1 119.24 88.17 50.87 0.00 0.00
250
+ ATOM 250 C PTH 1 119.24 88.17 51.87 0.00 0.00
251
+ ATOM 251 C PTH 1 119.24 88.17 52.87 0.00 0.00
252
+ ATOM 252 C PTH 1 119.24 88.17 53.87 0.00 0.00
253
+ ATOM 253 C PTH 1 119.24 89.17 48.87 0.00 0.00
254
+ ATOM 254 C PTH 1 119.24 89.17 49.87 0.00 0.00
255
+ ATOM 255 C PTH 1 119.24 89.17 50.87 0.00 0.00
256
+ ATOM 256 C PTH 1 119.24 89.17 51.87 0.00 0.00
257
+ ATOM 257 C PTH 1 119.24 89.17 52.87 0.00 0.00
258
+ ATOM 258 C PTH 1 119.24 89.17 53.87 0.00 0.00
259
+ ATOM 259 C PTH 1 119.24 90.17 50.87 0.00 0.00
260
+ ATOM 260 C PTH 1 119.24 90.17 51.87 0.00 0.00
261
+ ATOM 261 C PTH 1 119.24 90.17 52.87 0.00 0.00
262
+ ATOM 262 C PTH 1 119.24 90.17 53.87 0.00 0.00
263
+ ATOM 263 C PTH 1 119.24 91.17 51.87 0.00 0.00
264
+ ATOM 264 C PTH 1 119.24 91.17 52.87 0.00 0.00
265
+ ATOM 265 C PTH 1 119.24 91.17 53.87 0.00 0.00
266
+ ATOM 266 C PTH 1 119.24 91.17 54.87 0.00 0.00
267
+ ATOM 267 C PTH 1 119.24 92.17 51.87 0.00 0.00
268
+ ATOM 268 C PTH 1 119.24 92.17 52.87 0.00 0.00
269
+ ATOM 269 C PTH 1 119.24 92.17 53.87 0.00 0.00
270
+ ATOM 270 C PTH 1 119.24 92.17 54.87 0.00 0.00
271
+ ATOM 271 C PTH 1 120.24 84.17 45.87 0.00 0.00
272
+ ATOM 272 C PTH 1 120.24 84.17 46.87 0.00 0.00
273
+ ATOM 273 C PTH 1 120.24 84.17 47.87 0.00 0.00
274
+ ATOM 274 C PTH 1 120.24 84.17 48.87 0.00 0.00
275
+ ATOM 275 C PTH 1 120.24 84.17 51.87 0.00 0.00
276
+ ATOM 276 C PTH 1 120.24 84.17 52.87 0.00 0.00
277
+ ATOM 277 C PTH 1 120.24 84.17 53.87 0.00 0.00
278
+ ATOM 278 C PTH 1 120.24 84.17 54.87 0.00 0.00
279
+ ATOM 279 C PTH 1 120.24 84.17 55.87 0.00 0.00
280
+ ATOM 280 C PTH 1 120.24 84.17 56.87 0.00 0.00
281
+ ATOM 281 C PTH 1 120.24 85.17 44.87 0.00 0.00
282
+ ATOM 282 C PTH 1 120.24 85.17 45.87 0.00 0.00
283
+ ATOM 283 C PTH 1 120.24 85.17 46.87 0.00 0.00
284
+ ATOM 284 C PTH 1 120.24 85.17 47.87 0.00 0.00
285
+ ATOM 285 C PTH 1 120.24 85.17 48.87 0.00 0.00
286
+ ATOM 286 C PTH 1 120.24 85.17 49.87 0.00 0.00
287
+ ATOM 287 C PTH 1 120.24 85.17 50.87 0.00 0.00
288
+ ATOM 288 C PTH 1 120.24 85.17 51.87 0.00 0.00
289
+ ATOM 289 C PTH 1 120.24 85.17 52.87 0.00 0.00
290
+ ATOM 290 C PTH 1 120.24 85.17 53.87 0.00 0.00
291
+ ATOM 291 C PTH 1 120.24 85.17 54.87 0.00 0.00
292
+ ATOM 292 C PTH 1 120.24 85.17 55.87 0.00 0.00
293
+ ATOM 293 C PTH 1 120.24 85.17 56.87 0.00 0.00
294
+ ATOM 294 C PTH 1 120.24 86.17 45.87 0.00 0.00
295
+ ATOM 295 C PTH 1 120.24 86.17 46.87 0.00 0.00
296
+ ATOM 296 C PTH 1 120.24 86.17 47.87 0.00 0.00
297
+ ATOM 297 C PTH 1 120.24 86.17 48.87 0.00 0.00
298
+ ATOM 298 C PTH 1 120.24 86.17 49.87 0.00 0.00
299
+ ATOM 299 C PTH 1 120.24 86.17 50.87 0.00 0.00
300
+ ATOM 300 C PTH 1 120.24 86.17 51.87 0.00 0.00
301
+ ATOM 301 C PTH 1 120.24 86.17 52.87 0.00 0.00
302
+ ATOM 302 C PTH 1 120.24 86.17 53.87 0.00 0.00
303
+ ATOM 303 C PTH 1 120.24 86.17 54.87 0.00 0.00
304
+ ATOM 304 C PTH 1 120.24 86.17 55.87 0.00 0.00
305
+ ATOM 305 C PTH 1 120.24 87.17 45.87 0.00 0.00
306
+ ATOM 306 C PTH 1 120.24 87.17 46.87 0.00 0.00
307
+ ATOM 307 C PTH 1 120.24 87.17 47.87 0.00 0.00
308
+ ATOM 308 C PTH 1 120.24 87.17 48.87 0.00 0.00
309
+ ATOM 309 C PTH 1 120.24 87.17 49.87 0.00 0.00
310
+ ATOM 310 C PTH 1 120.24 87.17 50.87 0.00 0.00
311
+ ATOM 311 C PTH 1 120.24 87.17 51.87 0.00 0.00
312
+ ATOM 312 C PTH 1 120.24 87.17 52.87 0.00 0.00
313
+ ATOM 313 C PTH 1 120.24 87.17 53.87 0.00 0.00
314
+ ATOM 314 C PTH 1 120.24 87.17 54.87 0.00 0.00
315
+ ATOM 315 C PTH 1 120.24 88.17 45.87 0.00 0.00
316
+ ATOM 316 C PTH 1 120.24 88.17 46.87 0.00 0.00
317
+ ATOM 317 C PTH 1 120.24 88.17 47.87 0.00 0.00
318
+ ATOM 318 C PTH 1 120.24 88.17 48.87 0.00 0.00
319
+ ATOM 319 C PTH 1 120.24 88.17 49.87 0.00 0.00
320
+ ATOM 320 C PTH 1 120.24 88.17 50.87 0.00 0.00
321
+ ATOM 321 C PTH 1 120.24 88.17 51.87 0.00 0.00
322
+ ATOM 322 C PTH 1 120.24 88.17 52.87 0.00 0.00
323
+ ATOM 323 C PTH 1 120.24 88.17 53.87 0.00 0.00
324
+ ATOM 324 C PTH 1 120.24 89.17 47.87 0.00 0.00
325
+ ATOM 325 C PTH 1 120.24 89.17 48.87 0.00 0.00
326
+ ATOM 326 C PTH 1 120.24 89.17 49.87 0.00 0.00
327
+ ATOM 327 C PTH 1 120.24 89.17 50.87 0.00 0.00
328
+ ATOM 328 C PTH 1 120.24 89.17 51.87 0.00 0.00
329
+ ATOM 329 C PTH 1 120.24 89.17 52.87 0.00 0.00
330
+ ATOM 330 C PTH 1 120.24 89.17 53.87 0.00 0.00
331
+ ATOM 331 C PTH 1 120.24 90.17 50.87 0.00 0.00
332
+ ATOM 332 C PTH 1 120.24 90.17 51.87 0.00 0.00
333
+ ATOM 333 C PTH 1 120.24 90.17 52.87 0.00 0.00
334
+ ATOM 334 C PTH 1 120.24 90.17 53.87 0.00 0.00
335
+ ATOM 335 C PTH 1 120.24 91.17 51.87 0.00 0.00
336
+ ATOM 336 C PTH 1 120.24 91.17 52.87 0.00 0.00
337
+ ATOM 337 C PTH 1 120.24 91.17 53.87 0.00 0.00
338
+ ATOM 338 C PTH 1 120.24 92.17 51.87 0.00 0.00
339
+ ATOM 339 C PTH 1 120.24 92.17 52.87 0.00 0.00
340
+ ATOM 340 C PTH 1 120.24 92.17 53.87 0.00 0.00
341
+ ATOM 341 C PTH 1 120.24 92.17 54.87 0.00 0.00
342
+ ATOM 342 C PTH 1 121.24 84.17 45.87 0.00 0.00
343
+ ATOM 343 C PTH 1 121.24 84.17 46.87 0.00 0.00
344
+ ATOM 344 C PTH 1 121.24 84.17 47.87 0.00 0.00
345
+ ATOM 345 C PTH 1 121.24 85.17 44.87 0.00 0.00
346
+ ATOM 346 C PTH 1 121.24 85.17 45.87 0.00 0.00
347
+ ATOM 347 C PTH 1 121.24 85.17 46.87 0.00 0.00
348
+ ATOM 348 C PTH 1 121.24 85.17 47.87 0.00 0.00
349
+ ATOM 349 C PTH 1 121.24 85.17 48.87 0.00 0.00
350
+ ATOM 350 C PTH 1 121.24 85.17 49.87 0.00 0.00
351
+ ATOM 351 C PTH 1 121.24 85.17 50.87 0.00 0.00
352
+ ATOM 352 C PTH 1 121.24 86.17 45.87 0.00 0.00
353
+ ATOM 353 C PTH 1 121.24 86.17 46.87 0.00 0.00
354
+ ATOM 354 C PTH 1 121.24 86.17 47.87 0.00 0.00
355
+ ATOM 355 C PTH 1 121.24 86.17 48.87 0.00 0.00
356
+ ATOM 356 C PTH 1 121.24 86.17 49.87 0.00 0.00
357
+ ATOM 357 C PTH 1 121.24 86.17 50.87 0.00 0.00
358
+ ATOM 358 C PTH 1 121.24 86.17 51.87 0.00 0.00
359
+ ATOM 359 C PTH 1 121.24 86.17 52.87 0.00 0.00
360
+ ATOM 360 C PTH 1 121.24 87.17 45.87 0.00 0.00
361
+ ATOM 361 C PTH 1 121.24 87.17 46.87 0.00 0.00
362
+ ATOM 362 C PTH 1 121.24 87.17 47.87 0.00 0.00
363
+ ATOM 363 C PTH 1 121.24 87.17 48.87 0.00 0.00
364
+ ATOM 364 C PTH 1 121.24 87.17 49.87 0.00 0.00
365
+ ATOM 365 C PTH 1 121.24 87.17 50.87 0.00 0.00
366
+ ATOM 366 C PTH 1 121.24 87.17 51.87 0.00 0.00
367
+ ATOM 367 C PTH 1 121.24 87.17 52.87 0.00 0.00
368
+ ATOM 368 C PTH 1 121.24 88.17 45.87 0.00 0.00
369
+ ATOM 369 C PTH 1 121.24 88.17 46.87 0.00 0.00
370
+ ATOM 370 C PTH 1 121.24 88.17 47.87 0.00 0.00
371
+ ATOM 371 C PTH 1 121.24 88.17 48.87 0.00 0.00
372
+ ATOM 372 C PTH 1 121.24 88.17 49.87 0.00 0.00
373
+ ATOM 373 C PTH 1 121.24 88.17 50.87 0.00 0.00
374
+ ATOM 374 C PTH 1 121.24 88.17 51.87 0.00 0.00
375
+ ATOM 375 C PTH 1 121.24 88.17 52.87 0.00 0.00
376
+ ATOM 376 C PTH 1 121.24 89.17 47.87 0.00 0.00
377
+ ATOM 377 C PTH 1 121.24 89.17 48.87 0.00 0.00
378
+ ATOM 378 C PTH 1 121.24 89.17 49.87 0.00 0.00
379
+ ATOM 379 C PTH 1 121.24 89.17 50.87 0.00 0.00
380
+ ATOM 380 C PTH 1 121.24 89.17 51.87 0.00 0.00
381
+ ATOM 381 C PTH 1 121.24 89.17 52.87 0.00 0.00
382
+ ATOM 382 C PTH 1 121.24 89.17 53.87 0.00 0.00
383
+ ATOM 383 C PTH 1 121.24 90.17 51.87 0.00 0.00
384
+ ATOM 384 C PTH 1 121.24 90.17 52.87 0.00 0.00
385
+ ATOM 385 C PTH 1 121.24 90.17 53.87 0.00 0.00
386
+ ATOM 386 C PTH 1 121.24 91.17 51.87 0.00 0.00
387
+ ATOM 387 C PTH 1 121.24 91.17 52.87 0.00 0.00
388
+ ATOM 388 C PTH 1 121.24 91.17 53.87 0.00 0.00
389
+ ATOM 389 C PTH 1 121.24 92.17 53.87 0.00 0.00
390
+ ATOM 390 C PTH 1 122.24 84.17 44.87 0.00 0.00
391
+ ATOM 391 C PTH 1 122.24 84.17 45.87 0.00 0.00
392
+ ATOM 392 C PTH 1 122.24 84.17 46.87 0.00 0.00
393
+ ATOM 393 C PTH 1 122.24 84.17 47.87 0.00 0.00
394
+ ATOM 394 C PTH 1 122.24 85.17 44.87 0.00 0.00
395
+ ATOM 395 C PTH 1 122.24 85.17 45.87 0.00 0.00
396
+ ATOM 396 C PTH 1 122.24 85.17 46.87 0.00 0.00
397
+ ATOM 397 C PTH 1 122.24 85.17 47.87 0.00 0.00
398
+ ATOM 398 C PTH 1 122.24 85.17 48.87 0.00 0.00
399
+ ATOM 399 C PTH 1 122.24 86.17 44.87 0.00 0.00
400
+ ATOM 400 C PTH 1 122.24 86.17 45.87 0.00 0.00
401
+ ATOM 401 C PTH 1 122.24 86.17 46.87 0.00 0.00
402
+ ATOM 402 C PTH 1 122.24 86.17 47.87 0.00 0.00
403
+ ATOM 403 C PTH 1 122.24 86.17 48.87 0.00 0.00
404
+ ATOM 404 C PTH 1 122.24 86.17 49.87 0.00 0.00
405
+ ATOM 405 C PTH 1 122.24 87.17 44.87 0.00 0.00
406
+ ATOM 406 C PTH 1 122.24 87.17 45.87 0.00 0.00
407
+ ATOM 407 C PTH 1 122.24 87.17 46.87 0.00 0.00
408
+ ATOM 408 C PTH 1 122.24 87.17 47.87 0.00 0.00
409
+ ATOM 409 C PTH 1 122.24 87.17 48.87 0.00 0.00
410
+ ATOM 410 C PTH 1 122.24 87.17 49.87 0.00 0.00
411
+ ATOM 411 C PTH 1 122.24 88.17 45.87 0.00 0.00
412
+ ATOM 412 C PTH 1 122.24 88.17 46.87 0.00 0.00
413
+ ATOM 413 C PTH 1 122.24 88.17 47.87 0.00 0.00
414
+ ATOM 414 C PTH 1 122.24 88.17 48.87 0.00 0.00
415
+ ATOM 415 C PTH 1 122.24 88.17 49.87 0.00 0.00
416
+ ATOM 416 C PTH 1 122.24 89.17 46.87 0.00 0.00
417
+ ATOM 417 C PTH 1 122.24 89.17 47.87 0.00 0.00
418
+ ATOM 418 C PTH 1 122.24 89.17 48.87 0.00 0.00
419
+ ATOM 419 C PTH 1 122.24 89.17 49.87 0.00 0.00
420
+ ATOM 420 C PTH 1 123.24 84.17 44.87 0.00 0.00
421
+ ATOM 421 C PTH 1 123.24 84.17 45.87 0.00 0.00
422
+ ATOM 422 C PTH 1 123.24 84.17 46.87 0.00 0.00
423
+ ATOM 423 C PTH 1 123.24 85.17 44.87 0.00 0.00
424
+ ATOM 424 C PTH 1 123.24 85.17 45.87 0.00 0.00
425
+ ATOM 425 C PTH 1 123.24 85.17 46.87 0.00 0.00
426
+ ATOM 426 C PTH 1 123.24 85.17 47.87 0.00 0.00
427
+ ATOM 427 C PTH 1 123.24 86.17 43.87 0.00 0.00
428
+ ATOM 428 C PTH 1 123.24 86.17 44.87 0.00 0.00
429
+ ATOM 429 C PTH 1 123.24 86.17 45.87 0.00 0.00
430
+ ATOM 430 C PTH 1 123.24 86.17 46.87 0.00 0.00
431
+ ATOM 431 C PTH 1 123.24 86.17 47.87 0.00 0.00
432
+ ATOM 432 C PTH 1 123.24 86.17 48.87 0.00 0.00
433
+ ATOM 433 C PTH 1 123.24 87.17 44.87 0.00 0.00
434
+ ATOM 434 C PTH 1 123.24 87.17 45.87 0.00 0.00
435
+ ATOM 435 C PTH 1 123.24 87.17 46.87 0.00 0.00
436
+ ATOM 436 C PTH 1 123.24 87.17 47.87 0.00 0.00
437
+ ATOM 437 C PTH 1 123.24 87.17 48.87 0.00 0.00
438
+ ATOM 438 C PTH 1 123.24 88.17 45.87 0.00 0.00
439
+ ATOM 439 C PTH 1 123.24 88.17 46.87 0.00 0.00
440
+ ATOM 440 C PTH 1 123.24 88.17 47.87 0.00 0.00
441
+ ATOM 441 C PTH 1 123.24 88.17 48.87 0.00 0.00
442
+ ATOM 442 C PTH 1 123.24 88.17 49.87 0.00 0.00
443
+ ATOM 443 C PTH 1 123.24 89.17 45.87 0.00 0.00
444
+ ATOM 444 C PTH 1 123.24 89.17 46.87 0.00 0.00
445
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446
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447
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448
+ ATOM 448 C PTH 1 123.24 90.17 47.87 0.00 0.00
449
+ ATOM 449 C PTH 1 124.24 85.17 44.87 0.00 0.00
450
+ ATOM 450 C PTH 1 124.24 85.17 45.87 0.00 0.00
451
+ ATOM 451 C PTH 1 124.24 85.17 46.87 0.00 0.00
452
+ ATOM 452 C PTH 1 124.24 85.17 47.87 0.00 0.00
453
+ ATOM 453 C PTH 1 124.24 86.17 43.87 0.00 0.00
454
+ ATOM 454 C PTH 1 124.24 86.17 44.87 0.00 0.00
455
+ ATOM 455 C PTH 1 124.24 86.17 45.87 0.00 0.00
456
+ ATOM 456 C PTH 1 124.24 86.17 46.87 0.00 0.00
457
+ ATOM 457 C PTH 1 124.24 86.17 47.87 0.00 0.00
458
+ ATOM 458 C PTH 1 124.24 87.17 44.87 0.00 0.00
459
+ ATOM 459 C PTH 1 124.24 87.17 45.87 0.00 0.00
460
+ ATOM 460 C PTH 1 124.24 87.17 46.87 0.00 0.00
461
+ ATOM 461 C PTH 1 124.24 87.17 47.87 0.00 0.00
462
+ ATOM 462 C PTH 1 124.24 87.17 48.87 0.00 0.00
463
+ ATOM 463 C PTH 1 124.24 88.17 44.87 0.00 0.00
464
+ ATOM 464 C PTH 1 124.24 88.17 45.87 0.00 0.00
465
+ ATOM 465 C PTH 1 124.24 88.17 46.87 0.00 0.00
466
+ ATOM 466 C PTH 1 124.24 88.17 47.87 0.00 0.00
467
+ ATOM 467 C PTH 1 124.24 88.17 48.87 0.00 0.00
468
+ ATOM 468 C PTH 1 124.24 89.17 45.87 0.00 0.00
469
+ ATOM 469 C PTH 1 124.24 89.17 46.87 0.00 0.00
470
+ ATOM 470 C PTH 1 124.24 89.17 47.87 0.00 0.00
471
+ ATOM 471 C PTH 1 124.24 89.17 48.87 0.00 0.00
472
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473
+ ATOM 473 C PTH 1 124.24 90.17 47.87 0.00 0.00
474
+ ATOM 474 C PTH 1 124.24 90.17 48.87 0.00 0.00
475
+ ATOM 475 C PTH 1 125.24 85.17 44.87 0.00 0.00
476
+ ATOM 476 C PTH 1 125.24 85.17 45.87 0.00 0.00
477
+ ATOM 477 C PTH 1 125.24 85.17 46.87 0.00 0.00
478
+ ATOM 478 C PTH 1 125.24 86.17 44.87 0.00 0.00
479
+ ATOM 479 C PTH 1 125.24 86.17 45.87 0.00 0.00
480
+ ATOM 480 C PTH 1 125.24 86.17 46.87 0.00 0.00
481
+ ATOM 481 C PTH 1 125.24 86.17 47.87 0.00 0.00
482
+ ATOM 482 C PTH 1 125.24 87.17 43.87 0.00 0.00
483
+ ATOM 483 C PTH 1 125.24 87.17 44.87 0.00 0.00
484
+ ATOM 484 C PTH 1 125.24 87.17 45.87 0.00 0.00
485
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486
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487
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488
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489
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490
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491
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492
+ ATOM 492 C PTH 1 125.24 89.17 45.87 0.00 0.00
493
+ ATOM 493 C PTH 1 125.24 89.17 46.87 0.00 0.00
494
+ ATOM 494 C PTH 1 125.24 89.17 47.87 0.00 0.00
495
+ ATOM 495 C PTH 1 125.24 89.17 48.87 0.00 0.00
496
+ ATOM 496 C PTH 1 125.24 90.17 45.87 0.00 0.00
497
+ ATOM 497 C PTH 1 125.24 90.17 46.87 0.00 0.00
498
+ ATOM 498 C PTH 1 125.24 90.17 47.87 0.00 0.00
499
+ ATOM 499 C PTH 1 125.24 90.17 48.87 0.00 0.00
500
+ ATOM 500 C PTH 1 126.24 85.17 44.87 0.00 0.00
501
+ ATOM 501 C PTH 1 126.24 85.17 45.87 0.00 0.00
502
+ ATOM 502 C PTH 1 126.24 86.17 44.87 0.00 0.00
503
+ ATOM 503 C PTH 1 126.24 86.17 45.87 0.00 0.00
504
+ ATOM 504 C PTH 1 126.24 86.17 46.87 0.00 0.00
505
+ ATOM 505 C PTH 1 126.24 87.17 44.87 0.00 0.00
506
+ ATOM 506 C PTH 1 126.24 87.17 45.87 0.00 0.00
507
+ ATOM 507 C PTH 1 126.24 87.17 46.87 0.00 0.00
508
+ ATOM 508 C PTH 1 126.24 87.17 47.87 0.00 0.00
509
+ ATOM 509 C PTH 1 126.24 88.17 44.87 0.00 0.00
510
+ ATOM 510 C PTH 1 126.24 88.17 45.87 0.00 0.00
511
+ ATOM 511 C PTH 1 126.24 88.17 46.87 0.00 0.00
512
+ ATOM 512 C PTH 1 126.24 88.17 47.87 0.00 0.00
513
+ ATOM 513 C PTH 1 126.24 89.17 45.87 0.00 0.00
514
+ ATOM 514 C PTH 1 126.24 89.17 46.87 0.00 0.00
515
+ ATOM 515 C PTH 1 126.24 89.17 47.87 0.00 0.00
516
+ ATOM 516 C PTH 1 126.24 89.17 48.87 0.00 0.00
517
+ ATOM 517 C PTH 1 126.24 90.17 45.87 0.00 0.00
518
+ ATOM 518 C PTH 1 126.24 90.17 46.87 0.00 0.00
519
+ ATOM 519 C PTH 1 126.24 90.17 47.87 0.00 0.00
520
+ ATOM 520 C PTH 1 126.24 90.17 48.87 0.00 0.00
521
+ ATOM 521 C PTH 1 127.24 88.17 46.87 0.00 0.00
522
+ ATOM 522 C PTH 1 127.24 88.17 47.87 0.00 0.00
523
+ ATOM 523 C PTH 1 127.24 89.17 46.87 0.00 0.00
524
+ ATOM 524 C PTH 1 127.24 89.17 47.87 0.00 0.00
525
+ ATOM 525 C PTH 1 127.24 90.17 46.87 0.00 0.00
526
+ ATOM 526 C PTH 1 127.24 90.17 47.87 0.00 0.00
527
+ ATOM 527 C PTH 1 127.24 90.17 48.87 0.00 0.00
data/files/A00BV/pocket_02.pdb ADDED
@@ -0,0 +1,309 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 106.24 52.17 80.87 0.00 0.00
2
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270
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271
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273
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275
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276
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277
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279
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280
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281
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293
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294
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295
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+ ATOM 309 C PTH 1 113.24 59.17 84.87 0.00 0.00
data/files/A00BV/pocket_03.pdb ADDED
@@ -0,0 +1,283 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 116.24 106.17 70.87 0.00 0.00
2
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221
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223
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224
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225
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226
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227
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229
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230
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231
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232
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233
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234
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235
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236
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237
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238
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239
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240
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242
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243
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244
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245
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246
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247
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248
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249
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250
+ ATOM 250 C PTH 1 127.24 103.17 73.87 0.00 0.00
251
+ ATOM 251 C PTH 1 127.24 104.17 71.87 0.00 0.00
252
+ ATOM 252 C PTH 1 127.24 104.17 72.87 0.00 0.00
253
+ ATOM 253 C PTH 1 127.24 104.17 73.87 0.00 0.00
254
+ ATOM 254 C PTH 1 128.24 100.17 70.87 0.00 0.00
255
+ ATOM 255 C PTH 1 128.24 100.17 71.87 0.00 0.00
256
+ ATOM 256 C PTH 1 128.24 100.17 72.87 0.00 0.00
257
+ ATOM 257 C PTH 1 128.24 101.17 70.87 0.00 0.00
258
+ ATOM 258 C PTH 1 128.24 101.17 71.87 0.00 0.00
259
+ ATOM 259 C PTH 1 128.24 101.17 72.87 0.00 0.00
260
+ ATOM 260 C PTH 1 128.24 101.17 73.87 0.00 0.00
261
+ ATOM 261 C PTH 1 128.24 102.17 70.87 0.00 0.00
262
+ ATOM 262 C PTH 1 128.24 102.17 71.87 0.00 0.00
263
+ ATOM 263 C PTH 1 128.24 102.17 72.87 0.00 0.00
264
+ ATOM 264 C PTH 1 128.24 102.17 73.87 0.00 0.00
265
+ ATOM 265 C PTH 1 128.24 103.17 70.87 0.00 0.00
266
+ ATOM 266 C PTH 1 128.24 103.17 71.87 0.00 0.00
267
+ ATOM 267 C PTH 1 128.24 103.17 72.87 0.00 0.00
268
+ ATOM 268 C PTH 1 128.24 103.17 73.87 0.00 0.00
269
+ ATOM 269 C PTH 1 128.24 104.17 72.87 0.00 0.00
270
+ ATOM 270 C PTH 1 129.24 100.17 70.87 0.00 0.00
271
+ ATOM 271 C PTH 1 129.24 100.17 71.87 0.00 0.00
272
+ ATOM 272 C PTH 1 129.24 100.17 72.87 0.00 0.00
273
+ ATOM 273 C PTH 1 129.24 100.17 73.87 0.00 0.00
274
+ ATOM 274 C PTH 1 129.24 101.17 70.87 0.00 0.00
275
+ ATOM 275 C PTH 1 129.24 101.17 71.87 0.00 0.00
276
+ ATOM 276 C PTH 1 129.24 101.17 72.87 0.00 0.00
277
+ ATOM 277 C PTH 1 129.24 101.17 73.87 0.00 0.00
278
+ ATOM 278 C PTH 1 129.24 102.17 70.87 0.00 0.00
279
+ ATOM 279 C PTH 1 129.24 102.17 71.87 0.00 0.00
280
+ ATOM 280 C PTH 1 129.24 102.17 72.87 0.00 0.00
281
+ ATOM 281 C PTH 1 129.24 102.17 73.87 0.00 0.00
282
+ ATOM 282 C PTH 1 129.24 103.17 71.87 0.00 0.00
283
+ ATOM 283 C PTH 1 129.24 103.17 72.87 0.00 0.00
data/files/A00BV/pocket_04.pdb ADDED
@@ -0,0 +1,256 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 105.24 67.17 74.87 0.00 0.00
2
+ ATOM 2 C PTH 1 105.24 68.17 74.87 0.00 0.00
3
+ ATOM 3 C PTH 1 105.24 68.17 75.87 0.00 0.00
4
+ ATOM 4 C PTH 1 105.24 68.17 76.87 0.00 0.00
5
+ ATOM 5 C PTH 1 105.24 69.17 74.87 0.00 0.00
6
+ ATOM 6 C PTH 1 105.24 69.17 75.87 0.00 0.00
7
+ ATOM 7 C PTH 1 106.24 67.17 73.87 0.00 0.00
8
+ ATOM 8 C PTH 1 106.24 67.17 74.87 0.00 0.00
9
+ ATOM 9 C PTH 1 106.24 67.17 75.87 0.00 0.00
10
+ ATOM 10 C PTH 1 106.24 68.17 73.87 0.00 0.00
11
+ ATOM 11 C PTH 1 106.24 68.17 74.87 0.00 0.00
12
+ ATOM 12 C PTH 1 106.24 68.17 75.87 0.00 0.00
13
+ ATOM 13 C PTH 1 106.24 68.17 76.87 0.00 0.00
14
+ ATOM 14 C PTH 1 106.24 69.17 73.87 0.00 0.00
15
+ ATOM 15 C PTH 1 106.24 69.17 74.87 0.00 0.00
16
+ ATOM 16 C PTH 1 106.24 69.17 75.87 0.00 0.00
17
+ ATOM 17 C PTH 1 106.24 70.17 74.87 0.00 0.00
18
+ ATOM 18 C PTH 1 106.24 70.17 75.87 0.00 0.00
19
+ ATOM 19 C PTH 1 107.24 67.17 73.87 0.00 0.00
20
+ ATOM 20 C PTH 1 107.24 67.17 74.87 0.00 0.00
21
+ ATOM 21 C PTH 1 107.24 67.17 75.87 0.00 0.00
22
+ ATOM 22 C PTH 1 107.24 68.17 73.87 0.00 0.00
23
+ ATOM 23 C PTH 1 107.24 68.17 74.87 0.00 0.00
24
+ ATOM 24 C PTH 1 107.24 68.17 75.87 0.00 0.00
25
+ ATOM 25 C PTH 1 107.24 68.17 76.87 0.00 0.00
26
+ ATOM 26 C PTH 1 107.24 69.17 73.87 0.00 0.00
27
+ ATOM 27 C PTH 1 107.24 69.17 74.87 0.00 0.00
28
+ ATOM 28 C PTH 1 107.24 69.17 75.87 0.00 0.00
29
+ ATOM 29 C PTH 1 107.24 69.17 76.87 0.00 0.00
30
+ ATOM 30 C PTH 1 107.24 69.17 77.87 0.00 0.00
31
+ ATOM 31 C PTH 1 107.24 70.17 72.87 0.00 0.00
32
+ ATOM 32 C PTH 1 107.24 70.17 73.87 0.00 0.00
33
+ ATOM 33 C PTH 1 107.24 70.17 74.87 0.00 0.00
34
+ ATOM 34 C PTH 1 107.24 70.17 75.87 0.00 0.00
35
+ ATOM 35 C PTH 1 107.24 70.17 76.87 0.00 0.00
36
+ ATOM 36 C PTH 1 107.24 70.17 77.87 0.00 0.00
37
+ ATOM 37 C PTH 1 107.24 70.17 78.87 0.00 0.00
38
+ ATOM 38 C PTH 1 107.24 71.17 72.87 0.00 0.00
39
+ ATOM 39 C PTH 1 107.24 71.17 73.87 0.00 0.00
40
+ ATOM 40 C PTH 1 107.24 71.17 74.87 0.00 0.00
41
+ ATOM 41 C PTH 1 107.24 71.17 75.87 0.00 0.00
42
+ ATOM 42 C PTH 1 107.24 71.17 76.87 0.00 0.00
43
+ ATOM 43 C PTH 1 107.24 71.17 77.87 0.00 0.00
44
+ ATOM 44 C PTH 1 107.24 72.17 72.87 0.00 0.00
45
+ ATOM 45 C PTH 1 107.24 72.17 73.87 0.00 0.00
46
+ ATOM 46 C PTH 1 107.24 72.17 74.87 0.00 0.00
47
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48
+ ATOM 48 C PTH 1 107.24 72.17 76.87 0.00 0.00
49
+ ATOM 49 C PTH 1 107.24 72.17 77.87 0.00 0.00
50
+ ATOM 50 C PTH 1 107.24 73.17 72.87 0.00 0.00
51
+ ATOM 51 C PTH 1 107.24 73.17 73.87 0.00 0.00
52
+ ATOM 52 C PTH 1 107.24 73.17 74.87 0.00 0.00
53
+ ATOM 53 C PTH 1 107.24 73.17 75.87 0.00 0.00
54
+ ATOM 54 C PTH 1 107.24 73.17 76.87 0.00 0.00
55
+ ATOM 55 C PTH 1 107.24 74.17 74.87 0.00 0.00
56
+ ATOM 56 C PTH 1 108.24 67.17 73.87 0.00 0.00
57
+ ATOM 57 C PTH 1 108.24 67.17 74.87 0.00 0.00
58
+ ATOM 58 C PTH 1 108.24 67.17 75.87 0.00 0.00
59
+ ATOM 59 C PTH 1 108.24 68.17 73.87 0.00 0.00
60
+ ATOM 60 C PTH 1 108.24 68.17 74.87 0.00 0.00
61
+ ATOM 61 C PTH 1 108.24 68.17 75.87 0.00 0.00
62
+ ATOM 62 C PTH 1 108.24 68.17 76.87 0.00 0.00
63
+ ATOM 63 C PTH 1 108.24 68.17 77.87 0.00 0.00
64
+ ATOM 64 C PTH 1 108.24 69.17 73.87 0.00 0.00
65
+ ATOM 65 C PTH 1 108.24 69.17 74.87 0.00 0.00
66
+ ATOM 66 C PTH 1 108.24 69.17 75.87 0.00 0.00
67
+ ATOM 67 C PTH 1 108.24 69.17 76.87 0.00 0.00
68
+ ATOM 68 C PTH 1 108.24 69.17 77.87 0.00 0.00
69
+ ATOM 69 C PTH 1 108.24 69.17 78.87 0.00 0.00
70
+ ATOM 70 C PTH 1 108.24 69.17 79.87 0.00 0.00
71
+ ATOM 71 C PTH 1 108.24 70.17 72.87 0.00 0.00
72
+ ATOM 72 C PTH 1 108.24 70.17 73.87 0.00 0.00
73
+ ATOM 73 C PTH 1 108.24 70.17 74.87 0.00 0.00
74
+ ATOM 74 C PTH 1 108.24 70.17 75.87 0.00 0.00
75
+ ATOM 75 C PTH 1 108.24 70.17 76.87 0.00 0.00
76
+ ATOM 76 C PTH 1 108.24 70.17 77.87 0.00 0.00
77
+ ATOM 77 C PTH 1 108.24 70.17 78.87 0.00 0.00
78
+ ATOM 78 C PTH 1 108.24 70.17 79.87 0.00 0.00
79
+ ATOM 79 C PTH 1 108.24 71.17 72.87 0.00 0.00
80
+ ATOM 80 C PTH 1 108.24 71.17 73.87 0.00 0.00
81
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82
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83
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84
+ ATOM 84 C PTH 1 108.24 71.17 77.87 0.00 0.00
85
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86
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87
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88
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89
+ ATOM 89 C PTH 1 108.24 72.17 74.87 0.00 0.00
90
+ ATOM 90 C PTH 1 108.24 72.17 75.87 0.00 0.00
91
+ ATOM 91 C PTH 1 108.24 72.17 76.87 0.00 0.00
92
+ ATOM 92 C PTH 1 108.24 72.17 77.87 0.00 0.00
93
+ ATOM 93 C PTH 1 108.24 72.17 78.87 0.00 0.00
94
+ ATOM 94 C PTH 1 108.24 73.17 72.87 0.00 0.00
95
+ ATOM 95 C PTH 1 108.24 73.17 73.87 0.00 0.00
96
+ ATOM 96 C PTH 1 108.24 73.17 74.87 0.00 0.00
97
+ ATOM 97 C PTH 1 108.24 73.17 75.87 0.00 0.00
98
+ ATOM 98 C PTH 1 108.24 73.17 76.87 0.00 0.00
99
+ ATOM 99 C PTH 1 108.24 73.17 77.87 0.00 0.00
100
+ ATOM 100 C PTH 1 108.24 74.17 73.87 0.00 0.00
101
+ ATOM 101 C PTH 1 108.24 74.17 74.87 0.00 0.00
102
+ ATOM 102 C PTH 1 108.24 74.17 75.87 0.00 0.00
103
+ ATOM 103 C PTH 1 108.24 74.17 76.87 0.00 0.00
104
+ ATOM 104 C PTH 1 109.24 68.17 74.87 0.00 0.00
105
+ ATOM 105 C PTH 1 109.24 68.17 75.87 0.00 0.00
106
+ ATOM 106 C PTH 1 109.24 68.17 76.87 0.00 0.00
107
+ ATOM 107 C PTH 1 109.24 68.17 77.87 0.00 0.00
108
+ ATOM 108 C PTH 1 109.24 68.17 78.87 0.00 0.00
109
+ ATOM 109 C PTH 1 109.24 69.17 74.87 0.00 0.00
110
+ ATOM 110 C PTH 1 109.24 69.17 75.87 0.00 0.00
111
+ ATOM 111 C PTH 1 109.24 69.17 76.87 0.00 0.00
112
+ ATOM 112 C PTH 1 109.24 69.17 77.87 0.00 0.00
113
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114
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115
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116
+ ATOM 116 C PTH 1 109.24 70.17 74.87 0.00 0.00
117
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118
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119
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120
+ ATOM 120 C PTH 1 109.24 70.17 78.87 0.00 0.00
121
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122
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123
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124
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125
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126
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127
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128
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129
+ ATOM 129 C PTH 1 109.24 71.17 79.87 0.00 0.00
130
+ ATOM 130 C PTH 1 109.24 72.17 72.87 0.00 0.00
131
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132
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133
+ ATOM 133 C PTH 1 109.24 72.17 75.87 0.00 0.00
134
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135
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136
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137
+ ATOM 137 C PTH 1 109.24 72.17 79.87 0.00 0.00
138
+ ATOM 138 C PTH 1 109.24 73.17 72.87 0.00 0.00
139
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140
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141
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142
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143
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144
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145
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146
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147
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148
+ ATOM 148 C PTH 1 109.24 74.17 76.87 0.00 0.00
149
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150
+ ATOM 150 C PTH 1 109.24 75.17 74.87 0.00 0.00
151
+ ATOM 151 C PTH 1 110.24 68.17 75.87 0.00 0.00
152
+ ATOM 152 C PTH 1 110.24 68.17 76.87 0.00 0.00
153
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154
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155
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156
+ ATOM 156 C PTH 1 110.24 69.17 75.87 0.00 0.00
157
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158
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159
+ ATOM 159 C PTH 1 110.24 69.17 78.87 0.00 0.00
160
+ ATOM 160 C PTH 1 110.24 69.17 79.87 0.00 0.00
161
+ ATOM 161 C PTH 1 110.24 69.17 80.87 0.00 0.00
162
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163
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164
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165
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166
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167
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168
+ ATOM 168 C PTH 1 110.24 70.17 80.87 0.00 0.00
169
+ ATOM 169 C PTH 1 110.24 71.17 73.87 0.00 0.00
170
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171
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172
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173
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174
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175
+ ATOM 175 C PTH 1 110.24 71.17 79.87 0.00 0.00
176
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177
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178
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179
+ ATOM 179 C PTH 1 110.24 72.17 76.87 0.00 0.00
180
+ ATOM 180 C PTH 1 110.24 72.17 77.87 0.00 0.00
181
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182
+ ATOM 182 C PTH 1 110.24 72.17 79.87 0.00 0.00
183
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184
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185
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186
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187
+ ATOM 187 C PTH 1 110.24 73.17 77.87 0.00 0.00
188
+ ATOM 188 C PTH 1 110.24 73.17 78.87 0.00 0.00
189
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190
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191
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192
+ ATOM 192 C PTH 1 110.24 74.17 76.87 0.00 0.00
193
+ ATOM 193 C PTH 1 110.24 74.17 77.87 0.00 0.00
194
+ ATOM 194 C PTH 1 110.24 75.17 73.87 0.00 0.00
195
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196
+ ATOM 196 C PTH 1 110.24 75.17 75.87 0.00 0.00
197
+ ATOM 197 C PTH 1 111.24 68.17 79.87 0.00 0.00
198
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199
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200
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201
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202
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203
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204
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205
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206
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207
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208
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209
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210
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211
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212
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213
+ ATOM 213 C PTH 1 111.24 71.17 75.87 0.00 0.00
214
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215
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216
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217
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218
+ ATOM 218 C PTH 1 111.24 72.17 73.87 0.00 0.00
219
+ ATOM 219 C PTH 1 111.24 72.17 74.87 0.00 0.00
220
+ ATOM 220 C PTH 1 111.24 72.17 75.87 0.00 0.00
221
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222
+ ATOM 222 C PTH 1 111.24 72.17 77.87 0.00 0.00
223
+ ATOM 223 C PTH 1 111.24 72.17 78.87 0.00 0.00
224
+ ATOM 224 C PTH 1 111.24 72.17 79.87 0.00 0.00
225
+ ATOM 225 C PTH 1 111.24 73.17 73.87 0.00 0.00
226
+ ATOM 226 C PTH 1 111.24 73.17 74.87 0.00 0.00
227
+ ATOM 227 C PTH 1 111.24 73.17 75.87 0.00 0.00
228
+ ATOM 228 C PTH 1 111.24 73.17 76.87 0.00 0.00
229
+ ATOM 229 C PTH 1 111.24 73.17 77.87 0.00 0.00
230
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231
+ ATOM 231 C PTH 1 111.24 74.17 74.87 0.00 0.00
232
+ ATOM 232 C PTH 1 111.24 74.17 75.87 0.00 0.00
233
+ ATOM 233 C PTH 1 111.24 74.17 76.87 0.00 0.00
234
+ ATOM 234 C PTH 1 111.24 75.17 73.87 0.00 0.00
235
+ ATOM 235 C PTH 1 111.24 75.17 74.87 0.00 0.00
236
+ ATOM 236 C PTH 1 112.24 69.17 79.87 0.00 0.00
237
+ ATOM 237 C PTH 1 112.24 69.17 80.87 0.00 0.00
238
+ ATOM 238 C PTH 1 112.24 70.17 76.87 0.00 0.00
239
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240
+ ATOM 240 C PTH 1 112.24 70.17 78.87 0.00 0.00
241
+ ATOM 241 C PTH 1 112.24 70.17 79.87 0.00 0.00
242
+ ATOM 242 C PTH 1 112.24 70.17 80.87 0.00 0.00
243
+ ATOM 243 C PTH 1 112.24 71.17 75.87 0.00 0.00
244
+ ATOM 244 C PTH 1 112.24 71.17 76.87 0.00 0.00
245
+ ATOM 245 C PTH 1 112.24 71.17 77.87 0.00 0.00
246
+ ATOM 246 C PTH 1 112.24 71.17 78.87 0.00 0.00
247
+ ATOM 247 C PTH 1 112.24 71.17 79.87 0.00 0.00
248
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+ ATOM 8 C PTH 1 125.24 97.17 45.87 0.00 0.00
9
+ ATOM 9 C PTH 1 125.24 98.17 42.87 0.00 0.00
10
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11
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12
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13
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14
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15
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16
+ ATOM 16 C PTH 1 125.24 100.17 42.87 0.00 0.00
17
+ ATOM 17 C PTH 1 125.24 100.17 43.87 0.00 0.00
18
+ ATOM 18 C PTH 1 126.24 95.17 41.87 0.00 0.00
19
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20
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21
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22
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23
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24
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25
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26
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27
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28
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29
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30
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31
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32
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33
+ ATOM 33 C PTH 1 126.24 98.17 41.87 0.00 0.00
34
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35
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36
+ ATOM 36 C PTH 1 126.24 98.17 44.87 0.00 0.00
37
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38
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39
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40
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41
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42
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43
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44
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45
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46
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47
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48
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49
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50
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51
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52
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53
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54
+ ATOM 54 C PTH 1 126.24 103.17 42.87 0.00 0.00
55
+ ATOM 55 C PTH 1 126.24 103.17 43.87 0.00 0.00
56
+ ATOM 56 C PTH 1 127.24 94.17 40.87 0.00 0.00
57
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58
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59
+ ATOM 59 C PTH 1 127.24 95.17 40.87 0.00 0.00
60
+ ATOM 60 C PTH 1 127.24 95.17 41.87 0.00 0.00
61
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62
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63
+ ATOM 63 C PTH 1 127.24 95.17 44.87 0.00 0.00
64
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65
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66
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67
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68
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69
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70
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71
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72
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73
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74
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75
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76
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77
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78
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79
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80
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81
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82
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83
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84
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85
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86
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87
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88
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89
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90
+ ATOM 90 C PTH 1 127.24 101.17 41.87 0.00 0.00
91
+ ATOM 91 C PTH 1 127.24 101.17 42.87 0.00 0.00
92
+ ATOM 92 C PTH 1 127.24 101.17 43.87 0.00 0.00
93
+ ATOM 93 C PTH 1 127.24 101.17 44.87 0.00 0.00
94
+ ATOM 94 C PTH 1 127.24 102.17 41.87 0.00 0.00
95
+ ATOM 95 C PTH 1 127.24 102.17 42.87 0.00 0.00
96
+ ATOM 96 C PTH 1 127.24 102.17 43.87 0.00 0.00
97
+ ATOM 97 C PTH 1 127.24 102.17 44.87 0.00 0.00
98
+ ATOM 98 C PTH 1 127.24 103.17 41.87 0.00 0.00
99
+ ATOM 99 C PTH 1 127.24 103.17 42.87 0.00 0.00
100
+ ATOM 100 C PTH 1 127.24 103.17 43.87 0.00 0.00
101
+ ATOM 101 C PTH 1 127.24 103.17 44.87 0.00 0.00
102
+ ATOM 102 C PTH 1 127.24 104.17 41.87 0.00 0.00
103
+ ATOM 103 C PTH 1 128.24 94.17 40.87 0.00 0.00
104
+ ATOM 104 C PTH 1 128.24 94.17 41.87 0.00 0.00
105
+ ATOM 105 C PTH 1 128.24 94.17 42.87 0.00 0.00
106
+ ATOM 106 C PTH 1 128.24 94.17 43.87 0.00 0.00
107
+ ATOM 107 C PTH 1 128.24 95.17 40.87 0.00 0.00
108
+ ATOM 108 C PTH 1 128.24 95.17 41.87 0.00 0.00
109
+ ATOM 109 C PTH 1 128.24 95.17 42.87 0.00 0.00
110
+ ATOM 110 C PTH 1 128.24 95.17 43.87 0.00 0.00
111
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112
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113
+ ATOM 113 C PTH 1 128.24 96.17 41.87 0.00 0.00
114
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115
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116
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117
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118
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119
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120
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121
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122
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123
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124
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125
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126
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127
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128
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129
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130
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131
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132
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133
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134
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135
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136
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137
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138
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139
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140
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141
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142
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143
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144
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145
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146
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147
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148
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149
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150
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151
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152
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153
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154
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155
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156
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157
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158
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159
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160
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161
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162
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163
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164
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165
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166
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167
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168
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169
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170
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171
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172
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173
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174
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175
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176
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177
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178
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179
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180
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181
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182
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183
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184
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185
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186
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187
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188
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189
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190
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191
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192
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193
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194
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195
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196
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197
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198
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199
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200
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201
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202
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203
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204
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205
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206
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207
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208
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209
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210
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211
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212
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213
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214
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215
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216
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217
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218
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219
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220
+ ATOM 220 C PTH 1 130.24 101.17 43.87 0.00 0.00
221
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222
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223
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224
+ ATOM 224 C PTH 1 130.24 102.17 44.87 0.00 0.00
225
+ ATOM 225 C PTH 1 130.24 103.17 41.87 0.00 0.00
226
+ ATOM 226 C PTH 1 131.24 97.17 43.87 0.00 0.00
227
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228
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229
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230
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231
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232
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233
+ ATOM 233 C PTH 1 131.24 99.17 44.87 0.00 0.00
234
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235
+ ATOM 235 C PTH 1 131.24 100.17 42.87 0.00 0.00
236
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237
+ ATOM 237 C PTH 1 131.24 100.17 44.87 0.00 0.00
238
+ ATOM 238 C PTH 1 131.24 100.17 45.87 0.00 0.00
239
+ ATOM 239 C PTH 1 131.24 101.17 42.87 0.00 0.00
240
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241
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242
+ ATOM 242 C PTH 1 131.24 101.17 45.87 0.00 0.00
243
+ ATOM 243 C PTH 1 132.24 100.17 43.87 0.00 0.00
data/files/A00BV/pocket_07.pdb ADDED
@@ -0,0 +1,213 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 109.24 78.17 62.87 0.00 0.00
2
+ ATOM 2 C PTH 1 109.24 79.17 57.87 0.00 0.00
3
+ ATOM 3 C PTH 1 109.24 79.17 58.87 0.00 0.00
4
+ ATOM 4 C PTH 1 109.24 79.17 59.87 0.00 0.00
5
+ ATOM 5 C PTH 1 109.24 79.17 60.87 0.00 0.00
6
+ ATOM 6 C PTH 1 109.24 79.17 61.87 0.00 0.00
7
+ ATOM 7 C PTH 1 109.24 79.17 63.87 0.00 0.00
8
+ ATOM 8 C PTH 1 109.24 80.17 57.87 0.00 0.00
9
+ ATOM 9 C PTH 1 109.24 80.17 58.87 0.00 0.00
10
+ ATOM 10 C PTH 1 109.24 80.17 59.87 0.00 0.00
11
+ ATOM 11 C PTH 1 109.24 80.17 60.87 0.00 0.00
12
+ ATOM 12 C PTH 1 109.24 80.17 61.87 0.00 0.00
13
+ ATOM 13 C PTH 1 109.24 80.17 62.87 0.00 0.00
14
+ ATOM 14 C PTH 1 109.24 80.17 63.87 0.00 0.00
15
+ ATOM 15 C PTH 1 109.24 80.17 64.87 0.00 0.00
16
+ ATOM 16 C PTH 1 109.24 80.17 65.87 0.00 0.00
17
+ ATOM 17 C PTH 1 109.24 81.17 57.87 0.00 0.00
18
+ ATOM 18 C PTH 1 109.24 81.17 58.87 0.00 0.00
19
+ ATOM 19 C PTH 1 109.24 81.17 59.87 0.00 0.00
20
+ ATOM 20 C PTH 1 109.24 81.17 60.87 0.00 0.00
21
+ ATOM 21 C PTH 1 109.24 81.17 61.87 0.00 0.00
22
+ ATOM 22 C PTH 1 109.24 81.17 62.87 0.00 0.00
23
+ ATOM 23 C PTH 1 109.24 81.17 65.87 0.00 0.00
24
+ ATOM 24 C PTH 1 109.24 82.17 58.87 0.00 0.00
25
+ ATOM 25 C PTH 1 109.24 82.17 59.87 0.00 0.00
26
+ ATOM 26 C PTH 1 109.24 82.17 60.87 0.00 0.00
27
+ ATOM 27 C PTH 1 109.24 82.17 61.87 0.00 0.00
28
+ ATOM 28 C PTH 1 109.24 82.17 62.87 0.00 0.00
29
+ ATOM 29 C PTH 1 109.24 83.17 59.87 0.00 0.00
30
+ ATOM 30 C PTH 1 109.24 83.17 60.87 0.00 0.00
31
+ ATOM 31 C PTH 1 109.24 83.17 61.87 0.00 0.00
32
+ ATOM 32 C PTH 1 110.24 78.17 58.87 0.00 0.00
33
+ ATOM 33 C PTH 1 110.24 78.17 59.87 0.00 0.00
34
+ ATOM 34 C PTH 1 110.24 79.17 56.87 0.00 0.00
35
+ ATOM 35 C PTH 1 110.24 79.17 57.87 0.00 0.00
36
+ ATOM 36 C PTH 1 110.24 79.17 58.87 0.00 0.00
37
+ ATOM 37 C PTH 1 110.24 79.17 59.87 0.00 0.00
38
+ ATOM 38 C PTH 1 110.24 79.17 60.87 0.00 0.00
39
+ ATOM 39 C PTH 1 110.24 79.17 61.87 0.00 0.00
40
+ ATOM 40 C PTH 1 110.24 79.17 62.87 0.00 0.00
41
+ ATOM 41 C PTH 1 110.24 79.17 63.87 0.00 0.00
42
+ ATOM 42 C PTH 1 110.24 80.17 56.87 0.00 0.00
43
+ ATOM 43 C PTH 1 110.24 80.17 57.87 0.00 0.00
44
+ ATOM 44 C PTH 1 110.24 80.17 58.87 0.00 0.00
45
+ ATOM 45 C PTH 1 110.24 80.17 59.87 0.00 0.00
46
+ ATOM 46 C PTH 1 110.24 80.17 60.87 0.00 0.00
47
+ ATOM 47 C PTH 1 110.24 80.17 61.87 0.00 0.00
48
+ ATOM 48 C PTH 1 110.24 80.17 62.87 0.00 0.00
49
+ ATOM 49 C PTH 1 110.24 80.17 63.87 0.00 0.00
50
+ ATOM 50 C PTH 1 110.24 80.17 64.87 0.00 0.00
51
+ ATOM 51 C PTH 1 110.24 80.17 65.87 0.00 0.00
52
+ ATOM 52 C PTH 1 110.24 81.17 56.87 0.00 0.00
53
+ ATOM 53 C PTH 1 110.24 81.17 57.87 0.00 0.00
54
+ ATOM 54 C PTH 1 110.24 81.17 58.87 0.00 0.00
55
+ ATOM 55 C PTH 1 110.24 81.17 59.87 0.00 0.00
56
+ ATOM 56 C PTH 1 110.24 81.17 60.87 0.00 0.00
57
+ ATOM 57 C PTH 1 110.24 81.17 61.87 0.00 0.00
58
+ ATOM 58 C PTH 1 110.24 81.17 62.87 0.00 0.00
59
+ ATOM 59 C PTH 1 110.24 81.17 63.87 0.00 0.00
60
+ ATOM 60 C PTH 1 110.24 81.17 64.87 0.00 0.00
61
+ ATOM 61 C PTH 1 110.24 81.17 65.87 0.00 0.00
62
+ ATOM 62 C PTH 1 110.24 82.17 57.87 0.00 0.00
63
+ ATOM 63 C PTH 1 110.24 82.17 58.87 0.00 0.00
64
+ ATOM 64 C PTH 1 110.24 82.17 59.87 0.00 0.00
65
+ ATOM 65 C PTH 1 110.24 82.17 60.87 0.00 0.00
66
+ ATOM 66 C PTH 1 110.24 82.17 61.87 0.00 0.00
67
+ ATOM 67 C PTH 1 110.24 82.17 62.87 0.00 0.00
68
+ ATOM 68 C PTH 1 110.24 82.17 63.87 0.00 0.00
69
+ ATOM 69 C PTH 1 110.24 82.17 64.87 0.00 0.00
70
+ ATOM 70 C PTH 1 110.24 82.17 65.87 0.00 0.00
71
+ ATOM 71 C PTH 1 110.24 83.17 59.87 0.00 0.00
72
+ ATOM 72 C PTH 1 110.24 83.17 60.87 0.00 0.00
73
+ ATOM 73 C PTH 1 110.24 83.17 61.87 0.00 0.00
74
+ ATOM 74 C PTH 1 110.24 83.17 62.87 0.00 0.00
75
+ ATOM 75 C PTH 1 110.24 83.17 63.87 0.00 0.00
76
+ ATOM 76 C PTH 1 110.24 83.17 64.87 0.00 0.00
77
+ ATOM 77 C PTH 1 110.24 83.17 65.87 0.00 0.00
78
+ ATOM 78 C PTH 1 110.24 84.17 63.87 0.00 0.00
79
+ ATOM 79 C PTH 1 110.24 84.17 64.87 0.00 0.00
80
+ ATOM 80 C PTH 1 110.24 84.17 65.87 0.00 0.00
81
+ ATOM 81 C PTH 1 111.24 78.17 57.87 0.00 0.00
82
+ ATOM 82 C PTH 1 111.24 78.17 58.87 0.00 0.00
83
+ ATOM 83 C PTH 1 111.24 78.17 59.87 0.00 0.00
84
+ ATOM 84 C PTH 1 111.24 79.17 55.87 0.00 0.00
85
+ ATOM 85 C PTH 1 111.24 79.17 56.87 0.00 0.00
86
+ ATOM 86 C PTH 1 111.24 79.17 57.87 0.00 0.00
87
+ ATOM 87 C PTH 1 111.24 79.17 58.87 0.00 0.00
88
+ ATOM 88 C PTH 1 111.24 79.17 59.87 0.00 0.00
89
+ ATOM 89 C PTH 1 111.24 79.17 60.87 0.00 0.00
90
+ ATOM 90 C PTH 1 111.24 79.17 61.87 0.00 0.00
91
+ ATOM 91 C PTH 1 111.24 80.17 55.87 0.00 0.00
92
+ ATOM 92 C PTH 1 111.24 80.17 56.87 0.00 0.00
93
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94
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95
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96
+ ATOM 96 C PTH 1 111.24 80.17 60.87 0.00 0.00
97
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98
+ ATOM 98 C PTH 1 111.24 80.17 62.87 0.00 0.00
99
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100
+ ATOM 100 C PTH 1 111.24 80.17 64.87 0.00 0.00
101
+ ATOM 101 C PTH 1 111.24 80.17 65.87 0.00 0.00
102
+ ATOM 102 C PTH 1 111.24 81.17 56.87 0.00 0.00
103
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104
+ ATOM 104 C PTH 1 111.24 81.17 58.87 0.00 0.00
105
+ ATOM 105 C PTH 1 111.24 81.17 59.87 0.00 0.00
106
+ ATOM 106 C PTH 1 111.24 81.17 60.87 0.00 0.00
107
+ ATOM 107 C PTH 1 111.24 81.17 61.87 0.00 0.00
108
+ ATOM 108 C PTH 1 111.24 81.17 62.87 0.00 0.00
109
+ ATOM 109 C PTH 1 111.24 81.17 63.87 0.00 0.00
110
+ ATOM 110 C PTH 1 111.24 81.17 64.87 0.00 0.00
111
+ ATOM 111 C PTH 1 111.24 81.17 65.87 0.00 0.00
112
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113
+ ATOM 113 C PTH 1 111.24 82.17 58.87 0.00 0.00
114
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115
+ ATOM 115 C PTH 1 111.24 82.17 60.87 0.00 0.00
116
+ ATOM 116 C PTH 1 111.24 82.17 61.87 0.00 0.00
117
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118
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119
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120
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121
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122
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123
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124
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125
+ ATOM 125 C PTH 1 111.24 83.17 64.87 0.00 0.00
126
+ ATOM 126 C PTH 1 111.24 83.17 65.87 0.00 0.00
127
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128
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129
+ ATOM 129 C PTH 1 111.24 84.17 64.87 0.00 0.00
130
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131
+ ATOM 131 C PTH 1 112.24 78.17 56.87 0.00 0.00
132
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133
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134
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135
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136
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137
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138
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139
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140
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141
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142
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143
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144
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145
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146
+ ATOM 146 C PTH 1 112.24 80.17 61.87 0.00 0.00
147
+ ATOM 147 C PTH 1 112.24 80.17 62.87 0.00 0.00
148
+ ATOM 148 C PTH 1 112.24 81.17 56.87 0.00 0.00
149
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150
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151
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152
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153
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154
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155
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156
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157
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158
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159
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160
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161
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162
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163
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164
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165
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166
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167
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168
+ ATOM 168 C PTH 1 112.24 83.17 64.87 0.00 0.00
169
+ ATOM 169 C PTH 1 112.24 83.17 65.87 0.00 0.00
170
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171
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172
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173
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174
+ ATOM 174 C PTH 1 113.24 79.17 55.87 0.00 0.00
175
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176
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177
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178
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179
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180
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181
+ ATOM 181 C PTH 1 113.24 80.17 57.87 0.00 0.00
182
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183
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184
+ ATOM 184 C PTH 1 113.24 80.17 60.87 0.00 0.00
185
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186
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187
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188
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189
+ ATOM 189 C PTH 1 113.24 81.17 60.87 0.00 0.00
190
+ ATOM 190 C PTH 1 113.24 82.17 57.87 0.00 0.00
191
+ ATOM 191 C PTH 1 113.24 82.17 58.87 0.00 0.00
192
+ ATOM 192 C PTH 1 113.24 82.17 59.87 0.00 0.00
193
+ ATOM 193 C PTH 1 113.24 82.17 63.87 0.00 0.00
194
+ ATOM 194 C PTH 1 113.24 82.17 64.87 0.00 0.00
195
+ ATOM 195 C PTH 1 113.24 83.17 62.87 0.00 0.00
196
+ ATOM 196 C PTH 1 113.24 83.17 63.87 0.00 0.00
197
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198
+ ATOM 198 C PTH 1 113.24 83.17 65.87 0.00 0.00
199
+ ATOM 199 C PTH 1 113.24 84.17 63.87 0.00 0.00
200
+ ATOM 200 C PTH 1 113.24 84.17 64.87 0.00 0.00
201
+ ATOM 201 C PTH 1 113.24 84.17 65.87 0.00 0.00
202
+ ATOM 202 C PTH 1 114.24 79.17 55.87 0.00 0.00
203
+ ATOM 203 C PTH 1 114.24 79.17 56.87 0.00 0.00
204
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205
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206
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207
+ ATOM 207 C PTH 1 114.24 80.17 56.87 0.00 0.00
208
+ ATOM 208 C PTH 1 114.24 80.17 57.87 0.00 0.00
209
+ ATOM 209 C PTH 1 114.24 80.17 58.87 0.00 0.00
210
+ ATOM 210 C PTH 1 115.24 79.17 55.87 0.00 0.00
211
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212
+ ATOM 212 C PTH 1 115.24 80.17 56.87 0.00 0.00
213
+ ATOM 213 C PTH 1 115.24 80.17 57.87 0.00 0.00
data/files/A00BV/pocket_08.pdb ADDED
@@ -0,0 +1,207 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 113.24 93.17 55.87 0.00 0.00
2
+ ATOM 2 C PTH 1 113.24 93.17 56.87 0.00 0.00
3
+ ATOM 3 C PTH 1 113.24 93.17 57.87 0.00 0.00
4
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5
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6
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7
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8
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9
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10
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11
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12
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13
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14
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15
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16
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17
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18
+ ATOM 18 C PTH 1 114.24 94.17 55.87 0.00 0.00
19
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20
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21
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22
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23
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24
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25
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26
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27
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28
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29
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30
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31
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32
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33
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34
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35
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36
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37
+ ATOM 37 C PTH 1 115.24 93.17 57.87 0.00 0.00
38
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39
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40
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41
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42
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43
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44
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45
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46
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47
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48
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49
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50
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51
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52
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53
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54
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55
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56
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57
+ ATOM 57 C PTH 1 116.24 92.17 56.87 0.00 0.00
58
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59
+ ATOM 59 C PTH 1 116.24 92.17 58.87 0.00 0.00
60
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61
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62
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63
+ ATOM 63 C PTH 1 116.24 93.17 56.87 0.00 0.00
64
+ ATOM 64 C PTH 1 116.24 93.17 57.87 0.00 0.00
65
+ ATOM 65 C PTH 1 116.24 93.17 58.87 0.00 0.00
66
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67
+ ATOM 67 C PTH 1 116.24 94.17 53.87 0.00 0.00
68
+ ATOM 68 C PTH 1 116.24 94.17 54.87 0.00 0.00
69
+ ATOM 69 C PTH 1 116.24 94.17 55.87 0.00 0.00
70
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71
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72
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73
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74
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75
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76
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77
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78
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79
+ ATOM 79 C PTH 1 116.24 95.17 59.87 0.00 0.00
80
+ ATOM 80 C PTH 1 116.24 96.17 55.87 0.00 0.00
81
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82
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83
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84
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85
+ ATOM 85 C PTH 1 116.24 97.17 58.87 0.00 0.00
86
+ ATOM 86 C PTH 1 117.24 92.17 54.87 0.00 0.00
87
+ ATOM 87 C PTH 1 117.24 92.17 55.87 0.00 0.00
88
+ ATOM 88 C PTH 1 117.24 92.17 56.87 0.00 0.00
89
+ ATOM 89 C PTH 1 117.24 92.17 57.87 0.00 0.00
90
+ ATOM 90 C PTH 1 117.24 92.17 58.87 0.00 0.00
91
+ ATOM 91 C PTH 1 117.24 92.17 59.87 0.00 0.00
92
+ ATOM 92 C PTH 1 117.24 93.17 53.87 0.00 0.00
93
+ ATOM 93 C PTH 1 117.24 93.17 54.87 0.00 0.00
94
+ ATOM 94 C PTH 1 117.24 93.17 55.87 0.00 0.00
95
+ ATOM 95 C PTH 1 117.24 93.17 56.87 0.00 0.00
96
+ ATOM 96 C PTH 1 117.24 93.17 57.87 0.00 0.00
97
+ ATOM 97 C PTH 1 117.24 93.17 58.87 0.00 0.00
98
+ ATOM 98 C PTH 1 117.24 93.17 59.87 0.00 0.00
99
+ ATOM 99 C PTH 1 117.24 93.17 60.87 0.00 0.00
100
+ ATOM 100 C PTH 1 117.24 94.17 53.87 0.00 0.00
101
+ ATOM 101 C PTH 1 117.24 94.17 54.87 0.00 0.00
102
+ ATOM 102 C PTH 1 117.24 94.17 55.87 0.00 0.00
103
+ ATOM 103 C PTH 1 117.24 94.17 56.87 0.00 0.00
104
+ ATOM 104 C PTH 1 117.24 94.17 57.87 0.00 0.00
105
+ ATOM 105 C PTH 1 117.24 94.17 58.87 0.00 0.00
106
+ ATOM 106 C PTH 1 117.24 94.17 59.87 0.00 0.00
107
+ ATOM 107 C PTH 1 117.24 94.17 60.87 0.00 0.00
108
+ ATOM 108 C PTH 1 117.24 95.17 53.87 0.00 0.00
109
+ ATOM 109 C PTH 1 117.24 95.17 54.87 0.00 0.00
110
+ ATOM 110 C PTH 1 117.24 95.17 55.87 0.00 0.00
111
+ ATOM 111 C PTH 1 117.24 95.17 56.87 0.00 0.00
112
+ ATOM 112 C PTH 1 117.24 95.17 57.87 0.00 0.00
113
+ ATOM 113 C PTH 1 117.24 95.17 58.87 0.00 0.00
114
+ ATOM 114 C PTH 1 117.24 95.17 59.87 0.00 0.00
115
+ ATOM 115 C PTH 1 117.24 95.17 60.87 0.00 0.00
116
+ ATOM 116 C PTH 1 117.24 96.17 55.87 0.00 0.00
117
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data/files/A00BV/pocket_09.pdb ADDED
@@ -0,0 +1,150 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 132.24 96.17 48.87 0.00 0.00
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data/files/A00BV/pocket_10.pdb ADDED
@@ -0,0 +1,139 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 88.24 61.17 76.87 0.00 0.00
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38
+ ATOM 38 C PTH 1 91.24 61.17 76.87 0.00 0.00
39
+ ATOM 39 C PTH 1 91.24 62.17 74.87 0.00 0.00
40
+ ATOM 40 C PTH 1 91.24 62.17 75.87 0.00 0.00
41
+ ATOM 41 C PTH 1 91.24 62.17 76.87 0.00 0.00
42
+ ATOM 42 C PTH 1 91.24 62.17 77.87 0.00 0.00
43
+ ATOM 43 C PTH 1 92.24 58.17 73.87 0.00 0.00
44
+ ATOM 44 C PTH 1 92.24 58.17 74.87 0.00 0.00
45
+ ATOM 45 C PTH 1 92.24 59.17 72.87 0.00 0.00
46
+ ATOM 46 C PTH 1 92.24 59.17 73.87 0.00 0.00
47
+ ATOM 47 C PTH 1 92.24 59.17 74.87 0.00 0.00
48
+ ATOM 48 C PTH 1 92.24 59.17 75.87 0.00 0.00
49
+ ATOM 49 C PTH 1 92.24 60.17 72.87 0.00 0.00
50
+ ATOM 50 C PTH 1 92.24 60.17 73.87 0.00 0.00
51
+ ATOM 51 C PTH 1 92.24 60.17 74.87 0.00 0.00
52
+ ATOM 52 C PTH 1 92.24 60.17 75.87 0.00 0.00
53
+ ATOM 53 C PTH 1 92.24 60.17 76.87 0.00 0.00
54
+ ATOM 54 C PTH 1 92.24 61.17 73.87 0.00 0.00
55
+ ATOM 55 C PTH 1 92.24 61.17 74.87 0.00 0.00
56
+ ATOM 56 C PTH 1 92.24 61.17 75.87 0.00 0.00
57
+ ATOM 57 C PTH 1 92.24 61.17 76.87 0.00 0.00
58
+ ATOM 58 C PTH 1 92.24 62.17 74.87 0.00 0.00
59
+ ATOM 59 C PTH 1 92.24 62.17 75.87 0.00 0.00
60
+ ATOM 60 C PTH 1 92.24 62.17 76.87 0.00 0.00
61
+ ATOM 61 C PTH 1 93.24 57.17 74.87 0.00 0.00
62
+ ATOM 62 C PTH 1 93.24 58.17 72.87 0.00 0.00
63
+ ATOM 63 C PTH 1 93.24 58.17 73.87 0.00 0.00
64
+ ATOM 64 C PTH 1 93.24 58.17 74.87 0.00 0.00
65
+ ATOM 65 C PTH 1 93.24 58.17 75.87 0.00 0.00
66
+ ATOM 66 C PTH 1 93.24 59.17 71.87 0.00 0.00
67
+ ATOM 67 C PTH 1 93.24 59.17 72.87 0.00 0.00
68
+ ATOM 68 C PTH 1 93.24 59.17 73.87 0.00 0.00
69
+ ATOM 69 C PTH 1 93.24 59.17 74.87 0.00 0.00
70
+ ATOM 70 C PTH 1 93.24 59.17 75.87 0.00 0.00
71
+ ATOM 71 C PTH 1 93.24 60.17 71.87 0.00 0.00
72
+ ATOM 72 C PTH 1 93.24 60.17 72.87 0.00 0.00
73
+ ATOM 73 C PTH 1 93.24 60.17 73.87 0.00 0.00
74
+ ATOM 74 C PTH 1 93.24 60.17 74.87 0.00 0.00
75
+ ATOM 75 C PTH 1 93.24 60.17 75.87 0.00 0.00
76
+ ATOM 76 C PTH 1 93.24 60.17 76.87 0.00 0.00
77
+ ATOM 77 C PTH 1 93.24 61.17 73.87 0.00 0.00
78
+ ATOM 78 C PTH 1 93.24 61.17 74.87 0.00 0.00
79
+ ATOM 79 C PTH 1 93.24 61.17 75.87 0.00 0.00
80
+ ATOM 80 C PTH 1 93.24 61.17 76.87 0.00 0.00
81
+ ATOM 81 C PTH 1 93.24 62.17 74.87 0.00 0.00
82
+ ATOM 82 C PTH 1 93.24 62.17 75.87 0.00 0.00
83
+ ATOM 83 C PTH 1 93.24 62.17 76.87 0.00 0.00
84
+ ATOM 84 C PTH 1 93.24 63.17 75.87 0.00 0.00
85
+ ATOM 85 C PTH 1 93.24 63.17 76.87 0.00 0.00
86
+ ATOM 86 C PTH 1 94.24 58.17 71.87 0.00 0.00
87
+ ATOM 87 C PTH 1 94.24 58.17 72.87 0.00 0.00
88
+ ATOM 88 C PTH 1 94.24 58.17 73.87 0.00 0.00
89
+ ATOM 89 C PTH 1 94.24 58.17 74.87 0.00 0.00
90
+ ATOM 90 C PTH 1 94.24 59.17 71.87 0.00 0.00
91
+ ATOM 91 C PTH 1 94.24 59.17 72.87 0.00 0.00
92
+ ATOM 92 C PTH 1 94.24 59.17 73.87 0.00 0.00
93
+ ATOM 93 C PTH 1 94.24 59.17 74.87 0.00 0.00
94
+ ATOM 94 C PTH 1 94.24 59.17 75.87 0.00 0.00
95
+ ATOM 95 C PTH 1 94.24 60.17 71.87 0.00 0.00
96
+ ATOM 96 C PTH 1 94.24 60.17 72.87 0.00 0.00
97
+ ATOM 97 C PTH 1 94.24 60.17 73.87 0.00 0.00
98
+ ATOM 98 C PTH 1 94.24 60.17 74.87 0.00 0.00
99
+ ATOM 99 C PTH 1 94.24 60.17 75.87 0.00 0.00
100
+ ATOM 100 C PTH 1 94.24 61.17 72.87 0.00 0.00
101
+ ATOM 101 C PTH 1 94.24 61.17 73.87 0.00 0.00
102
+ ATOM 102 C PTH 1 94.24 61.17 74.87 0.00 0.00
103
+ ATOM 103 C PTH 1 94.24 61.17 75.87 0.00 0.00
104
+ ATOM 104 C PTH 1 94.24 61.17 76.87 0.00 0.00
105
+ ATOM 105 C PTH 1 94.24 62.17 73.87 0.00 0.00
106
+ ATOM 106 C PTH 1 94.24 62.17 74.87 0.00 0.00
107
+ ATOM 107 C PTH 1 94.24 62.17 75.87 0.00 0.00
108
+ ATOM 108 C PTH 1 94.24 62.17 76.87 0.00 0.00
109
+ ATOM 109 C PTH 1 94.24 63.17 74.87 0.00 0.00
110
+ ATOM 110 C PTH 1 94.24 63.17 75.87 0.00 0.00
111
+ ATOM 111 C PTH 1 94.24 63.17 76.87 0.00 0.00
112
+ ATOM 112 C PTH 1 95.24 58.17 71.87 0.00 0.00
113
+ ATOM 113 C PTH 1 95.24 58.17 72.87 0.00 0.00
114
+ ATOM 114 C PTH 1 95.24 58.17 73.87 0.00 0.00
115
+ ATOM 115 C PTH 1 95.24 58.17 74.87 0.00 0.00
116
+ ATOM 116 C PTH 1 95.24 59.17 71.87 0.00 0.00
117
+ ATOM 117 C PTH 1 95.24 59.17 72.87 0.00 0.00
118
+ ATOM 118 C PTH 1 95.24 59.17 73.87 0.00 0.00
119
+ ATOM 119 C PTH 1 95.24 59.17 74.87 0.00 0.00
120
+ ATOM 120 C PTH 1 95.24 59.17 75.87 0.00 0.00
121
+ ATOM 121 C PTH 1 95.24 60.17 72.87 0.00 0.00
122
+ ATOM 122 C PTH 1 95.24 60.17 73.87 0.00 0.00
123
+ ATOM 123 C PTH 1 95.24 60.17 74.87 0.00 0.00
124
+ ATOM 124 C PTH 1 95.24 60.17 75.87 0.00 0.00
125
+ ATOM 125 C PTH 1 95.24 61.17 72.87 0.00 0.00
126
+ ATOM 126 C PTH 1 95.24 61.17 73.87 0.00 0.00
127
+ ATOM 127 C PTH 1 95.24 61.17 74.87 0.00 0.00
128
+ ATOM 128 C PTH 1 95.24 61.17 75.87 0.00 0.00
129
+ ATOM 129 C PTH 1 95.24 62.17 73.87 0.00 0.00
130
+ ATOM 130 C PTH 1 95.24 62.17 74.87 0.00 0.00
131
+ ATOM 131 C PTH 1 95.24 62.17 75.87 0.00 0.00
132
+ ATOM 132 C PTH 1 96.24 59.17 72.87 0.00 0.00
133
+ ATOM 133 C PTH 1 96.24 59.17 73.87 0.00 0.00
134
+ ATOM 134 C PTH 1 96.24 60.17 72.87 0.00 0.00
135
+ ATOM 135 C PTH 1 96.24 60.17 73.87 0.00 0.00
136
+ ATOM 136 C PTH 1 96.24 60.17 74.87 0.00 0.00
137
+ ATOM 137 C PTH 1 96.24 61.17 72.87 0.00 0.00
138
+ ATOM 138 C PTH 1 96.24 61.17 73.87 0.00 0.00
139
+ ATOM 139 C PTH 1 96.24 61.17 74.87 0.00 0.00
data/files/A00BV/structure.pdb ADDED
The diff for this file is too large to render. See raw diff
 
data/files/A00F8/pocket_01.pdb ADDED
@@ -0,0 +1,188 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 66.52 84.63 27.85 0.00 0.00
2
+ ATOM 2 C PTH 1 66.52 84.63 28.85 0.00 0.00
3
+ ATOM 3 C PTH 1 66.52 85.63 26.85 0.00 0.00
4
+ ATOM 4 C PTH 1 66.52 85.63 27.85 0.00 0.00
5
+ ATOM 5 C PTH 1 66.52 85.63 28.85 0.00 0.00
6
+ ATOM 6 C PTH 1 66.52 86.63 26.85 0.00 0.00
7
+ ATOM 7 C PTH 1 66.52 86.63 27.85 0.00 0.00
8
+ ATOM 8 C PTH 1 66.52 86.63 28.85 0.00 0.00
9
+ ATOM 9 C PTH 1 67.52 83.63 26.85 0.00 0.00
10
+ ATOM 10 C PTH 1 67.52 83.63 27.85 0.00 0.00
11
+ ATOM 11 C PTH 1 67.52 83.63 28.85 0.00 0.00
12
+ ATOM 12 C PTH 1 67.52 84.63 25.85 0.00 0.00
13
+ ATOM 13 C PTH 1 67.52 84.63 26.85 0.00 0.00
14
+ ATOM 14 C PTH 1 67.52 84.63 27.85 0.00 0.00
15
+ ATOM 15 C PTH 1 67.52 84.63 28.85 0.00 0.00
16
+ ATOM 16 C PTH 1 67.52 84.63 29.85 0.00 0.00
17
+ ATOM 17 C PTH 1 67.52 85.63 25.85 0.00 0.00
18
+ ATOM 18 C PTH 1 67.52 85.63 26.85 0.00 0.00
19
+ ATOM 19 C PTH 1 67.52 85.63 27.85 0.00 0.00
20
+ ATOM 20 C PTH 1 67.52 85.63 28.85 0.00 0.00
21
+ ATOM 21 C PTH 1 67.52 85.63 29.85 0.00 0.00
22
+ ATOM 22 C PTH 1 67.52 86.63 25.85 0.00 0.00
23
+ ATOM 23 C PTH 1 67.52 86.63 26.85 0.00 0.00
24
+ ATOM 24 C PTH 1 67.52 86.63 27.85 0.00 0.00
25
+ ATOM 25 C PTH 1 67.52 86.63 28.85 0.00 0.00
26
+ ATOM 26 C PTH 1 67.52 86.63 29.85 0.00 0.00
27
+ ATOM 27 C PTH 1 67.52 87.63 25.85 0.00 0.00
28
+ ATOM 28 C PTH 1 67.52 87.63 26.85 0.00 0.00
29
+ ATOM 29 C PTH 1 67.52 87.63 27.85 0.00 0.00
30
+ ATOM 30 C PTH 1 67.52 87.63 28.85 0.00 0.00
31
+ ATOM 31 C PTH 1 67.52 87.63 29.85 0.00 0.00
32
+ ATOM 32 C PTH 1 67.52 88.63 26.85 0.00 0.00
33
+ ATOM 33 C PTH 1 67.52 88.63 27.85 0.00 0.00
34
+ ATOM 34 C PTH 1 67.52 88.63 28.85 0.00 0.00
35
+ ATOM 35 C PTH 1 68.52 83.63 22.85 0.00 0.00
36
+ ATOM 36 C PTH 1 68.52 83.63 23.85 0.00 0.00
37
+ ATOM 37 C PTH 1 68.52 83.63 24.85 0.00 0.00
38
+ ATOM 38 C PTH 1 68.52 83.63 25.85 0.00 0.00
39
+ ATOM 39 C PTH 1 68.52 83.63 26.85 0.00 0.00
40
+ ATOM 40 C PTH 1 68.52 83.63 27.85 0.00 0.00
41
+ ATOM 41 C PTH 1 68.52 83.63 28.85 0.00 0.00
42
+ ATOM 42 C PTH 1 68.52 84.63 22.85 0.00 0.00
43
+ ATOM 43 C PTH 1 68.52 84.63 23.85 0.00 0.00
44
+ ATOM 44 C PTH 1 68.52 84.63 24.85 0.00 0.00
45
+ ATOM 45 C PTH 1 68.52 84.63 25.85 0.00 0.00
46
+ ATOM 46 C PTH 1 68.52 84.63 26.85 0.00 0.00
47
+ ATOM 47 C PTH 1 68.52 84.63 27.85 0.00 0.00
48
+ ATOM 48 C PTH 1 68.52 84.63 28.85 0.00 0.00
49
+ ATOM 49 C PTH 1 68.52 84.63 29.85 0.00 0.00
50
+ ATOM 50 C PTH 1 68.52 85.63 22.85 0.00 0.00
51
+ ATOM 51 C PTH 1 68.52 85.63 23.85 0.00 0.00
52
+ ATOM 52 C PTH 1 68.52 85.63 24.85 0.00 0.00
53
+ ATOM 53 C PTH 1 68.52 85.63 25.85 0.00 0.00
54
+ ATOM 54 C PTH 1 68.52 85.63 26.85 0.00 0.00
55
+ ATOM 55 C PTH 1 68.52 85.63 27.85 0.00 0.00
56
+ ATOM 56 C PTH 1 68.52 85.63 28.85 0.00 0.00
57
+ ATOM 57 C PTH 1 68.52 85.63 29.85 0.00 0.00
58
+ ATOM 58 C PTH 1 68.52 86.63 23.85 0.00 0.00
59
+ ATOM 59 C PTH 1 68.52 86.63 24.85 0.00 0.00
60
+ ATOM 60 C PTH 1 68.52 86.63 25.85 0.00 0.00
61
+ ATOM 61 C PTH 1 68.52 86.63 26.85 0.00 0.00
62
+ ATOM 62 C PTH 1 68.52 86.63 27.85 0.00 0.00
63
+ ATOM 63 C PTH 1 68.52 86.63 28.85 0.00 0.00
64
+ ATOM 64 C PTH 1 68.52 86.63 29.85 0.00 0.00
65
+ ATOM 65 C PTH 1 68.52 87.63 25.85 0.00 0.00
66
+ ATOM 66 C PTH 1 68.52 87.63 26.85 0.00 0.00
67
+ ATOM 67 C PTH 1 68.52 87.63 27.85 0.00 0.00
68
+ ATOM 68 C PTH 1 68.52 87.63 28.85 0.00 0.00
69
+ ATOM 69 C PTH 1 68.52 87.63 29.85 0.00 0.00
70
+ ATOM 70 C PTH 1 68.52 88.63 26.85 0.00 0.00
71
+ ATOM 71 C PTH 1 68.52 88.63 27.85 0.00 0.00
72
+ ATOM 72 C PTH 1 68.52 88.63 28.85 0.00 0.00
73
+ ATOM 73 C PTH 1 68.52 89.63 26.85 0.00 0.00
74
+ ATOM 74 C PTH 1 68.52 89.63 27.85 0.00 0.00
75
+ ATOM 75 C PTH 1 69.52 83.63 22.85 0.00 0.00
76
+ ATOM 76 C PTH 1 69.52 83.63 23.85 0.00 0.00
77
+ ATOM 77 C PTH 1 69.52 83.63 24.85 0.00 0.00
78
+ ATOM 78 C PTH 1 69.52 83.63 25.85 0.00 0.00
79
+ ATOM 79 C PTH 1 69.52 83.63 26.85 0.00 0.00
80
+ ATOM 80 C PTH 1 69.52 83.63 27.85 0.00 0.00
81
+ ATOM 81 C PTH 1 69.52 83.63 28.85 0.00 0.00
82
+ ATOM 82 C PTH 1 69.52 84.63 21.85 0.00 0.00
83
+ ATOM 83 C PTH 1 69.52 84.63 22.85 0.00 0.00
84
+ ATOM 84 C PTH 1 69.52 84.63 23.85 0.00 0.00
85
+ ATOM 85 C PTH 1 69.52 84.63 24.85 0.00 0.00
86
+ ATOM 86 C PTH 1 69.52 84.63 25.85 0.00 0.00
87
+ ATOM 87 C PTH 1 69.52 84.63 26.85 0.00 0.00
88
+ ATOM 88 C PTH 1 69.52 84.63 27.85 0.00 0.00
89
+ ATOM 89 C PTH 1 69.52 84.63 28.85 0.00 0.00
90
+ ATOM 90 C PTH 1 69.52 84.63 29.85 0.00 0.00
91
+ ATOM 91 C PTH 1 69.52 85.63 21.85 0.00 0.00
92
+ ATOM 92 C PTH 1 69.52 85.63 22.85 0.00 0.00
93
+ ATOM 93 C PTH 1 69.52 85.63 23.85 0.00 0.00
94
+ ATOM 94 C PTH 1 69.52 85.63 24.85 0.00 0.00
95
+ ATOM 95 C PTH 1 69.52 85.63 25.85 0.00 0.00
96
+ ATOM 96 C PTH 1 69.52 85.63 26.85 0.00 0.00
97
+ ATOM 97 C PTH 1 69.52 85.63 27.85 0.00 0.00
98
+ ATOM 98 C PTH 1 69.52 85.63 28.85 0.00 0.00
99
+ ATOM 99 C PTH 1 69.52 85.63 29.85 0.00 0.00
100
+ ATOM 100 C PTH 1 69.52 86.63 22.85 0.00 0.00
101
+ ATOM 101 C PTH 1 69.52 86.63 23.85 0.00 0.00
102
+ ATOM 102 C PTH 1 69.52 86.63 24.85 0.00 0.00
103
+ ATOM 103 C PTH 1 69.52 86.63 25.85 0.00 0.00
104
+ ATOM 104 C PTH 1 69.52 86.63 26.85 0.00 0.00
105
+ ATOM 105 C PTH 1 69.52 86.63 27.85 0.00 0.00
106
+ ATOM 106 C PTH 1 69.52 86.63 28.85 0.00 0.00
107
+ ATOM 107 C PTH 1 69.52 86.63 29.85 0.00 0.00
108
+ ATOM 108 C PTH 1 69.52 87.63 25.85 0.00 0.00
109
+ ATOM 109 C PTH 1 69.52 87.63 26.85 0.00 0.00
110
+ ATOM 110 C PTH 1 69.52 87.63 27.85 0.00 0.00
111
+ ATOM 111 C PTH 1 69.52 87.63 28.85 0.00 0.00
112
+ ATOM 112 C PTH 1 69.52 87.63 29.85 0.00 0.00
113
+ ATOM 113 C PTH 1 69.52 88.63 25.85 0.00 0.00
114
+ ATOM 114 C PTH 1 69.52 88.63 26.85 0.00 0.00
115
+ ATOM 115 C PTH 1 69.52 88.63 27.85 0.00 0.00
116
+ ATOM 116 C PTH 1 69.52 88.63 28.85 0.00 0.00
117
+ ATOM 117 C PTH 1 69.52 89.63 26.85 0.00 0.00
118
+ ATOM 118 C PTH 1 69.52 89.63 27.85 0.00 0.00
119
+ ATOM 119 C PTH 1 70.52 83.63 22.85 0.00 0.00
120
+ ATOM 120 C PTH 1 70.52 83.63 23.85 0.00 0.00
121
+ ATOM 121 C PTH 1 70.52 83.63 24.85 0.00 0.00
122
+ ATOM 122 C PTH 1 70.52 83.63 25.85 0.00 0.00
123
+ ATOM 123 C PTH 1 70.52 83.63 26.85 0.00 0.00
124
+ ATOM 124 C PTH 1 70.52 83.63 27.85 0.00 0.00
125
+ ATOM 125 C PTH 1 70.52 83.63 28.85 0.00 0.00
126
+ ATOM 126 C PTH 1 70.52 84.63 22.85 0.00 0.00
127
+ ATOM 127 C PTH 1 70.52 84.63 23.85 0.00 0.00
128
+ ATOM 128 C PTH 1 70.52 84.63 24.85 0.00 0.00
129
+ ATOM 129 C PTH 1 70.52 84.63 25.85 0.00 0.00
130
+ ATOM 130 C PTH 1 70.52 84.63 26.85 0.00 0.00
131
+ ATOM 131 C PTH 1 70.52 84.63 27.85 0.00 0.00
132
+ ATOM 132 C PTH 1 70.52 84.63 28.85 0.00 0.00
133
+ ATOM 133 C PTH 1 70.52 84.63 29.85 0.00 0.00
134
+ ATOM 134 C PTH 1 70.52 85.63 22.85 0.00 0.00
135
+ ATOM 135 C PTH 1 70.52 85.63 23.85 0.00 0.00
136
+ ATOM 136 C PTH 1 70.52 85.63 24.85 0.00 0.00
137
+ ATOM 137 C PTH 1 70.52 85.63 25.85 0.00 0.00
138
+ ATOM 138 C PTH 1 70.52 85.63 26.85 0.00 0.00
139
+ ATOM 139 C PTH 1 70.52 85.63 27.85 0.00 0.00
140
+ ATOM 140 C PTH 1 70.52 85.63 28.85 0.00 0.00
141
+ ATOM 141 C PTH 1 70.52 85.63 29.85 0.00 0.00
142
+ ATOM 142 C PTH 1 70.52 86.63 22.85 0.00 0.00
143
+ ATOM 143 C PTH 1 70.52 86.63 23.85 0.00 0.00
144
+ ATOM 144 C PTH 1 70.52 86.63 24.85 0.00 0.00
145
+ ATOM 145 C PTH 1 70.52 86.63 25.85 0.00 0.00
146
+ ATOM 146 C PTH 1 70.52 86.63 26.85 0.00 0.00
147
+ ATOM 147 C PTH 1 70.52 86.63 27.85 0.00 0.00
148
+ ATOM 148 C PTH 1 70.52 86.63 28.85 0.00 0.00
149
+ ATOM 149 C PTH 1 70.52 86.63 29.85 0.00 0.00
150
+ ATOM 150 C PTH 1 70.52 87.63 25.85 0.00 0.00
151
+ ATOM 151 C PTH 1 70.52 87.63 26.85 0.00 0.00
152
+ ATOM 152 C PTH 1 70.52 87.63 27.85 0.00 0.00
153
+ ATOM 153 C PTH 1 70.52 87.63 28.85 0.00 0.00
154
+ ATOM 154 C PTH 1 70.52 87.63 29.85 0.00 0.00
155
+ ATOM 155 C PTH 1 70.52 88.63 25.85 0.00 0.00
156
+ ATOM 156 C PTH 1 70.52 88.63 26.85 0.00 0.00
157
+ ATOM 157 C PTH 1 70.52 88.63 27.85 0.00 0.00
158
+ ATOM 158 C PTH 1 70.52 88.63 28.85 0.00 0.00
159
+ ATOM 159 C PTH 1 70.52 89.63 25.85 0.00 0.00
160
+ ATOM 160 C PTH 1 70.52 89.63 26.85 0.00 0.00
161
+ ATOM 161 C PTH 1 70.52 89.63 27.85 0.00 0.00
162
+ ATOM 162 C PTH 1 71.52 83.63 23.85 0.00 0.00
163
+ ATOM 163 C PTH 1 71.52 83.63 24.85 0.00 0.00
164
+ ATOM 164 C PTH 1 71.52 83.63 25.85 0.00 0.00
165
+ ATOM 165 C PTH 1 71.52 83.63 26.85 0.00 0.00
166
+ ATOM 166 C PTH 1 71.52 84.63 22.85 0.00 0.00
167
+ ATOM 167 C PTH 1 71.52 84.63 23.85 0.00 0.00
168
+ ATOM 168 C PTH 1 71.52 84.63 24.85 0.00 0.00
169
+ ATOM 169 C PTH 1 71.52 84.63 25.85 0.00 0.00
170
+ ATOM 170 C PTH 1 71.52 84.63 26.85 0.00 0.00
171
+ ATOM 171 C PTH 1 71.52 84.63 27.85 0.00 0.00
172
+ ATOM 172 C PTH 1 71.52 85.63 22.85 0.00 0.00
173
+ ATOM 173 C PTH 1 71.52 85.63 23.85 0.00 0.00
174
+ ATOM 174 C PTH 1 71.52 85.63 24.85 0.00 0.00
175
+ ATOM 175 C PTH 1 71.52 85.63 25.85 0.00 0.00
176
+ ATOM 176 C PTH 1 71.52 85.63 26.85 0.00 0.00
177
+ ATOM 177 C PTH 1 71.52 85.63 27.85 0.00 0.00
178
+ ATOM 178 C PTH 1 71.52 85.63 28.85 0.00 0.00
179
+ ATOM 179 C PTH 1 71.52 86.63 23.85 0.00 0.00
180
+ ATOM 180 C PTH 1 71.52 86.63 24.85 0.00 0.00
181
+ ATOM 181 C PTH 1 71.52 86.63 25.85 0.00 0.00
182
+ ATOM 182 C PTH 1 71.52 86.63 26.85 0.00 0.00
183
+ ATOM 183 C PTH 1 71.52 86.63 27.85 0.00 0.00
184
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185
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186
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188
+ ATOM 188 C PTH 1 71.52 87.63 28.85 0.00 0.00
data/files/A00F8/pocket_02.pdb ADDED
@@ -0,0 +1,71 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 65.52 52.63 38.85 0.00 0.00
2
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3
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+ ATOM 71 C PTH 1 68.52 54.63 41.85 0.00 0.00
data/files/A00F8/structure.pdb ADDED
The diff for this file is too large to render. See raw diff
 
data/files/A00FS/pocket_01.pdb ADDED
@@ -0,0 +1,128 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 141.04 115.63 60.36 0.00 0.00
2
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128
+ ATOM 128 C PTH 1 149.04 118.63 60.36 0.00 0.00
data/files/A00FS/pocket_02.pdb ADDED
@@ -0,0 +1,86 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 106.04 134.63 65.36 0.00 0.00
2
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3
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178
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179
+ ATOM 179 C PTH 1 60.24 73.38 35.83 0.00 0.00
180
+ ATOM 180 C PTH 1 60.24 73.38 36.83 0.00 0.00
181
+ ATOM 181 C PTH 1 60.24 73.38 37.83 0.00 0.00
182
+ ATOM 182 C PTH 1 60.24 73.38 38.83 0.00 0.00
183
+ ATOM 183 C PTH 1 60.24 73.38 39.83 0.00 0.00
184
+ ATOM 184 C PTH 1 60.24 74.38 31.83 0.00 0.00
185
+ ATOM 185 C PTH 1 60.24 74.38 32.83 0.00 0.00
186
+ ATOM 186 C PTH 1 60.24 74.38 33.83 0.00 0.00
187
+ ATOM 187 C PTH 1 60.24 74.38 34.83 0.00 0.00
188
+ ATOM 188 C PTH 1 60.24 74.38 35.83 0.00 0.00
189
+ ATOM 189 C PTH 1 60.24 74.38 36.83 0.00 0.00
190
+ ATOM 190 C PTH 1 60.24 74.38 37.83 0.00 0.00
191
+ ATOM 191 C PTH 1 60.24 74.38 38.83 0.00 0.00
192
+ ATOM 192 C PTH 1 60.24 74.38 39.83 0.00 0.00
193
+ ATOM 193 C PTH 1 60.24 75.38 31.83 0.00 0.00
194
+ ATOM 194 C PTH 1 60.24 75.38 32.83 0.00 0.00
195
+ ATOM 195 C PTH 1 60.24 75.38 33.83 0.00 0.00
196
+ ATOM 196 C PTH 1 60.24 75.38 34.83 0.00 0.00
197
+ ATOM 197 C PTH 1 60.24 75.38 35.83 0.00 0.00
198
+ ATOM 198 C PTH 1 60.24 75.38 36.83 0.00 0.00
199
+ ATOM 199 C PTH 1 60.24 75.38 37.83 0.00 0.00
200
+ ATOM 200 C PTH 1 60.24 75.38 38.83 0.00 0.00
201
+ ATOM 201 C PTH 1 60.24 75.38 39.83 0.00 0.00
202
+ ATOM 202 C PTH 1 60.24 76.38 31.83 0.00 0.00
203
+ ATOM 203 C PTH 1 60.24 76.38 32.83 0.00 0.00
204
+ ATOM 204 C PTH 1 60.24 76.38 33.83 0.00 0.00
205
+ ATOM 205 C PTH 1 60.24 76.38 34.83 0.00 0.00
206
+ ATOM 206 C PTH 1 60.24 76.38 35.83 0.00 0.00
207
+ ATOM 207 C PTH 1 60.24 76.38 36.83 0.00 0.00
208
+ ATOM 208 C PTH 1 60.24 76.38 37.83 0.00 0.00
209
+ ATOM 209 C PTH 1 60.24 77.38 31.83 0.00 0.00
210
+ ATOM 210 C PTH 1 60.24 77.38 32.83 0.00 0.00
211
+ ATOM 211 C PTH 1 60.24 77.38 33.83 0.00 0.00
212
+ ATOM 212 C PTH 1 60.24 77.38 34.83 0.00 0.00
213
+ ATOM 213 C PTH 1 60.24 77.38 35.83 0.00 0.00
214
+ ATOM 214 C PTH 1 60.24 77.38 36.83 0.00 0.00
215
+ ATOM 215 C PTH 1 60.24 78.38 32.83 0.00 0.00
216
+ ATOM 216 C PTH 1 60.24 78.38 33.83 0.00 0.00
217
+ ATOM 217 C PTH 1 60.24 78.38 34.83 0.00 0.00
218
+ ATOM 218 C PTH 1 60.24 78.38 35.83 0.00 0.00
219
+ ATOM 219 C PTH 1 60.24 79.38 33.83 0.00 0.00
220
+ ATOM 220 C PTH 1 60.24 79.38 34.83 0.00 0.00
221
+ ATOM 221 C PTH 1 61.24 68.38 32.83 0.00 0.00
222
+ ATOM 222 C PTH 1 61.24 68.38 33.83 0.00 0.00
223
+ ATOM 223 C PTH 1 61.24 68.38 34.83 0.00 0.00
224
+ ATOM 224 C PTH 1 61.24 69.38 32.83 0.00 0.00
225
+ ATOM 225 C PTH 1 61.24 69.38 33.83 0.00 0.00
226
+ ATOM 226 C PTH 1 61.24 69.38 34.83 0.00 0.00
227
+ ATOM 227 C PTH 1 61.24 69.38 35.83 0.00 0.00
228
+ ATOM 228 C PTH 1 61.24 70.38 32.83 0.00 0.00
229
+ ATOM 229 C PTH 1 61.24 70.38 33.83 0.00 0.00
230
+ ATOM 230 C PTH 1 61.24 70.38 34.83 0.00 0.00
231
+ ATOM 231 C PTH 1 61.24 70.38 35.83 0.00 0.00
232
+ ATOM 232 C PTH 1 61.24 71.38 31.83 0.00 0.00
233
+ ATOM 233 C PTH 1 61.24 71.38 32.83 0.00 0.00
234
+ ATOM 234 C PTH 1 61.24 71.38 33.83 0.00 0.00
235
+ ATOM 235 C PTH 1 61.24 71.38 34.83 0.00 0.00
236
+ ATOM 236 C PTH 1 61.24 71.38 35.83 0.00 0.00
237
+ ATOM 237 C PTH 1 61.24 71.38 36.83 0.00 0.00
238
+ ATOM 238 C PTH 1 61.24 72.38 31.83 0.00 0.00
239
+ ATOM 239 C PTH 1 61.24 72.38 32.83 0.00 0.00
240
+ ATOM 240 C PTH 1 61.24 72.38 33.83 0.00 0.00
241
+ ATOM 241 C PTH 1 61.24 72.38 34.83 0.00 0.00
242
+ ATOM 242 C PTH 1 61.24 72.38 35.83 0.00 0.00
243
+ ATOM 243 C PTH 1 61.24 72.38 36.83 0.00 0.00
244
+ ATOM 244 C PTH 1 61.24 72.38 37.83 0.00 0.00
245
+ ATOM 245 C PTH 1 61.24 72.38 38.83 0.00 0.00
246
+ ATOM 246 C PTH 1 61.24 73.38 31.83 0.00 0.00
247
+ ATOM 247 C PTH 1 61.24 73.38 32.83 0.00 0.00
248
+ ATOM 248 C PTH 1 61.24 73.38 33.83 0.00 0.00
249
+ ATOM 249 C PTH 1 61.24 73.38 34.83 0.00 0.00
250
+ ATOM 250 C PTH 1 61.24 73.38 35.83 0.00 0.00
251
+ ATOM 251 C PTH 1 61.24 73.38 36.83 0.00 0.00
252
+ ATOM 252 C PTH 1 61.24 73.38 37.83 0.00 0.00
253
+ ATOM 253 C PTH 1 61.24 73.38 38.83 0.00 0.00
254
+ ATOM 254 C PTH 1 61.24 73.38 39.83 0.00 0.00
255
+ ATOM 255 C PTH 1 61.24 74.38 31.83 0.00 0.00
256
+ ATOM 256 C PTH 1 61.24 74.38 32.83 0.00 0.00
257
+ ATOM 257 C PTH 1 61.24 74.38 33.83 0.00 0.00
258
+ ATOM 258 C PTH 1 61.24 74.38 34.83 0.00 0.00
259
+ ATOM 259 C PTH 1 61.24 74.38 35.83 0.00 0.00
260
+ ATOM 260 C PTH 1 61.24 74.38 36.83 0.00 0.00
261
+ ATOM 261 C PTH 1 61.24 74.38 37.83 0.00 0.00
262
+ ATOM 262 C PTH 1 61.24 74.38 38.83 0.00 0.00
263
+ ATOM 263 C PTH 1 61.24 74.38 39.83 0.00 0.00
264
+ ATOM 264 C PTH 1 61.24 75.38 31.83 0.00 0.00
265
+ ATOM 265 C PTH 1 61.24 75.38 32.83 0.00 0.00
266
+ ATOM 266 C PTH 1 61.24 75.38 33.83 0.00 0.00
267
+ ATOM 267 C PTH 1 61.24 75.38 34.83 0.00 0.00
268
+ ATOM 268 C PTH 1 61.24 75.38 35.83 0.00 0.00
269
+ ATOM 269 C PTH 1 61.24 75.38 36.83 0.00 0.00
270
+ ATOM 270 C PTH 1 61.24 75.38 37.83 0.00 0.00
271
+ ATOM 271 C PTH 1 61.24 75.38 38.83 0.00 0.00
272
+ ATOM 272 C PTH 1 61.24 75.38 39.83 0.00 0.00
273
+ ATOM 273 C PTH 1 61.24 75.38 40.83 0.00 0.00
274
+ ATOM 274 C PTH 1 61.24 76.38 31.83 0.00 0.00
275
+ ATOM 275 C PTH 1 61.24 76.38 32.83 0.00 0.00
276
+ ATOM 276 C PTH 1 61.24 76.38 33.83 0.00 0.00
277
+ ATOM 277 C PTH 1 61.24 76.38 34.83 0.00 0.00
278
+ ATOM 278 C PTH 1 61.24 76.38 35.83 0.00 0.00
279
+ ATOM 279 C PTH 1 61.24 76.38 36.83 0.00 0.00
280
+ ATOM 280 C PTH 1 61.24 77.38 31.83 0.00 0.00
281
+ ATOM 281 C PTH 1 61.24 77.38 32.83 0.00 0.00
282
+ ATOM 282 C PTH 1 61.24 77.38 33.83 0.00 0.00
283
+ ATOM 283 C PTH 1 61.24 77.38 34.83 0.00 0.00
284
+ ATOM 284 C PTH 1 61.24 77.38 35.83 0.00 0.00
285
+ ATOM 285 C PTH 1 61.24 78.38 32.83 0.00 0.00
286
+ ATOM 286 C PTH 1 61.24 78.38 33.83 0.00 0.00
287
+ ATOM 287 C PTH 1 61.24 78.38 34.83 0.00 0.00
288
+ ATOM 288 C PTH 1 61.24 78.38 35.83 0.00 0.00
289
+ ATOM 289 C PTH 1 62.24 68.38 33.83 0.00 0.00
290
+ ATOM 290 C PTH 1 62.24 69.38 32.83 0.00 0.00
291
+ ATOM 291 C PTH 1 62.24 69.38 33.83 0.00 0.00
292
+ ATOM 292 C PTH 1 62.24 69.38 34.83 0.00 0.00
293
+ ATOM 293 C PTH 1 62.24 69.38 35.83 0.00 0.00
294
+ ATOM 294 C PTH 1 62.24 70.38 32.83 0.00 0.00
295
+ ATOM 295 C PTH 1 62.24 70.38 33.83 0.00 0.00
296
+ ATOM 296 C PTH 1 62.24 70.38 34.83 0.00 0.00
297
+ ATOM 297 C PTH 1 62.24 70.38 35.83 0.00 0.00
298
+ ATOM 298 C PTH 1 62.24 70.38 36.83 0.00 0.00
299
+ ATOM 299 C PTH 1 62.24 71.38 31.83 0.00 0.00
300
+ ATOM 300 C PTH 1 62.24 71.38 32.83 0.00 0.00
301
+ ATOM 301 C PTH 1 62.24 71.38 33.83 0.00 0.00
302
+ ATOM 302 C PTH 1 62.24 71.38 34.83 0.00 0.00
303
+ ATOM 303 C PTH 1 62.24 71.38 35.83 0.00 0.00
304
+ ATOM 304 C PTH 1 62.24 71.38 36.83 0.00 0.00
305
+ ATOM 305 C PTH 1 62.24 71.38 37.83 0.00 0.00
306
+ ATOM 306 C PTH 1 62.24 72.38 31.83 0.00 0.00
307
+ ATOM 307 C PTH 1 62.24 72.38 32.83 0.00 0.00
308
+ ATOM 308 C PTH 1 62.24 72.38 33.83 0.00 0.00
309
+ ATOM 309 C PTH 1 62.24 72.38 34.83 0.00 0.00
310
+ ATOM 310 C PTH 1 62.24 72.38 35.83 0.00 0.00
311
+ ATOM 311 C PTH 1 62.24 72.38 36.83 0.00 0.00
312
+ ATOM 312 C PTH 1 62.24 72.38 37.83 0.00 0.00
313
+ ATOM 313 C PTH 1 62.24 72.38 38.83 0.00 0.00
314
+ ATOM 314 C PTH 1 62.24 72.38 39.83 0.00 0.00
315
+ ATOM 315 C PTH 1 62.24 73.38 31.83 0.00 0.00
316
+ ATOM 316 C PTH 1 62.24 73.38 32.83 0.00 0.00
317
+ ATOM 317 C PTH 1 62.24 73.38 33.83 0.00 0.00
318
+ ATOM 318 C PTH 1 62.24 73.38 34.83 0.00 0.00
319
+ ATOM 319 C PTH 1 62.24 73.38 35.83 0.00 0.00
320
+ ATOM 320 C PTH 1 62.24 73.38 36.83 0.00 0.00
321
+ ATOM 321 C PTH 1 62.24 73.38 37.83 0.00 0.00
322
+ ATOM 322 C PTH 1 62.24 73.38 38.83 0.00 0.00
323
+ ATOM 323 C PTH 1 62.24 73.38 39.83 0.00 0.00
324
+ ATOM 324 C PTH 1 62.24 74.38 31.83 0.00 0.00
325
+ ATOM 325 C PTH 1 62.24 74.38 32.83 0.00 0.00
326
+ ATOM 326 C PTH 1 62.24 74.38 33.83 0.00 0.00
327
+ ATOM 327 C PTH 1 62.24 74.38 34.83 0.00 0.00
328
+ ATOM 328 C PTH 1 62.24 74.38 35.83 0.00 0.00
329
+ ATOM 329 C PTH 1 62.24 74.38 36.83 0.00 0.00
330
+ ATOM 330 C PTH 1 62.24 74.38 37.83 0.00 0.00
331
+ ATOM 331 C PTH 1 62.24 74.38 38.83 0.00 0.00
332
+ ATOM 332 C PTH 1 62.24 74.38 39.83 0.00 0.00
333
+ ATOM 333 C PTH 1 62.24 75.38 32.83 0.00 0.00
334
+ ATOM 334 C PTH 1 62.24 75.38 33.83 0.00 0.00
335
+ ATOM 335 C PTH 1 62.24 75.38 34.83 0.00 0.00
336
+ ATOM 336 C PTH 1 62.24 75.38 35.83 0.00 0.00
337
+ ATOM 337 C PTH 1 62.24 75.38 36.83 0.00 0.00
338
+ ATOM 338 C PTH 1 62.24 75.38 37.83 0.00 0.00
339
+ ATOM 339 C PTH 1 62.24 75.38 38.83 0.00 0.00
340
+ ATOM 340 C PTH 1 62.24 75.38 39.83 0.00 0.00
341
+ ATOM 341 C PTH 1 62.24 76.38 32.83 0.00 0.00
342
+ ATOM 342 C PTH 1 62.24 76.38 33.83 0.00 0.00
343
+ ATOM 343 C PTH 1 62.24 76.38 34.83 0.00 0.00
344
+ ATOM 344 C PTH 1 62.24 76.38 35.83 0.00 0.00
345
+ ATOM 345 C PTH 1 62.24 76.38 36.83 0.00 0.00
346
+ ATOM 346 C PTH 1 62.24 77.38 32.83 0.00 0.00
347
+ ATOM 347 C PTH 1 62.24 77.38 33.83 0.00 0.00
348
+ ATOM 348 C PTH 1 62.24 77.38 34.83 0.00 0.00
349
+ ATOM 349 C PTH 1 62.24 77.38 35.83 0.00 0.00
350
+ ATOM 350 C PTH 1 62.24 78.38 32.83 0.00 0.00
351
+ ATOM 351 C PTH 1 62.24 78.38 33.83 0.00 0.00
352
+ ATOM 352 C PTH 1 62.24 78.38 34.83 0.00 0.00
353
+ ATOM 353 C PTH 1 62.24 78.38 35.83 0.00 0.00
354
+ ATOM 354 C PTH 1 63.24 69.38 32.83 0.00 0.00
355
+ ATOM 355 C PTH 1 63.24 69.38 33.83 0.00 0.00
356
+ ATOM 356 C PTH 1 63.24 69.38 34.83 0.00 0.00
357
+ ATOM 357 C PTH 1 63.24 69.38 35.83 0.00 0.00
358
+ ATOM 358 C PTH 1 63.24 70.38 32.83 0.00 0.00
359
+ ATOM 359 C PTH 1 63.24 70.38 33.83 0.00 0.00
360
+ ATOM 360 C PTH 1 63.24 70.38 34.83 0.00 0.00
361
+ ATOM 361 C PTH 1 63.24 70.38 35.83 0.00 0.00
362
+ ATOM 362 C PTH 1 63.24 70.38 36.83 0.00 0.00
363
+ ATOM 363 C PTH 1 63.24 70.38 37.83 0.00 0.00
364
+ ATOM 364 C PTH 1 63.24 70.38 38.83 0.00 0.00
365
+ ATOM 365 C PTH 1 63.24 71.38 31.83 0.00 0.00
366
+ ATOM 366 C PTH 1 63.24 71.38 32.83 0.00 0.00
367
+ ATOM 367 C PTH 1 63.24 71.38 33.83 0.00 0.00
368
+ ATOM 368 C PTH 1 63.24 71.38 34.83 0.00 0.00
369
+ ATOM 369 C PTH 1 63.24 71.38 35.83 0.00 0.00
370
+ ATOM 370 C PTH 1 63.24 71.38 36.83 0.00 0.00
371
+ ATOM 371 C PTH 1 63.24 71.38 37.83 0.00 0.00
372
+ ATOM 372 C PTH 1 63.24 71.38 38.83 0.00 0.00
373
+ ATOM 373 C PTH 1 63.24 71.38 39.83 0.00 0.00
374
+ ATOM 374 C PTH 1 63.24 72.38 31.83 0.00 0.00
375
+ ATOM 375 C PTH 1 63.24 72.38 32.83 0.00 0.00
376
+ ATOM 376 C PTH 1 63.24 72.38 33.83 0.00 0.00
377
+ ATOM 377 C PTH 1 63.24 72.38 34.83 0.00 0.00
378
+ ATOM 378 C PTH 1 63.24 72.38 35.83 0.00 0.00
379
+ ATOM 379 C PTH 1 63.24 72.38 36.83 0.00 0.00
380
+ ATOM 380 C PTH 1 63.24 72.38 37.83 0.00 0.00
381
+ ATOM 381 C PTH 1 63.24 72.38 38.83 0.00 0.00
382
+ ATOM 382 C PTH 1 63.24 72.38 39.83 0.00 0.00
383
+ ATOM 383 C PTH 1 63.24 73.38 31.83 0.00 0.00
384
+ ATOM 384 C PTH 1 63.24 73.38 32.83 0.00 0.00
385
+ ATOM 385 C PTH 1 63.24 73.38 33.83 0.00 0.00
386
+ ATOM 386 C PTH 1 63.24 73.38 34.83 0.00 0.00
387
+ ATOM 387 C PTH 1 63.24 73.38 35.83 0.00 0.00
388
+ ATOM 388 C PTH 1 63.24 73.38 36.83 0.00 0.00
389
+ ATOM 389 C PTH 1 63.24 73.38 37.83 0.00 0.00
390
+ ATOM 390 C PTH 1 63.24 73.38 38.83 0.00 0.00
391
+ ATOM 391 C PTH 1 63.24 73.38 39.83 0.00 0.00
392
+ ATOM 392 C PTH 1 63.24 74.38 32.83 0.00 0.00
393
+ ATOM 393 C PTH 1 63.24 74.38 33.83 0.00 0.00
394
+ ATOM 394 C PTH 1 63.24 74.38 34.83 0.00 0.00
395
+ ATOM 395 C PTH 1 63.24 74.38 35.83 0.00 0.00
396
+ ATOM 396 C PTH 1 63.24 74.38 36.83 0.00 0.00
397
+ ATOM 397 C PTH 1 63.24 74.38 37.83 0.00 0.00
398
+ ATOM 398 C PTH 1 63.24 74.38 38.83 0.00 0.00
399
+ ATOM 399 C PTH 1 63.24 74.38 39.83 0.00 0.00
400
+ ATOM 400 C PTH 1 63.24 75.38 32.83 0.00 0.00
401
+ ATOM 401 C PTH 1 63.24 75.38 33.83 0.00 0.00
402
+ ATOM 402 C PTH 1 63.24 75.38 34.83 0.00 0.00
403
+ ATOM 403 C PTH 1 63.24 75.38 35.83 0.00 0.00
404
+ ATOM 404 C PTH 1 63.24 75.38 36.83 0.00 0.00
405
+ ATOM 405 C PTH 1 63.24 75.38 37.83 0.00 0.00
406
+ ATOM 406 C PTH 1 63.24 75.38 38.83 0.00 0.00
407
+ ATOM 407 C PTH 1 63.24 75.38 39.83 0.00 0.00
408
+ ATOM 408 C PTH 1 63.24 76.38 32.83 0.00 0.00
409
+ ATOM 409 C PTH 1 63.24 76.38 33.83 0.00 0.00
410
+ ATOM 410 C PTH 1 63.24 76.38 34.83 0.00 0.00
411
+ ATOM 411 C PTH 1 63.24 76.38 35.83 0.00 0.00
412
+ ATOM 412 C PTH 1 63.24 76.38 36.83 0.00 0.00
413
+ ATOM 413 C PTH 1 63.24 77.38 32.83 0.00 0.00
414
+ ATOM 414 C PTH 1 63.24 77.38 33.83 0.00 0.00
415
+ ATOM 415 C PTH 1 63.24 77.38 34.83 0.00 0.00
416
+ ATOM 416 C PTH 1 63.24 77.38 35.83 0.00 0.00
417
+ ATOM 417 C PTH 1 64.24 69.38 33.83 0.00 0.00
418
+ ATOM 418 C PTH 1 64.24 69.38 34.83 0.00 0.00
419
+ ATOM 419 C PTH 1 64.24 69.38 35.83 0.00 0.00
420
+ ATOM 420 C PTH 1 64.24 69.38 36.83 0.00 0.00
421
+ ATOM 421 C PTH 1 64.24 70.38 32.83 0.00 0.00
422
+ ATOM 422 C PTH 1 64.24 70.38 33.83 0.00 0.00
423
+ ATOM 423 C PTH 1 64.24 70.38 34.83 0.00 0.00
424
+ ATOM 424 C PTH 1 64.24 70.38 35.83 0.00 0.00
425
+ ATOM 425 C PTH 1 64.24 70.38 36.83 0.00 0.00
426
+ ATOM 426 C PTH 1 64.24 70.38 37.83 0.00 0.00
427
+ ATOM 427 C PTH 1 64.24 70.38 38.83 0.00 0.00
428
+ ATOM 428 C PTH 1 64.24 70.38 39.83 0.00 0.00
429
+ ATOM 429 C PTH 1 64.24 71.38 31.83 0.00 0.00
430
+ ATOM 430 C PTH 1 64.24 71.38 32.83 0.00 0.00
431
+ ATOM 431 C PTH 1 64.24 71.38 33.83 0.00 0.00
432
+ ATOM 432 C PTH 1 64.24 71.38 34.83 0.00 0.00
433
+ ATOM 433 C PTH 1 64.24 71.38 35.83 0.00 0.00
434
+ ATOM 434 C PTH 1 64.24 71.38 36.83 0.00 0.00
435
+ ATOM 435 C PTH 1 64.24 71.38 37.83 0.00 0.00
436
+ ATOM 436 C PTH 1 64.24 71.38 38.83 0.00 0.00
437
+ ATOM 437 C PTH 1 64.24 71.38 39.83 0.00 0.00
438
+ ATOM 438 C PTH 1 64.24 72.38 31.83 0.00 0.00
439
+ ATOM 439 C PTH 1 64.24 72.38 32.83 0.00 0.00
440
+ ATOM 440 C PTH 1 64.24 72.38 33.83 0.00 0.00
441
+ ATOM 441 C PTH 1 64.24 72.38 34.83 0.00 0.00
442
+ ATOM 442 C PTH 1 64.24 72.38 35.83 0.00 0.00
443
+ ATOM 443 C PTH 1 64.24 72.38 36.83 0.00 0.00
444
+ ATOM 444 C PTH 1 64.24 72.38 37.83 0.00 0.00
445
+ ATOM 445 C PTH 1 64.24 72.38 38.83 0.00 0.00
446
+ ATOM 446 C PTH 1 64.24 72.38 39.83 0.00 0.00
447
+ ATOM 447 C PTH 1 64.24 73.38 31.83 0.00 0.00
448
+ ATOM 448 C PTH 1 64.24 73.38 32.83 0.00 0.00
449
+ ATOM 449 C PTH 1 64.24 73.38 33.83 0.00 0.00
450
+ ATOM 450 C PTH 1 64.24 73.38 34.83 0.00 0.00
451
+ ATOM 451 C PTH 1 64.24 73.38 35.83 0.00 0.00
452
+ ATOM 452 C PTH 1 64.24 73.38 36.83 0.00 0.00
453
+ ATOM 453 C PTH 1 64.24 73.38 37.83 0.00 0.00
454
+ ATOM 454 C PTH 1 64.24 73.38 38.83 0.00 0.00
455
+ ATOM 455 C PTH 1 64.24 73.38 39.83 0.00 0.00
456
+ ATOM 456 C PTH 1 64.24 73.38 40.83 0.00 0.00
457
+ ATOM 457 C PTH 1 64.24 74.38 32.83 0.00 0.00
458
+ ATOM 458 C PTH 1 64.24 74.38 33.83 0.00 0.00
459
+ ATOM 459 C PTH 1 64.24 74.38 34.83 0.00 0.00
460
+ ATOM 460 C PTH 1 64.24 74.38 35.83 0.00 0.00
461
+ ATOM 461 C PTH 1 64.24 74.38 36.83 0.00 0.00
462
+ ATOM 462 C PTH 1 64.24 74.38 37.83 0.00 0.00
463
+ ATOM 463 C PTH 1 64.24 74.38 38.83 0.00 0.00
464
+ ATOM 464 C PTH 1 64.24 74.38 39.83 0.00 0.00
465
+ ATOM 465 C PTH 1 64.24 75.38 32.83 0.00 0.00
466
+ ATOM 466 C PTH 1 64.24 75.38 33.83 0.00 0.00
467
+ ATOM 467 C PTH 1 64.24 75.38 34.83 0.00 0.00
468
+ ATOM 468 C PTH 1 64.24 75.38 35.83 0.00 0.00
469
+ ATOM 469 C PTH 1 64.24 75.38 36.83 0.00 0.00
470
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471
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472
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473
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474
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475
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476
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477
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478
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479
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480
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481
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482
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483
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484
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485
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486
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487
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488
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489
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490
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491
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492
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493
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494
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495
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496
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497
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498
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499
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500
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501
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502
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503
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504
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505
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506
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507
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508
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509
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510
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511
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512
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513
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514
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515
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516
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517
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518
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519
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520
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521
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522
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523
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524
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525
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526
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527
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528
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529
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530
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531
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532
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533
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534
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535
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536
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537
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538
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539
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540
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541
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542
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543
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544
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545
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546
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547
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548
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549
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550
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551
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552
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553
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554
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555
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556
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557
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558
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559
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560
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561
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562
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563
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564
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565
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566
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567
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568
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569
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570
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571
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572
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573
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574
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575
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576
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577
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578
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579
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580
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581
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582
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583
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584
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585
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586
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587
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588
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589
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590
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591
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592
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593
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594
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595
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596
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598
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599
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600
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601
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602
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603
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604
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605
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606
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607
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608
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609
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610
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611
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612
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613
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614
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615
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616
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617
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618
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619
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620
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621
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622
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623
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624
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625
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626
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627
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628
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629
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630
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631
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632
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633
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634
+ ATOM 634 C PTH 1 68.24 75.38 34.83 0.00 0.00
data/files/A00G2/pocket_02.pdb ADDED
@@ -0,0 +1,423 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 52.24 61.38 27.83 0.00 0.00
2
+ ATOM 2 C PTH 1 52.24 62.38 26.83 0.00 0.00
3
+ ATOM 3 C PTH 1 52.24 62.38 27.83 0.00 0.00
4
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5
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6
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7
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8
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9
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10
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11
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12
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13
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14
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15
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16
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17
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18
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19
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20
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21
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22
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23
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24
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25
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26
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27
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28
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29
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30
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31
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32
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33
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34
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35
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36
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37
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38
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39
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40
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41
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42
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43
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44
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45
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46
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47
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48
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49
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50
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51
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52
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53
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54
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55
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56
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57
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58
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59
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60
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61
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62
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63
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64
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65
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66
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67
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68
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69
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70
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71
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72
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73
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74
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75
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76
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77
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78
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79
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80
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81
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82
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83
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84
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85
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86
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87
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88
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89
+ ATOM 89 C PTH 1 54.24 65.38 23.83 0.00 0.00
90
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91
+ ATOM 91 C PTH 1 54.24 65.38 25.83 0.00 0.00
92
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93
+ ATOM 93 C PTH 1 54.24 66.38 21.83 0.00 0.00
94
+ ATOM 94 C PTH 1 54.24 66.38 22.83 0.00 0.00
95
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96
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97
+ ATOM 97 C PTH 1 54.24 66.38 25.83 0.00 0.00
98
+ ATOM 98 C PTH 1 54.24 66.38 26.83 0.00 0.00
99
+ ATOM 99 C PTH 1 54.24 67.38 21.83 0.00 0.00
100
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101
+ ATOM 101 C PTH 1 54.24 67.38 23.83 0.00 0.00
102
+ ATOM 102 C PTH 1 54.24 67.38 24.83 0.00 0.00
103
+ ATOM 103 C PTH 1 54.24 67.38 25.83 0.00 0.00
104
+ ATOM 104 C PTH 1 55.24 61.38 25.83 0.00 0.00
105
+ ATOM 105 C PTH 1 55.24 61.38 26.83 0.00 0.00
106
+ ATOM 106 C PTH 1 55.24 62.38 22.83 0.00 0.00
107
+ ATOM 107 C PTH 1 55.24 62.38 23.83 0.00 0.00
108
+ ATOM 108 C PTH 1 55.24 62.38 24.83 0.00 0.00
109
+ ATOM 109 C PTH 1 55.24 62.38 25.83 0.00 0.00
110
+ ATOM 110 C PTH 1 55.24 62.38 26.83 0.00 0.00
111
+ ATOM 111 C PTH 1 55.24 63.38 21.83 0.00 0.00
112
+ ATOM 112 C PTH 1 55.24 63.38 22.83 0.00 0.00
113
+ ATOM 113 C PTH 1 55.24 63.38 23.83 0.00 0.00
114
+ ATOM 114 C PTH 1 55.24 63.38 24.83 0.00 0.00
115
+ ATOM 115 C PTH 1 55.24 63.38 25.83 0.00 0.00
116
+ ATOM 116 C PTH 1 55.24 63.38 26.83 0.00 0.00
117
+ ATOM 117 C PTH 1 55.24 64.38 21.83 0.00 0.00
118
+ ATOM 118 C PTH 1 55.24 64.38 22.83 0.00 0.00
119
+ ATOM 119 C PTH 1 55.24 64.38 23.83 0.00 0.00
120
+ ATOM 120 C PTH 1 55.24 64.38 24.83 0.00 0.00
121
+ ATOM 121 C PTH 1 55.24 64.38 25.83 0.00 0.00
122
+ ATOM 122 C PTH 1 55.24 64.38 26.83 0.00 0.00
123
+ ATOM 123 C PTH 1 55.24 65.38 21.83 0.00 0.00
124
+ ATOM 124 C PTH 1 55.24 65.38 22.83 0.00 0.00
125
+ ATOM 125 C PTH 1 55.24 65.38 23.83 0.00 0.00
126
+ ATOM 126 C PTH 1 55.24 65.38 24.83 0.00 0.00
127
+ ATOM 127 C PTH 1 55.24 65.38 25.83 0.00 0.00
128
+ ATOM 128 C PTH 1 55.24 65.38 26.83 0.00 0.00
129
+ ATOM 129 C PTH 1 55.24 66.38 21.83 0.00 0.00
130
+ ATOM 130 C PTH 1 55.24 66.38 22.83 0.00 0.00
131
+ ATOM 131 C PTH 1 55.24 66.38 23.83 0.00 0.00
132
+ ATOM 132 C PTH 1 55.24 66.38 24.83 0.00 0.00
133
+ ATOM 133 C PTH 1 55.24 66.38 25.83 0.00 0.00
134
+ ATOM 134 C PTH 1 55.24 66.38 26.83 0.00 0.00
135
+ ATOM 135 C PTH 1 55.24 67.38 23.83 0.00 0.00
136
+ ATOM 136 C PTH 1 55.24 67.38 24.83 0.00 0.00
137
+ ATOM 137 C PTH 1 55.24 67.38 25.83 0.00 0.00
138
+ ATOM 138 C PTH 1 56.24 61.38 25.83 0.00 0.00
139
+ ATOM 139 C PTH 1 56.24 62.38 22.83 0.00 0.00
140
+ ATOM 140 C PTH 1 56.24 62.38 23.83 0.00 0.00
141
+ ATOM 141 C PTH 1 56.24 62.38 24.83 0.00 0.00
142
+ ATOM 142 C PTH 1 56.24 62.38 25.83 0.00 0.00
143
+ ATOM 143 C PTH 1 56.24 62.38 26.83 0.00 0.00
144
+ ATOM 144 C PTH 1 56.24 63.38 21.83 0.00 0.00
145
+ ATOM 145 C PTH 1 56.24 63.38 22.83 0.00 0.00
146
+ ATOM 146 C PTH 1 56.24 63.38 23.83 0.00 0.00
147
+ ATOM 147 C PTH 1 56.24 63.38 24.83 0.00 0.00
148
+ ATOM 148 C PTH 1 56.24 63.38 25.83 0.00 0.00
149
+ ATOM 149 C PTH 1 56.24 63.38 26.83 0.00 0.00
150
+ ATOM 150 C PTH 1 56.24 64.38 21.83 0.00 0.00
151
+ ATOM 151 C PTH 1 56.24 64.38 22.83 0.00 0.00
152
+ ATOM 152 C PTH 1 56.24 64.38 23.83 0.00 0.00
153
+ ATOM 153 C PTH 1 56.24 64.38 24.83 0.00 0.00
154
+ ATOM 154 C PTH 1 56.24 64.38 25.83 0.00 0.00
155
+ ATOM 155 C PTH 1 56.24 64.38 26.83 0.00 0.00
156
+ ATOM 156 C PTH 1 56.24 65.38 21.83 0.00 0.00
157
+ ATOM 157 C PTH 1 56.24 65.38 22.83 0.00 0.00
158
+ ATOM 158 C PTH 1 56.24 65.38 23.83 0.00 0.00
159
+ ATOM 159 C PTH 1 56.24 65.38 24.83 0.00 0.00
160
+ ATOM 160 C PTH 1 56.24 65.38 25.83 0.00 0.00
161
+ ATOM 161 C PTH 1 56.24 65.38 26.83 0.00 0.00
162
+ ATOM 162 C PTH 1 56.24 66.38 21.83 0.00 0.00
163
+ ATOM 163 C PTH 1 56.24 66.38 22.83 0.00 0.00
164
+ ATOM 164 C PTH 1 56.24 66.38 23.83 0.00 0.00
165
+ ATOM 165 C PTH 1 56.24 66.38 24.83 0.00 0.00
166
+ ATOM 166 C PTH 1 56.24 66.38 25.83 0.00 0.00
167
+ ATOM 167 C PTH 1 57.24 62.38 22.83 0.00 0.00
168
+ ATOM 168 C PTH 1 57.24 62.38 23.83 0.00 0.00
169
+ ATOM 169 C PTH 1 57.24 62.38 24.83 0.00 0.00
170
+ ATOM 170 C PTH 1 57.24 62.38 25.83 0.00 0.00
171
+ ATOM 171 C PTH 1 57.24 63.38 22.83 0.00 0.00
172
+ ATOM 172 C PTH 1 57.24 63.38 23.83 0.00 0.00
173
+ ATOM 173 C PTH 1 57.24 63.38 24.83 0.00 0.00
174
+ ATOM 174 C PTH 1 57.24 63.38 25.83 0.00 0.00
175
+ ATOM 175 C PTH 1 57.24 64.38 21.83 0.00 0.00
176
+ ATOM 176 C PTH 1 57.24 64.38 22.83 0.00 0.00
177
+ ATOM 177 C PTH 1 57.24 64.38 23.83 0.00 0.00
178
+ ATOM 178 C PTH 1 57.24 64.38 24.83 0.00 0.00
179
+ ATOM 179 C PTH 1 57.24 64.38 25.83 0.00 0.00
180
+ ATOM 180 C PTH 1 57.24 65.38 21.83 0.00 0.00
181
+ ATOM 181 C PTH 1 57.24 65.38 22.83 0.00 0.00
182
+ ATOM 182 C PTH 1 57.24 65.38 23.83 0.00 0.00
183
+ ATOM 183 C PTH 1 57.24 65.38 24.83 0.00 0.00
184
+ ATOM 184 C PTH 1 57.24 65.38 25.83 0.00 0.00
185
+ ATOM 185 C PTH 1 57.24 66.38 23.83 0.00 0.00
186
+ ATOM 186 C PTH 1 58.24 61.38 23.83 0.00 0.00
187
+ ATOM 187 C PTH 1 58.24 61.38 24.83 0.00 0.00
188
+ ATOM 188 C PTH 1 58.24 62.38 22.83 0.00 0.00
189
+ ATOM 189 C PTH 1 58.24 62.38 23.83 0.00 0.00
190
+ ATOM 190 C PTH 1 58.24 62.38 24.83 0.00 0.00
191
+ ATOM 191 C PTH 1 58.24 62.38 25.83 0.00 0.00
192
+ ATOM 192 C PTH 1 58.24 63.38 22.83 0.00 0.00
193
+ ATOM 193 C PTH 1 58.24 63.38 23.83 0.00 0.00
194
+ ATOM 194 C PTH 1 58.24 63.38 24.83 0.00 0.00
195
+ ATOM 195 C PTH 1 58.24 63.38 25.83 0.00 0.00
196
+ ATOM 196 C PTH 1 58.24 64.38 21.83 0.00 0.00
197
+ ATOM 197 C PTH 1 58.24 64.38 22.83 0.00 0.00
198
+ ATOM 198 C PTH 1 58.24 64.38 23.83 0.00 0.00
199
+ ATOM 199 C PTH 1 58.24 64.38 24.83 0.00 0.00
200
+ ATOM 200 C PTH 1 58.24 64.38 25.83 0.00 0.00
201
+ ATOM 201 C PTH 1 58.24 65.38 22.83 0.00 0.00
202
+ ATOM 202 C PTH 1 58.24 65.38 23.83 0.00 0.00
203
+ ATOM 203 C PTH 1 58.24 65.38 24.83 0.00 0.00
204
+ ATOM 204 C PTH 1 58.24 65.38 25.83 0.00 0.00
205
+ ATOM 205 C PTH 1 58.24 65.38 26.83 0.00 0.00
206
+ ATOM 206 C PTH 1 58.24 66.38 23.83 0.00 0.00
207
+ ATOM 207 C PTH 1 58.24 66.38 24.83 0.00 0.00
208
+ ATOM 208 C PTH 1 58.24 66.38 25.83 0.00 0.00
209
+ ATOM 209 C PTH 1 58.24 66.38 26.83 0.00 0.00
210
+ ATOM 210 C PTH 1 58.24 67.38 24.83 0.00 0.00
211
+ ATOM 211 C PTH 1 58.24 67.38 25.83 0.00 0.00
212
+ ATOM 212 C PTH 1 58.24 67.38 26.83 0.00 0.00
213
+ ATOM 213 C PTH 1 59.24 60.38 23.83 0.00 0.00
214
+ ATOM 214 C PTH 1 59.24 60.38 24.83 0.00 0.00
215
+ ATOM 215 C PTH 1 59.24 60.38 25.83 0.00 0.00
216
+ ATOM 216 C PTH 1 59.24 61.38 22.83 0.00 0.00
217
+ ATOM 217 C PTH 1 59.24 61.38 23.83 0.00 0.00
218
+ ATOM 218 C PTH 1 59.24 61.38 24.83 0.00 0.00
219
+ ATOM 219 C PTH 1 59.24 61.38 25.83 0.00 0.00
220
+ ATOM 220 C PTH 1 59.24 62.38 21.83 0.00 0.00
221
+ ATOM 221 C PTH 1 59.24 62.38 22.83 0.00 0.00
222
+ ATOM 222 C PTH 1 59.24 62.38 23.83 0.00 0.00
223
+ ATOM 223 C PTH 1 59.24 62.38 24.83 0.00 0.00
224
+ ATOM 224 C PTH 1 59.24 62.38 25.83 0.00 0.00
225
+ ATOM 225 C PTH 1 59.24 63.38 21.83 0.00 0.00
226
+ ATOM 226 C PTH 1 59.24 63.38 22.83 0.00 0.00
227
+ ATOM 227 C PTH 1 59.24 63.38 23.83 0.00 0.00
228
+ ATOM 228 C PTH 1 59.24 63.38 24.83 0.00 0.00
229
+ ATOM 229 C PTH 1 59.24 63.38 25.83 0.00 0.00
230
+ ATOM 230 C PTH 1 59.24 64.38 21.83 0.00 0.00
231
+ ATOM 231 C PTH 1 59.24 64.38 22.83 0.00 0.00
232
+ ATOM 232 C PTH 1 59.24 64.38 23.83 0.00 0.00
233
+ ATOM 233 C PTH 1 59.24 64.38 24.83 0.00 0.00
234
+ ATOM 234 C PTH 1 59.24 64.38 25.83 0.00 0.00
235
+ ATOM 235 C PTH 1 59.24 64.38 26.83 0.00 0.00
236
+ ATOM 236 C PTH 1 59.24 65.38 21.83 0.00 0.00
237
+ ATOM 237 C PTH 1 59.24 65.38 22.83 0.00 0.00
238
+ ATOM 238 C PTH 1 59.24 65.38 23.83 0.00 0.00
239
+ ATOM 239 C PTH 1 59.24 65.38 24.83 0.00 0.00
240
+ ATOM 240 C PTH 1 59.24 65.38 25.83 0.00 0.00
241
+ ATOM 241 C PTH 1 59.24 65.38 26.83 0.00 0.00
242
+ ATOM 242 C PTH 1 59.24 66.38 22.83 0.00 0.00
243
+ ATOM 243 C PTH 1 59.24 66.38 23.83 0.00 0.00
244
+ ATOM 244 C PTH 1 59.24 66.38 24.83 0.00 0.00
245
+ ATOM 245 C PTH 1 59.24 66.38 25.83 0.00 0.00
246
+ ATOM 246 C PTH 1 59.24 66.38 26.83 0.00 0.00
247
+ ATOM 247 C PTH 1 59.24 67.38 23.83 0.00 0.00
248
+ ATOM 248 C PTH 1 59.24 67.38 24.83 0.00 0.00
249
+ ATOM 249 C PTH 1 59.24 67.38 25.83 0.00 0.00
250
+ ATOM 250 C PTH 1 59.24 67.38 26.83 0.00 0.00
251
+ ATOM 251 C PTH 1 60.24 59.38 22.83 0.00 0.00
252
+ ATOM 252 C PTH 1 60.24 59.38 23.83 0.00 0.00
253
+ ATOM 253 C PTH 1 60.24 59.38 24.83 0.00 0.00
254
+ ATOM 254 C PTH 1 60.24 59.38 25.83 0.00 0.00
255
+ ATOM 255 C PTH 1 60.24 60.38 22.83 0.00 0.00
256
+ ATOM 256 C PTH 1 60.24 60.38 23.83 0.00 0.00
257
+ ATOM 257 C PTH 1 60.24 60.38 24.83 0.00 0.00
258
+ ATOM 258 C PTH 1 60.24 60.38 25.83 0.00 0.00
259
+ ATOM 259 C PTH 1 60.24 61.38 22.83 0.00 0.00
260
+ ATOM 260 C PTH 1 60.24 61.38 23.83 0.00 0.00
261
+ ATOM 261 C PTH 1 60.24 61.38 24.83 0.00 0.00
262
+ ATOM 262 C PTH 1 60.24 61.38 25.83 0.00 0.00
263
+ ATOM 263 C PTH 1 60.24 61.38 26.83 0.00 0.00
264
+ ATOM 264 C PTH 1 60.24 62.38 21.83 0.00 0.00
265
+ ATOM 265 C PTH 1 60.24 62.38 22.83 0.00 0.00
266
+ ATOM 266 C PTH 1 60.24 62.38 23.83 0.00 0.00
267
+ ATOM 267 C PTH 1 60.24 62.38 24.83 0.00 0.00
268
+ ATOM 268 C PTH 1 60.24 62.38 25.83 0.00 0.00
269
+ ATOM 269 C PTH 1 60.24 62.38 26.83 0.00 0.00
270
+ ATOM 270 C PTH 1 60.24 63.38 21.83 0.00 0.00
271
+ ATOM 271 C PTH 1 60.24 63.38 22.83 0.00 0.00
272
+ ATOM 272 C PTH 1 60.24 63.38 23.83 0.00 0.00
273
+ ATOM 273 C PTH 1 60.24 63.38 24.83 0.00 0.00
274
+ ATOM 274 C PTH 1 60.24 63.38 25.83 0.00 0.00
275
+ ATOM 275 C PTH 1 60.24 63.38 26.83 0.00 0.00
276
+ ATOM 276 C PTH 1 60.24 64.38 21.83 0.00 0.00
277
+ ATOM 277 C PTH 1 60.24 64.38 22.83 0.00 0.00
278
+ ATOM 278 C PTH 1 60.24 64.38 23.83 0.00 0.00
279
+ ATOM 279 C PTH 1 60.24 64.38 24.83 0.00 0.00
280
+ ATOM 280 C PTH 1 60.24 64.38 25.83 0.00 0.00
281
+ ATOM 281 C PTH 1 60.24 64.38 26.83 0.00 0.00
282
+ ATOM 282 C PTH 1 60.24 65.38 22.83 0.00 0.00
283
+ ATOM 283 C PTH 1 60.24 65.38 23.83 0.00 0.00
284
+ ATOM 284 C PTH 1 60.24 65.38 24.83 0.00 0.00
285
+ ATOM 285 C PTH 1 60.24 65.38 25.83 0.00 0.00
286
+ ATOM 286 C PTH 1 60.24 65.38 26.83 0.00 0.00
287
+ ATOM 287 C PTH 1 60.24 66.38 22.83 0.00 0.00
288
+ ATOM 288 C PTH 1 60.24 66.38 23.83 0.00 0.00
289
+ ATOM 289 C PTH 1 60.24 66.38 24.83 0.00 0.00
290
+ ATOM 290 C PTH 1 60.24 66.38 25.83 0.00 0.00
291
+ ATOM 291 C PTH 1 60.24 66.38 26.83 0.00 0.00
292
+ ATOM 292 C PTH 1 60.24 67.38 23.83 0.00 0.00
293
+ ATOM 293 C PTH 1 60.24 67.38 24.83 0.00 0.00
294
+ ATOM 294 C PTH 1 60.24 67.38 25.83 0.00 0.00
295
+ ATOM 295 C PTH 1 60.24 67.38 26.83 0.00 0.00
296
+ ATOM 296 C PTH 1 61.24 58.38 22.83 0.00 0.00
297
+ ATOM 297 C PTH 1 61.24 58.38 23.83 0.00 0.00
298
+ ATOM 298 C PTH 1 61.24 59.38 22.83 0.00 0.00
299
+ ATOM 299 C PTH 1 61.24 59.38 23.83 0.00 0.00
300
+ ATOM 300 C PTH 1 61.24 59.38 24.83 0.00 0.00
301
+ ATOM 301 C PTH 1 61.24 59.38 25.83 0.00 0.00
302
+ ATOM 302 C PTH 1 61.24 59.38 26.83 0.00 0.00
303
+ ATOM 303 C PTH 1 61.24 60.38 22.83 0.00 0.00
304
+ ATOM 304 C PTH 1 61.24 60.38 23.83 0.00 0.00
305
+ ATOM 305 C PTH 1 61.24 60.38 24.83 0.00 0.00
306
+ ATOM 306 C PTH 1 61.24 60.38 25.83 0.00 0.00
307
+ ATOM 307 C PTH 1 61.24 60.38 26.83 0.00 0.00
308
+ ATOM 308 C PTH 1 61.24 61.38 22.83 0.00 0.00
309
+ ATOM 309 C PTH 1 61.24 61.38 23.83 0.00 0.00
310
+ ATOM 310 C PTH 1 61.24 61.38 24.83 0.00 0.00
311
+ ATOM 311 C PTH 1 61.24 61.38 25.83 0.00 0.00
312
+ ATOM 312 C PTH 1 61.24 61.38 26.83 0.00 0.00
313
+ ATOM 313 C PTH 1 61.24 62.38 21.83 0.00 0.00
314
+ ATOM 314 C PTH 1 61.24 62.38 22.83 0.00 0.00
315
+ ATOM 315 C PTH 1 61.24 62.38 23.83 0.00 0.00
316
+ ATOM 316 C PTH 1 61.24 62.38 24.83 0.00 0.00
317
+ ATOM 317 C PTH 1 61.24 62.38 25.83 0.00 0.00
318
+ ATOM 318 C PTH 1 61.24 62.38 26.83 0.00 0.00
319
+ ATOM 319 C PTH 1 61.24 63.38 21.83 0.00 0.00
320
+ ATOM 320 C PTH 1 61.24 63.38 22.83 0.00 0.00
321
+ ATOM 321 C PTH 1 61.24 63.38 23.83 0.00 0.00
322
+ ATOM 322 C PTH 1 61.24 63.38 24.83 0.00 0.00
323
+ ATOM 323 C PTH 1 61.24 63.38 25.83 0.00 0.00
324
+ ATOM 324 C PTH 1 61.24 63.38 26.83 0.00 0.00
325
+ ATOM 325 C PTH 1 61.24 64.38 21.83 0.00 0.00
326
+ ATOM 326 C PTH 1 61.24 64.38 22.83 0.00 0.00
327
+ ATOM 327 C PTH 1 61.24 64.38 23.83 0.00 0.00
328
+ ATOM 328 C PTH 1 61.24 64.38 24.83 0.00 0.00
329
+ ATOM 329 C PTH 1 61.24 64.38 25.83 0.00 0.00
330
+ ATOM 330 C PTH 1 61.24 64.38 26.83 0.00 0.00
331
+ ATOM 331 C PTH 1 61.24 65.38 22.83 0.00 0.00
332
+ ATOM 332 C PTH 1 61.24 65.38 23.83 0.00 0.00
333
+ ATOM 333 C PTH 1 61.24 65.38 24.83 0.00 0.00
334
+ ATOM 334 C PTH 1 61.24 65.38 25.83 0.00 0.00
335
+ ATOM 335 C PTH 1 61.24 65.38 26.83 0.00 0.00
336
+ ATOM 336 C PTH 1 61.24 66.38 22.83 0.00 0.00
337
+ ATOM 337 C PTH 1 61.24 66.38 23.83 0.00 0.00
338
+ ATOM 338 C PTH 1 61.24 66.38 24.83 0.00 0.00
339
+ ATOM 339 C PTH 1 61.24 66.38 25.83 0.00 0.00
340
+ ATOM 340 C PTH 1 61.24 66.38 26.83 0.00 0.00
341
+ ATOM 341 C PTH 1 61.24 67.38 23.83 0.00 0.00
342
+ ATOM 342 C PTH 1 61.24 67.38 24.83 0.00 0.00
343
+ ATOM 343 C PTH 1 61.24 67.38 25.83 0.00 0.00
344
+ ATOM 344 C PTH 1 61.24 67.38 26.83 0.00 0.00
345
+ ATOM 345 C PTH 1 62.24 58.38 22.83 0.00 0.00
346
+ ATOM 346 C PTH 1 62.24 58.38 23.83 0.00 0.00
347
+ ATOM 347 C PTH 1 62.24 58.38 24.83 0.00 0.00
348
+ ATOM 348 C PTH 1 62.24 59.38 21.83 0.00 0.00
349
+ ATOM 349 C PTH 1 62.24 59.38 22.83 0.00 0.00
350
+ ATOM 350 C PTH 1 62.24 59.38 23.83 0.00 0.00
351
+ ATOM 351 C PTH 1 62.24 59.38 24.83 0.00 0.00
352
+ ATOM 352 C PTH 1 62.24 59.38 25.83 0.00 0.00
353
+ ATOM 353 C PTH 1 62.24 59.38 26.83 0.00 0.00
354
+ ATOM 354 C PTH 1 62.24 60.38 21.83 0.00 0.00
355
+ ATOM 355 C PTH 1 62.24 60.38 22.83 0.00 0.00
356
+ ATOM 356 C PTH 1 62.24 60.38 23.83 0.00 0.00
357
+ ATOM 357 C PTH 1 62.24 60.38 24.83 0.00 0.00
358
+ ATOM 358 C PTH 1 62.24 60.38 25.83 0.00 0.00
359
+ ATOM 359 C PTH 1 62.24 60.38 26.83 0.00 0.00
360
+ ATOM 360 C PTH 1 62.24 61.38 22.83 0.00 0.00
361
+ ATOM 361 C PTH 1 62.24 61.38 23.83 0.00 0.00
362
+ ATOM 362 C PTH 1 62.24 61.38 24.83 0.00 0.00
363
+ ATOM 363 C PTH 1 62.24 61.38 25.83 0.00 0.00
364
+ ATOM 364 C PTH 1 62.24 61.38 26.83 0.00 0.00
365
+ ATOM 365 C PTH 1 62.24 62.38 22.83 0.00 0.00
366
+ ATOM 366 C PTH 1 62.24 62.38 23.83 0.00 0.00
367
+ ATOM 367 C PTH 1 62.24 62.38 24.83 0.00 0.00
368
+ ATOM 368 C PTH 1 62.24 62.38 25.83 0.00 0.00
369
+ ATOM 369 C PTH 1 62.24 62.38 26.83 0.00 0.00
370
+ ATOM 370 C PTH 1 62.24 63.38 22.83 0.00 0.00
371
+ ATOM 371 C PTH 1 62.24 63.38 23.83 0.00 0.00
372
+ ATOM 372 C PTH 1 62.24 63.38 24.83 0.00 0.00
373
+ ATOM 373 C PTH 1 62.24 63.38 25.83 0.00 0.00
374
+ ATOM 374 C PTH 1 62.24 64.38 22.83 0.00 0.00
375
+ ATOM 375 C PTH 1 62.24 64.38 23.83 0.00 0.00
376
+ ATOM 376 C PTH 1 62.24 64.38 24.83 0.00 0.00
377
+ ATOM 377 C PTH 1 62.24 64.38 25.83 0.00 0.00
378
+ ATOM 378 C PTH 1 62.24 65.38 22.83 0.00 0.00
379
+ ATOM 379 C PTH 1 62.24 65.38 23.83 0.00 0.00
380
+ ATOM 380 C PTH 1 62.24 65.38 24.83 0.00 0.00
381
+ ATOM 381 C PTH 1 62.24 65.38 25.83 0.00 0.00
382
+ ATOM 382 C PTH 1 62.24 66.38 22.83 0.00 0.00
383
+ ATOM 383 C PTH 1 62.24 66.38 23.83 0.00 0.00
384
+ ATOM 384 C PTH 1 62.24 66.38 24.83 0.00 0.00
385
+ ATOM 385 C PTH 1 62.24 66.38 25.83 0.00 0.00
386
+ ATOM 386 C PTH 1 63.24 58.38 21.83 0.00 0.00
387
+ ATOM 387 C PTH 1 63.24 58.38 22.83 0.00 0.00
388
+ ATOM 388 C PTH 1 63.24 58.38 23.83 0.00 0.00
389
+ ATOM 389 C PTH 1 63.24 58.38 24.83 0.00 0.00
390
+ ATOM 390 C PTH 1 63.24 59.38 21.83 0.00 0.00
391
+ ATOM 391 C PTH 1 63.24 59.38 22.83 0.00 0.00
392
+ ATOM 392 C PTH 1 63.24 59.38 23.83 0.00 0.00
393
+ ATOM 393 C PTH 1 63.24 59.38 24.83 0.00 0.00
394
+ ATOM 394 C PTH 1 63.24 59.38 25.83 0.00 0.00
395
+ ATOM 395 C PTH 1 63.24 59.38 26.83 0.00 0.00
396
+ ATOM 396 C PTH 1 63.24 60.38 22.83 0.00 0.00
397
+ ATOM 397 C PTH 1 63.24 60.38 23.83 0.00 0.00
398
+ ATOM 398 C PTH 1 63.24 60.38 24.83 0.00 0.00
399
+ ATOM 399 C PTH 1 63.24 60.38 25.83 0.00 0.00
400
+ ATOM 400 C PTH 1 63.24 60.38 26.83 0.00 0.00
401
+ ATOM 401 C PTH 1 63.24 61.38 22.83 0.00 0.00
402
+ ATOM 402 C PTH 1 63.24 61.38 23.83 0.00 0.00
403
+ ATOM 403 C PTH 1 63.24 61.38 24.83 0.00 0.00
404
+ ATOM 404 C PTH 1 63.24 61.38 25.83 0.00 0.00
405
+ ATOM 405 C PTH 1 63.24 62.38 22.83 0.00 0.00
406
+ ATOM 406 C PTH 1 63.24 62.38 23.83 0.00 0.00
407
+ ATOM 407 C PTH 1 63.24 62.38 24.83 0.00 0.00
408
+ ATOM 408 C PTH 1 63.24 62.38 25.83 0.00 0.00
409
+ ATOM 409 C PTH 1 63.24 64.38 23.83 0.00 0.00
410
+ ATOM 410 C PTH 1 64.24 58.38 21.83 0.00 0.00
411
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412
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413
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414
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415
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417
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418
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419
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420
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423
+ ATOM 423 C PTH 1 64.24 61.38 25.83 0.00 0.00
data/files/A00G2/pocket_03.pdb ADDED
@@ -0,0 +1,230 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 64.24 59.38 37.83 0.00 0.00
2
+ ATOM 2 C PTH 1 64.24 60.38 36.83 0.00 0.00
3
+ ATOM 3 C PTH 1 64.24 60.38 37.83 0.00 0.00
4
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5
+ ATOM 5 C PTH 1 64.24 60.38 39.83 0.00 0.00
6
+ ATOM 6 C PTH 1 65.24 54.38 31.83 0.00 0.00
7
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+ ATOM 10 C PTH 1 65.24 55.38 35.83 0.00 0.00
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13
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14
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15
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16
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17
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18
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19
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24
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25
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26
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27
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28
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+ ATOM 34 C PTH 1 66.24 54.38 31.83 0.00 0.00
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36
+ ATOM 36 C PTH 1 66.24 54.38 33.83 0.00 0.00
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38
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40
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53
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55
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62
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63
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64
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65
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66
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68
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70
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71
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72
+ ATOM 72 C PTH 1 67.24 54.38 31.83 0.00 0.00
73
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74
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75
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76
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77
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78
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79
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80
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81
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82
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83
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84
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85
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86
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87
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88
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89
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90
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91
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92
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93
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94
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95
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96
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97
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100
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101
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102
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103
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104
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105
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106
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108
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111
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112
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113
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115
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119
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121
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123
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127
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128
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134
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135
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136
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138
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140
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148
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149
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150
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151
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154
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155
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157
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158
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159
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160
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161
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162
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163
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164
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167
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168
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169
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170
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171
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172
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173
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174
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175
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176
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177
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178
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179
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180
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181
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182
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183
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184
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185
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186
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187
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188
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189
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190
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191
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192
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193
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194
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195
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196
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197
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198
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199
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200
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201
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202
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208
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212
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214
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215
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216
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217
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218
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219
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223
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224
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225
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227
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230
+ ATOM 230 C PTH 1 71.24 57.38 39.83 0.00 0.00
data/files/A00G2/pocket_04.pdb ADDED
@@ -0,0 +1,123 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 72.24 53.38 25.83 0.00 0.00
2
+ ATOM 2 C PTH 1 72.24 53.38 26.83 0.00 0.00
3
+ ATOM 3 C PTH 1 72.24 53.38 27.83 0.00 0.00
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+ ATOM 12 C PTH 1 73.24 53.38 24.83 0.00 0.00
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17
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19
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20
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21
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22
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23
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123
+ ATOM 123 C PTH 1 78.24 56.38 24.83 0.00 0.00
data/files/A00G2/pocket_05.pdb ADDED
@@ -0,0 +1,66 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 40.24 65.38 31.83 0.00 0.00
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+ ATOM 66 C PTH 1 44.24 67.38 33.83 0.00 0.00
data/files/A00G2/pocket_06.pdb ADDED
@@ -0,0 +1,65 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 61.24 50.38 45.83 0.00 0.00
2
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+ ATOM 65 C PTH 1 64.24 52.38 47.83 0.00 0.00
data/files/A00G2/pocket_07.pdb ADDED
@@ -0,0 +1,65 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 64.24 64.38 16.83 0.00 0.00
2
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+ ATOM 49 C PTH 1 67.24 67.38 16.83 0.00 0.00
50
+ ATOM 50 C PTH 1 67.24 68.38 13.83 0.00 0.00
51
+ ATOM 51 C PTH 1 67.24 68.38 14.83 0.00 0.00
52
+ ATOM 52 C PTH 1 67.24 68.38 15.83 0.00 0.00
53
+ ATOM 53 C PTH 1 68.24 65.38 15.83 0.00 0.00
54
+ ATOM 54 C PTH 1 68.24 65.38 16.83 0.00 0.00
55
+ ATOM 55 C PTH 1 68.24 66.38 13.83 0.00 0.00
56
+ ATOM 56 C PTH 1 68.24 66.38 14.83 0.00 0.00
57
+ ATOM 57 C PTH 1 68.24 66.38 15.83 0.00 0.00
58
+ ATOM 58 C PTH 1 68.24 66.38 16.83 0.00 0.00
59
+ ATOM 59 C PTH 1 68.24 67.38 13.83 0.00 0.00
60
+ ATOM 60 C PTH 1 68.24 67.38 14.83 0.00 0.00
61
+ ATOM 61 C PTH 1 68.24 67.38 15.83 0.00 0.00
62
+ ATOM 62 C PTH 1 68.24 67.38 16.83 0.00 0.00
63
+ ATOM 63 C PTH 1 68.24 68.38 13.83 0.00 0.00
64
+ ATOM 64 C PTH 1 68.24 68.38 14.83 0.00 0.00
65
+ ATOM 65 C PTH 1 68.24 68.38 15.83 0.00 0.00
data/files/A00G2/pocket_08.pdb ADDED
@@ -0,0 +1,54 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ ATOM 1 C PTH 1 77.24 59.38 14.83 0.00 0.00
2
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3
+ ATOM 3 C PTH 1 78.24 58.38 13.83 0.00 0.00
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5
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6
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7
+ ATOM 7 C PTH 1 78.24 59.38 13.83 0.00 0.00
8
+ ATOM 8 C PTH 1 78.24 59.38 14.83 0.00 0.00
9
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10
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11
+ ATOM 11 C PTH 1 78.24 60.38 13.83 0.00 0.00
12
+ ATOM 12 C PTH 1 78.24 60.38 14.83 0.00 0.00
13
+ ATOM 13 C PTH 1 78.24 60.38 15.83 0.00 0.00
14
+ ATOM 14 C PTH 1 78.24 61.38 13.83 0.00 0.00
15
+ ATOM 15 C PTH 1 78.24 61.38 14.83 0.00 0.00
16
+ ATOM 16 C PTH 1 78.24 61.38 15.83 0.00 0.00
17
+ ATOM 17 C PTH 1 78.24 62.38 14.83 0.00 0.00
18
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19
+ ATOM 19 C PTH 1 79.24 58.38 13.83 0.00 0.00
20
+ ATOM 20 C PTH 1 79.24 58.38 14.83 0.00 0.00
21
+ ATOM 21 C PTH 1 79.24 58.38 15.83 0.00 0.00
22
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23
+ ATOM 23 C PTH 1 79.24 59.38 13.83 0.00 0.00
24
+ ATOM 24 C PTH 1 79.24 59.38 14.83 0.00 0.00
25
+ ATOM 25 C PTH 1 79.24 59.38 15.83 0.00 0.00
26
+ ATOM 26 C PTH 1 79.24 59.38 16.83 0.00 0.00
27
+ ATOM 27 C PTH 1 79.24 60.38 13.83 0.00 0.00
28
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29
+ ATOM 29 C PTH 1 79.24 60.38 15.83 0.00 0.00
30
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31
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32
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33
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34
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35
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36
+ ATOM 36 C PTH 1 80.24 58.38 14.83 0.00 0.00
37
+ ATOM 37 C PTH 1 80.24 58.38 15.83 0.00 0.00
38
+ ATOM 38 C PTH 1 80.24 59.38 13.83 0.00 0.00
39
+ ATOM 39 C PTH 1 80.24 59.38 14.83 0.00 0.00
40
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41
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42
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43
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44
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45
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46
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47
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48
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49
+ ATOM 49 C PTH 1 81.24 59.38 14.83 0.00 0.00
50
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51
+ ATOM 51 C PTH 1 81.24 60.38 14.83 0.00 0.00
52
+ ATOM 52 C PTH 1 81.24 60.38 15.83 0.00 0.00
53
+ ATOM 53 C PTH 1 81.24 61.38 14.83 0.00 0.00
54
+ ATOM 54 C PTH 1 81.24 61.38 15.83 0.00 0.00
data/files/A00G2/structure.pdb ADDED
The diff for this file is too large to render. See raw diff
 
dataset_metadata.json ADDED
@@ -0,0 +1,5 @@
 
 
 
 
 
 
1
+ {
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+ }