Project name: ACLY_F3

Status: done

Started: 2026-07-29 15:47:52
Settings
Chain sequence(s) A: MSAKAISEQTGKELLYKFICTTSAIQNRFKYARVTPDTDWARLLQDHPWLLSQNLVVKPDQLIKRRGKLGLVGVNLTLDGVKSWLKPRLGQEATVGKATGFLKNFLIEPFVPHSQAEEFYVCIYATREGDYVLFHHEGGVDVGDVDAKAQKLLVGVDEKLNPEDIKKHLLVHAPEDKKEILASFISGLFNFYEDLYFTYLEINPLVVTKDGVYVLDLAAKVDATADYICKVKWGDIEFPPPFGREAYPEEAYIADLDAKSGASLKLTLLNPKGRIWTMVAGGGASVVYSDTICDLGGVNELANYGEYSGAPSEQQTYDYAKTILSLMTREKHPDGKILIIGGSIANFTNVAATFKGIVRAIRDYQGPLKEHEVTIFVRRGGPNYQEGLRVMGEVGKTTGIPIHVFGTETHMTAIVGMALGHRPIPNQPPTAAHTANFLLNASGSTSTPAKKRRASNSESRADEVEPAKKRKKAMKQESVPSPRSLQGKSTTLFSRHTKAIVWGMQTRAVQGMLDFDYVCSRDEPSVAAMVYPFTGDHKQKFYWGHKEILIPVFKNMADAMRKHPEVDVLINFASLRSAYDSTMETMNYAQIRTIAIIAEGIPEALTRKLIKKADQKGVTIIGPATVGGIKPGCFKIGNTGGMLDNILASKLYRPGSVAYVSRSGGMSNELNNIISRTTDGVYEGVAIGGDRYPGSTFMDHVLRYQDTPGVKMIVVLGEIGGTEEYKICRGIKEGRLTKPIVCWCIGTCATMFSSEVQFGHAGACANQASETAVAKNQALKEAGVFVPRSFDELGEIIQSVYEDLVANGVIVPAQEVPPPTVPMDYSWARELGLIRKPASFMTSICDERGQELIYAGMPITEVFKEEMGIGGVLGLLWFQKRLPKYSCQFIEMCLMVTADHGPAVSGAHNTIICARAGKDLVSSLTSGLLTIGDRFGGALDAAAKMFSKAFDSGIIPMEFVNKMKKEGKLIMGIGHRVKSINNPDMRVQILKDYVRQHFPATPLLDYALEVEKITTSKKPNLILNVDGLIGVAFVDMLRNCGSFTREEADEYIDIGALNGIFVLGRSMGFIGHYLDQKRLKQGLYRHPWDDISYVLPEHMSM
input PDB
Selected Chain(s) A
Distance of aggregation 10 Å
FoldX usage Yes
Dynamic mode No
Automated mutations No
Downloads Download all the data
Simulation log
[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:00)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:00)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:16:15)
[INFO]       Main:     Simulation completed successfully.                                          (00:16:30)
Show buried residues

Minimal score value
-4.3912
Maximal score value
2.9088
Average score
-0.7163
Total score value
-788.6723

The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan3D score mutation
residue index residue name chain Aggrescan3D score
mutation
1 M A -0.1205
2 S A 0.0000
3 A A 0.0000
4 K A -0.8261
5 A A -0.5463
6 I A 0.0000
7 S A -0.4138
8 E A 0.0000
9 Q A -0.5728
10 T A -0.5560
11 G A 0.0000
12 K A 0.0000
13 E A -1.1180
14 L A 0.0000
15 L A 0.0000
16 Y A 0.0000
17 K A -1.6177
18 F A -0.6998
19 I A 0.0000
20 C A 0.3781
21 T A 0.2890
22 T A -0.0100
23 S A 0.0000
24 A A -0.3961
25 I A -0.5719
26 Q A -1.0795
27 N A -0.8865
28 R A -1.3908
29 F A -0.2273
30 K A -0.7171
31 Y A -0.6658
32 A A 0.0000
33 R A -1.8813
34 V A 0.0000
35 T A -1.6320
36 P A -1.7264
37 D A -2.2164
38 T A -1.7886
39 D A -1.6314
40 W A -1.2093
41 A A -1.3760
42 R A -2.7413
43 L A -2.0401
44 L A -1.2016
45 Q A -2.5815
46 D A -2.8020
47 H A -1.3278
48 P A -0.7144
49 W A -0.3239
50 L A 0.0000
51 L A 0.9708
52 S A 0.0423
53 Q A -0.7636
54 N A -0.6997
55 L A 0.0000
56 V A 0.6373
57 V A 0.0000
58 K A 0.0000
59 P A 0.0000
60 D A 0.0000
61 Q A -0.3619
62 L A -0.4553
63 I A 0.0000
64 K A -2.6867
65 R A -3.0104
66 R A -1.8177
67 G A -1.6019
68 K A -2.4589
69 L A -1.2566
70 G A -1.0292
71 L A 0.0000
72 V A 0.1422
73 G A 0.0000
74 V A 1.3660
75 N A -0.2439
76 L A -0.3011
77 T A -0.6291
78 L A -0.7466
79 D A -1.7391
80 G A -0.9878
81 V A 0.0000
82 K A -1.5522
83 S A -1.4563
84 W A -0.9095
85 L A 0.0000
86 K A -2.1576
87 P A -1.6196
88 R A -1.5197
89 L A -1.2784
90 G A -1.4026
91 Q A -1.7931
92 E A -1.8827
93 A A -0.7374
94 T A -0.5846
95 V A -0.8343
96 G A -1.3597
97 K A -1.9531
98 A A -1.2973
99 T A -0.7398
100 G A -0.6669
101 F A -0.3874
102 L A 0.0000
103 K A -1.5618
104 N A -1.0048
105 F A 0.0000
106 L A 0.0000
107 I A 0.0000
108 E A -0.2250
109 P A 0.0000
110 F A -0.0384
111 V A 0.0000
112 P A -0.6421
113 H A -0.9051
114 S A -1.1392
115 Q A -1.9108
116 A A -1.3470
117 E A -1.5508
118 E A -1.2488
119 F A 0.0000
120 Y A 0.0000
121 V A 0.0000
122 C A 0.0000
123 I A 0.0000
124 Y A 0.4961
125 A A 0.0098
126 T A -0.5469
127 R A -1.4587
128 E A -2.0756
129 G A 0.0000
130 D A 0.0000
131 Y A 0.3063
132 V A 0.0000
133 L A 0.0000
134 F A 0.0000
135 H A -1.6119
136 H A -1.8063
137 E A -2.6516
138 G A 0.0000
139 G A 0.0000
140 V A -0.2020
141 D A -1.8931
142 V A -1.5096
143 G A -1.8994
144 D A -3.0010
145 V A -2.6480
146 D A -2.9428
147 A A -2.2819
148 K A -3.0396
149 A A -2.3146
150 Q A -1.5910
151 K A -1.3547
152 L A -0.1037
153 L A 0.2952
154 V A 0.0000
155 G A -1.8858
156 V A 0.0000
157 D A -3.3101
158 E A -3.4941
159 K A -3.3585
160 L A 0.0000
161 N A -2.0181
162 P A -2.3138
163 E A -3.3199
164 D A -2.8148
165 I A 0.0000
166 K A -3.1361
167 K A -2.8316
168 H A -2.1413
169 L A 0.0000
170 L A 0.0000
171 V A -0.5733
172 H A -1.3065
173 A A 0.0000
174 P A -2.0148
175 E A -3.2790
176 D A -3.3699
177 K A -2.5090
178 K A -2.4690
179 E A -2.8576
180 I A -0.9075
181 L A 0.0000
182 A A 0.0000
183 S A -0.7018
184 F A 0.0000
185 I A 0.0000
186 S A -0.8491
187 G A 0.0000
188 L A 0.0000
189 F A 0.0000
190 N A -2.2899
191 F A 0.0000
192 Y A 0.0000
193 E A -2.6128
194 D A -2.6531
195 L A 0.0000
196 Y A -0.9292
197 F A 0.0000
198 T A 0.0000
199 Y A 0.2089
200 L A 0.0000
201 E A -0.3430
202 I A 0.0000
203 N A -0.2625
204 P A -0.3781
205 L A 0.0000
206 V A 0.0000
207 V A 0.0000
208 T A -1.6847
209 K A -2.8297
210 D A -2.6487
211 G A 0.0000
212 V A 0.0000
213 Y A 0.0000
214 V A 0.0000
215 L A 0.0371
216 D A -0.3676
217 L A 0.0000
218 A A -0.4455
219 A A 0.0000
220 K A -0.5088
221 V A 0.0000
222 D A 0.0000
223 A A 0.0000
224 T A 0.0000
225 A A 0.0000
226 D A -0.6913
227 Y A 0.0103
228 I A 0.2038
229 C A 0.0000
230 K A -1.1784
231 V A 0.5832
232 K A -0.6310
233 W A 0.0000
234 G A -1.3620
235 D A -2.3215
236 I A -1.7625
237 E A -1.9926
238 F A -0.7919
239 P A -0.6361
240 P A -0.9091
241 P A -0.7549
242 F A -0.7809
243 G A -1.1453
244 R A -1.2444
245 E A -1.6994
246 A A -0.9149
247 Y A -0.4908
248 P A -0.3839
249 E A -0.4033
250 E A -0.3472
251 A A -0.1194
252 Y A 0.1179
253 I A 0.0000
254 A A -0.6160
255 D A -1.2396
256 L A -0.9250
257 D A -0.9480
258 A A -1.2364
259 K A -2.0340
260 S A -1.2682
261 G A -1.0032
262 A A 0.0000
263 S A -0.5430
264 L A 0.0000
265 K A -0.4421
266 L A 0.0000
267 T A -0.1484
268 L A 0.0000
269 L A -0.5107
270 N A -1.0847
271 P A -1.4976
272 K A -3.0176
273 G A 0.0000
274 R A -1.8119
275 I A 0.0000
276 W A 0.0000
277 T A 0.0000
278 M A 0.0000
279 V A 0.0000
280 A A -0.0648
281 G A -0.1790
282 G A 0.0000
283 G A 0.0000
284 A A 0.0000
285 S A 0.0000
286 V A 0.0000
287 V A 0.0000
288 Y A 0.0000
289 S A 0.0000
290 D A 0.0000
291 T A 0.0000
292 I A 0.0000
293 C A 0.0000
294 D A -1.7962
295 L A -0.6683
296 G A -0.9032
297 G A 0.0000
298 V A -0.4945
299 N A -1.4941
300 E A -1.3305
301 L A 0.0000
302 A A 0.0000
303 N A 0.0000
304 Y A 0.0000
305 G A 0.0000
306 E A 0.0000
307 Y A 0.0000
308 S A -0.1304
309 G A -0.3235
310 A A -0.3355
311 P A 0.0000
312 S A -1.4844
313 E A -2.6510
314 Q A -2.2085
315 Q A -1.3406
316 T A 0.0000
317 Y A 0.0000
318 D A -1.1274
319 Y A 0.0000
320 A A 0.0000
321 K A -1.3239
322 T A 0.0000
323 I A 0.0000
324 L A 0.0000
325 S A -0.6570
326 L A 0.0000
327 M A 0.0000
328 T A -2.5696
329 R A -3.2360
330 E A -3.9326
331 K A -4.2292
332 H A -2.9285
333 P A -1.8772
334 D A -2.5433
335 G A 0.0000
336 K A 0.0000
337 I A 0.0000
338 L A 0.0000
339 I A 0.0000
340 I A 0.0000
341 G A 0.0000
342 G A 0.0000
343 S A 0.0000
344 I A 0.0000
345 A A 0.0507
346 N A 0.0000
347 F A 0.3523
348 T A 0.0000
349 N A -0.8160
350 V A 0.0000
351 A A 0.0000
352 A A -1.3389
353 T A 0.0000
354 F A 0.0000
355 K A -2.0744
356 G A 0.0000
357 I A 0.0000
358 V A 0.0000
359 R A -2.9589
360 A A 0.0000
361 I A 0.0000
362 R A -2.3102
363 D A -2.7338
364 Y A -1.6982
365 Q A -2.0883
366 G A -1.6697
367 P A -2.1975
368 L A 0.0000
369 K A -3.0713
370 E A -3.4402
371 H A -3.6705
372 E A -3.5059
373 V A 0.0000
374 T A -0.6617
375 I A 0.0000
376 F A 0.0000
377 V A 0.0000
378 R A 0.0000
379 R A 0.0000
380 G A 0.0000
381 G A 0.0000
382 P A 0.0000
383 N A -0.4709
384 Y A -0.4387
385 Q A -0.6922
386 E A -1.2086
387 G A 0.0000
388 L A -0.9059
389 R A -1.7874
390 V A 0.0000
391 M A 0.0000
392 G A -1.4050
393 E A -2.0736
394 V A 0.0000
395 G A -1.4988
396 K A -2.2656
397 T A -1.4784
398 T A 0.0000
399 G A -1.4454
400 I A 0.0000
401 P A -0.8845
402 I A -0.3753
403 H A 0.1119
404 V A 0.0377
405 F A 0.0000
406 G A 0.0000
407 T A -0.3457
408 E A -0.6835
409 T A -0.4481
410 H A -0.6065
411 M A 0.0000
412 T A 0.0000
413 A A -0.4976
414 I A 0.0000
415 V A 0.0000
416 G A 0.0000
417 M A -0.6790
418 A A -0.2916
419 L A -0.4341
420 G A -1.0325
421 H A -1.4333
422 R A -2.0853
423 P A -1.0746
424 I A -0.3594
425 P A -1.0541
426 N A -1.7513
427 Q A -1.8441
428 P A -1.0695
429 P A -0.8930
430 T A -0.5467
431 A A -0.3598
432 A A -0.2762
433 H A -0.6024
434 T A -0.0673
435 A A 0.0000
436 N A -0.4244
437 F A 0.9774
438 L A 0.8805
439 L A 0.9825
440 N A -0.5667
441 A A -0.1308
442 S A -0.3036
443 G A -0.8588
444 S A -0.7580
445 T A -0.4689
446 S A -0.4846
447 T A -0.5228
448 P A -0.9753
449 A A -1.6051
450 K A -3.2367
451 K A -3.9112
452 R A -3.9927
453 R A -3.5291
454 A A -1.9214
455 S A -1.7255
456 N A -2.0763
457 S A -1.8252
458 E A -2.7409
459 S A -2.0453
460 R A -2.6993
461 A A -2.0278
462 D A -2.6430
463 E A -2.2547
464 V A -0.4317
465 E A -1.6771
466 P A -1.5168
467 A A -1.5089
468 K A -3.4129
469 K A -4.0158
470 R A -4.3243
471 K A -3.8590
472 K A -3.0721
473 A A -1.5470
474 M A -0.9276
475 K A -2.4516
476 Q A -2.4781
477 E A -2.4528
478 S A -0.8836
479 V A 0.8884
480 P A -0.1951
481 S A -0.5652
482 P A -1.0057
483 R A -2.0496
484 S A -0.9491
485 L A -0.5457
486 Q A -2.0191
487 G A -1.9261
488 K A -2.2809
489 S A -1.1469
490 T A -0.7196
491 T A -0.4280
492 L A 0.0000
493 F A 0.0000
494 S A -0.8211
495 R A -1.9285
496 H A -2.2890
497 T A 0.0000
498 K A -1.3015
499 A A 0.0000
500 I A 0.0000
501 V A 0.0000
502 W A 0.2881
503 G A 0.0000
504 M A 0.2222
505 Q A -0.7624
506 T A -1.3349
507 R A -1.9176
508 A A 0.0000
509 V A 0.0000
510 Q A -0.9517
511 G A -0.5615
512 M A 0.0000
513 L A 0.0000
514 D A -0.0545
515 F A 0.0000
516 D A 0.0000
517 Y A -0.4322
518 V A 0.0000
519 C A 0.0000
520 S A -0.9655
521 R A 0.0000
522 D A -2.9582
523 E A -2.9897
524 P A -1.3857
525 S A 0.0000
526 V A 0.0000
527 A A -0.6662
528 A A 0.0000
529 M A 0.0000
530 V A 0.0000
531 Y A 0.1165
532 P A 0.1211
533 F A 1.4276
534 T A -0.0706
535 G A -1.6187
536 D A -2.8796
537 H A -2.3552
538 K A -2.5763
539 Q A -1.8535
540 K A -1.9131
541 F A 0.0000
542 Y A -0.4604
543 W A -0.6431
544 G A 0.0000
545 H A -1.7175
546 K A -2.2840
547 E A -1.7904
548 I A -0.7717
549 L A -0.4045
550 I A 0.0000
551 P A -1.4799
552 V A 0.0000
553 F A 0.0000
554 K A -1.7816
555 N A -1.5249
556 M A 0.0000
557 A A -1.7480
558 D A -2.4228
559 A A 0.0000
560 M A 0.0000
561 R A -3.1716
562 K A -3.1271
563 H A -2.3527
564 P A -2.1579
565 E A -2.5148
566 V A 0.0000
567 D A -1.2025
568 V A 0.0000
569 L A 0.0000
570 I A 0.0000
571 N A 0.0000
572 F A 0.3183
573 A A 0.0000
574 S A -0.7782
575 L A -0.9296
576 R A -1.9568
577 S A -1.3942
578 A A 0.0000
579 Y A -1.2209
580 D A -2.2917
581 S A 0.0000
582 T A 0.0000
583 M A -1.4693
584 E A -2.2004
585 T A 0.0000
586 M A 0.0000
587 N A -1.8082
588 Y A -1.1811
589 A A -0.7171
590 Q A -1.0164
591 I A 0.0000
592 R A -1.3935
593 T A 0.0000
594 I A 0.0000
595 A A 0.0000
596 I A 0.0000
597 I A 0.1031
598 A A 0.0000
599 E A -0.9714
600 G A -0.6851
601 I A 0.0000
602 P A 0.0000
603 E A 0.0000
604 A A -0.4450
605 L A -0.1118
606 T A 0.0000
607 R A 0.0000
608 K A -1.6699
609 L A 0.0000
610 I A -1.6934
611 K A -3.0662
612 K A -2.5525
613 A A 0.0000
614 D A -3.5199
615 Q A -2.9947
616 K A -3.0365
617 G A -2.6303
618 V A 0.0000
619 T A 0.0000
620 I A 0.0000
621 I A 0.0000
622 G A 0.0000
623 P A 0.0000
624 A A -0.3183
625 T A 0.0000
626 V A 0.0000
627 G A 0.0000
628 G A 0.0000
629 I A 0.0000
630 K A 0.0000
631 P A 0.0000
632 G A 0.0000
633 C A -0.5661
634 F A 0.0000
635 K A 0.0000
636 I A 0.0000
637 G A 0.0000
638 N A -0.2578
639 T A 0.0000
640 G A 0.0000
641 G A 0.0000
642 M A 0.1589
643 L A 0.2427
644 D A 0.1221
645 N A -0.1147
646 I A 0.0000
647 L A 0.0000
648 A A -0.1839
649 S A 0.0000
650 K A -1.1320
651 L A 0.0000
652 Y A 0.0000
653 R A -0.5384
654 P A -0.3590
655 G A -0.1919
656 S A 0.0000
657 V A 0.0000
658 A A 0.0000
659 Y A 0.0000
660 V A 0.0000
661 S A 0.0000
662 R A 0.0000
663 S A 0.0000
664 G A -0.1215
665 G A -0.0815
666 M A 0.0000
667 S A 0.0000
668 N A 0.0000
669 E A 0.0000
670 L A 0.0000
671 N A 0.0000
672 N A 0.0000
673 I A 0.0000
674 I A 0.0000
675 S A -1.1087
676 R A -2.0452
677 T A -1.6793
678 T A -1.0343
679 D A -0.7644
680 G A 0.0000
681 V A 0.0000
682 Y A -0.0436
683 E A 0.0000
684 G A 0.0000
685 V A 0.0000
686 A A 0.0000
687 I A 0.0000
688 G A 0.0000
689 G A 0.0000
690 D A 0.0000
691 R A -0.3002
692 Y A -0.3094
693 P A 0.0000
694 G A -0.4742
695 S A 0.0000
696 T A -0.3349
697 F A 0.0000
698 M A 0.0000
699 D A -0.4581
700 H A 0.0000
701 V A 0.0000
702 L A -0.3116
703 R A 0.0000
704 Y A 0.0000
705 Q A -1.0527
706 D A -1.6073
707 T A -0.9084
708 P A -0.7986
709 G A -0.5700
710 V A 0.0000
711 K A -0.3689
712 M A 0.0000
713 I A 0.0000
714 V A 0.0000
715 V A 0.0000
716 L A 0.0000
717 G A 0.0000
718 E A 0.0000
719 I A 0.0000
720 G A 0.0000
721 G A -0.6447
722 T A -0.5368
723 E A -0.7669
724 E A 0.0000
725 Y A -1.0414
726 K A -2.1598
727 I A 0.0000
728 C A 0.0000
729 R A -3.2946
730 G A 0.0000
731 I A -2.2393
732 K A -3.4894
733 E A -3.4662
734 G A -2.4108
735 R A -2.2486
736 L A 0.0000
737 T A -0.8989
738 K A -0.6849
739 P A -0.1459
740 I A 0.0000
741 V A 0.0000
742 C A 0.0000
743 W A 0.0000
744 C A 0.0000
745 I A 0.0000
746 G A 0.0000
747 T A 0.0846
748 C A 0.0000
749 A A -0.1447
750 T A 0.0617
751 M A -0.0353
752 F A 0.0000
753 S A -1.1601
754 S A -1.3844
755 E A -1.9996
756 V A -0.8590
757 Q A -0.7756
758 F A 0.0000
759 G A 0.0000
760 H A -0.3248
761 A A -0.2737
762 G A -0.2052
763 A A 0.0000
764 C A -0.7604
765 A A -1.2576
766 N A -2.0441
767 Q A -1.8240
768 A A -0.7402
769 S A -0.5586
770 E A 0.0000
771 T A -0.1768
772 A A 0.0000
773 V A 0.5428
774 A A 0.0121
775 K A 0.0000
776 N A 0.0000
777 Q A -1.9702
778 A A -1.6190
779 L A 0.0000
780 K A -2.7625
781 E A -2.9173
782 A A -2.1630
783 G A -1.4502
784 V A 0.0000
785 F A 0.4044
786 V A 0.0000
787 P A 0.0000
788 R A -2.1969
789 S A -1.5667
790 F A 0.0000
791 D A -1.4812
792 E A -1.6542
793 L A 0.0000
794 G A -1.5274
795 E A -2.0615
796 I A -0.9257
797 I A 0.0000
798 Q A -2.0992
799 S A -1.5867
800 V A 0.0000
801 Y A -1.5243
802 E A -2.6604
803 D A -2.6483
804 L A -0.9590
805 V A -0.2553
806 A A -1.0108
807 N A -1.3274
808 G A -0.1780
809 V A 0.9937
810 I A 0.0000
811 V A 1.7722
812 P A 0.3012
813 A A -0.4884
814 Q A -1.4907
815 E A -1.7468
816 V A 0.4072
817 P A -0.0943
818 P A -0.0886
819 P A 0.0580
820 T A -0.1629
821 V A -0.0570
822 P A -0.1670
823 M A 0.2253
824 D A -0.5949
825 Y A 0.0346
826 S A -0.8350
827 W A -0.8679
828 A A 0.0000
829 R A -2.7811
830 E A -2.3996
831 L A -0.8932
832 G A -1.2649
833 L A 0.0362
834 I A -0.8206
835 R A -2.5559
836 K A -2.8154
837 P A -1.2807
838 A A 0.0000
839 S A 0.6993
840 F A 2.3201
841 M A 1.9702
842 T A 0.9878
843 S A 0.2753
844 I A 0.8595
845 C A -0.0961
846 D A -1.5506
847 E A -2.9829
848 R A -3.2385
849 G A -2.5293
850 Q A -2.1847
851 E A -1.5698
852 L A -0.9048
853 I A -0.2835
854 Y A 0.2783
855 A A -0.0855
856 G A -0.4339
857 M A 0.0000
858 P A -0.0925
859 I A 0.4342
860 T A -0.2494
861 E A -1.2612
862 V A 0.0000
863 F A -0.1526
864 K A -2.1689
865 E A -2.6734
866 E A -2.5222
867 M A 0.0000
868 G A -0.5799
869 I A 0.6438
870 G A 0.0000
871 G A 0.0000
872 V A 0.6421
873 L A 0.0000
874 G A 0.0000
875 L A 0.0000
876 L A 0.4751
877 W A 0.4405
878 F A 0.0000
879 Q A -0.9001
880 K A -1.4457
881 R A -2.3855
882 L A 0.0000
883 P A -1.4849
884 K A -2.6065
885 Y A -1.3127
886 S A 0.0000
887 C A 0.0000
888 Q A -1.5084
889 F A 0.0000
890 I A 0.0000
891 E A -0.2195
892 M A 0.2888
893 C A 0.0000
894 L A 0.0000
895 M A 0.9955
896 V A 0.5064
897 T A 0.0000
898 A A 0.1251
899 D A -0.9379
900 H A -1.2658
901 G A -0.8978
902 P A -0.7424
903 A A -0.3009
904 V A -0.2265
905 S A -0.2100
906 G A 0.0000
907 A A 0.0000
908 H A -0.7061
909 N A -0.4276
910 T A 0.0000
911 I A -0.1812
912 I A -0.0885
913 C A -0.2358
914 A A 0.0000
915 R A -0.7520
916 A A -0.3883
917 G A -1.3860
918 K A -1.5998
919 D A -1.1353
920 L A 0.7116
921 V A 1.6055
922 S A 0.3176
923 S A 0.0000
924 L A 1.0254
925 T A 1.1117
926 S A 0.7380
927 G A 0.0000
928 L A 1.1459
929 L A 1.7044
930 T A 0.2854
931 I A 0.0291
932 G A -1.2078
933 D A -2.7817
934 R A -2.6510
935 F A -1.0068
936 G A -0.8689
937 G A -1.4671
938 A A -0.9759
939 L A 0.0000
940 D A -0.8543
941 A A -0.5671
942 A A 0.0000
943 A A 0.0000
944 K A -1.1349
945 M A -0.4630
946 F A 0.0000
947 S A 0.0000
948 K A -2.0601
949 A A 0.0000
950 F A -0.2809
951 D A -1.7538
952 S A -0.9540
953 G A -0.4864
954 I A 0.4085
955 I A 1.7216
956 P A 0.0000
957 M A -0.0392
958 E A -1.2256
959 F A 0.0000
960 V A 0.0000
961 N A -2.8496
962 K A -3.6051
963 M A 0.0000
964 K A -4.1376
965 K A -4.3912
966 E A -4.1182
967 G A -3.1622
968 K A -2.6403
969 L A 0.0942
970 I A 0.0000
971 M A 0.3178
972 G A 0.0000
973 I A 0.3732
974 G A -0.2893
975 H A -0.7189
976 R A -1.2089
977 V A 0.4322
978 K A -0.1377
979 S A 0.0000
980 I A 0.5461
981 N A -0.8443
982 N A -0.5744
983 P A -0.1427
984 D A 0.0000
985 M A 0.9190
986 R A 0.6015
987 V A 0.0000
988 Q A 0.0379
989 I A 1.1068
990 L A 0.0000
991 K A -1.2440
992 D A -2.2353
993 Y A -1.5142
994 V A 0.0000
995 R A -3.0818
996 Q A -2.6968
997 H A -1.9657
998 F A 0.0000
999 P A -0.8871
1000 A A -0.6466
1001 T A 0.0000
1002 P A -0.4279
1003 L A 0.0000
1004 L A 0.0000
1005 D A -1.5438
1006 Y A 0.0000
1007 A A 0.0000
1008 L A 0.0000
1009 E A -1.8155
1010 V A 0.0000
1011 E A -1.4233
1012 K A -2.0732
1013 I A -1.3503
1014 T A 0.0000
1015 T A -1.4828
1016 S A -1.6468
1017 K A -2.7030
1018 K A -2.1622
1019 P A -1.1438
1020 N A -0.8921
1021 L A -0.8828
1022 I A 0.0000
1023 L A 0.0000
1024 N A -0.6388
1025 V A 0.0000
1026 D A -0.3975
1027 G A 0.0000
1028 L A 0.0000
1029 I A 0.0000
1030 G A 0.0000
1031 V A 0.0000
1032 A A 0.0000
1033 F A 0.0000
1034 V A 0.0000
1035 D A 0.0000
1036 M A 0.0000
1037 L A 0.0000
1038 R A -1.3986
1039 N A -0.8330
1040 C A -0.4006
1041 G A -0.8100
1042 S A -1.1047
1043 F A 0.0000
1044 T A -2.1360
1045 R A -3.4069
1046 E A -3.7119
1047 E A -3.0756
1048 A A 0.0000
1049 D A -3.1311
1050 E A -3.1829
1051 Y A -1.2311
1052 I A 0.0000
1053 D A -1.8184
1054 I A 0.4424
1055 G A -0.2248
1056 A A 0.0000
1057 L A 0.0000
1058 N A -0.5486
1059 G A 0.0866
1060 I A 0.0000
1061 F A 0.0000
1062 V A 0.7576
1063 L A 0.6631
1064 G A 0.0000
1065 R A 0.0000
1066 S A 0.5402
1067 M A 0.6668
1068 G A -0.0504
1069 F A 0.0000
1070 I A 0.9520
1071 G A -0.0846
1072 H A -0.5472
1073 Y A -0.1141
1074 L A -0.3608
1075 D A -1.3252
1076 Q A -1.4062
1077 K A -2.1681
1078 R A -2.1686
1079 L A -0.8012
1080 K A -2.1900
1081 Q A -1.4135
1082 G A -0.5666
1083 L A 0.6362
1084 Y A -0.0481
1085 R A -1.4001
1086 H A -1.3865
1087 P A -1.1534
1088 W A -0.2772
1089 D A -1.8317
1090 D A -1.9267
1091 I A 0.0959
1092 S A 0.8868
1093 Y A 2.4499
1094 V A 2.9088
1095 L A 2.1792
1096 P A 0.1402
1097 E A -1.5839
1098 H A -1.1249
1099 M A 0.4823
1100 S A 0.3299
1101 M A 1.1097
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Laboratory of Theory of Biopolymers 2018