Project name: C933R_4D

Status: done

Started: 2026-05-14 00:52:17
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSRFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
input PDB
Selected Chain(s) A
Distance of aggregation 10 Å
FoldX usage Yes
pH calculations No
alphaCutter usage No
Dynamic mode Yes
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 minimization                                          (00:00:01)
[INFO]       CABS:     Running CABS flex simulation                                                (00:18:46)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (10:51:33)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (10:52:12)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (10:52:56)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (10:53:40)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (10:54:23)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (10:55:03)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (10:55:42)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (10:56:22)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (10:57:01)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (10:57:41)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (10:58:21)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (10:59:01)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (10:59:39)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (11:00:55)
[INFO]       Main:     Simulation completed successfully.                                          (11:01:33)
Show buried residues

Minimal score value
-4.4643
Maximal score value
3.7904
Average score
-0.5929
Total score value
-1376.1819

The table below lists A4D score for protein residues. Residues with A4D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan4D score mutation
1 M A 0.7959
2 G A 0.0000
3 P A -0.1016
4 G A -0.7526
5 A A -1.3274
6 R A -2.9079
7 G A -2.5433
8 R A -4.0880
9 R A -4.3389
10 R A -3.7138
11 R A -3.2951
12 R A -3.1668
13 R A -1.9056
14 P A -0.5965
15 M A 0.1587
16 S A -0.0734
17 P A -0.6008
18 P A -0.5341
19 P A -0.8860
20 P A -1.0417
21 P A -0.6017
22 P A -0.3130
23 P A 0.1790
24 V A 0.9752
25 R A -0.2589
26 A A -0.2471
27 L A -0.3324
28 P A 0.0000
29 L A 0.0000
30 L A -0.3316
31 L A 0.0000
32 L A 0.0000
33 L A -0.1898
34 A A -0.3006
35 G A -0.8102
36 P A -0.6945
37 G A -0.6691
38 A A -0.1503
39 A A 0.0208
40 A A -0.1430
41 P A -0.0078
42 P A 0.0000
43 C A 0.0019
44 L A 0.0000
45 D A -1.7007
46 G A 0.0000
47 S A 0.0000
48 P A 0.0000
49 C A 0.0000
50 A A 0.0000
51 N A -1.2112
52 G A 0.0000
53 G A 0.0000
54 R A -0.9580
55 C A 0.0000
56 T A 0.0000
57 Q A -0.7735
58 L A 0.5136
59 P A 0.0305
60 S A -0.1971
61 R A 0.0000
62 E A -1.1076
63 A A 0.0000
64 A A 0.0000
65 C A 0.0000
66 L A 0.7202
67 C A 0.1547
68 P A 0.0000
69 P A -0.4942
70 G A -0.7687
71 W A -0.6711
72 V A 0.0000
73 G A -0.2871
74 E A -0.3738
75 R A 0.0000
76 C A 0.0000
77 Q A -0.8918
78 L A -1.2153
79 E A -2.1440
80 D A -1.4477
81 P A -1.0236
82 C A -0.9484
83 H A -1.5123
84 S A -1.1183
85 G A -1.3193
86 P A -0.9741
87 C A 0.0000
88 A A -0.6195
89 G A -1.0064
90 R A -2.4256
91 G A -1.5192
92 V A -0.8598
93 C A -0.4425
94 Q A -0.2686
95 S A -0.4529
96 S A 0.0000
97 V A 0.0000
98 V A 0.3453
99 A A -0.0556
100 G A -0.6766
101 T A -0.3844
102 A A -0.6505
103 R A -0.8139
104 F A -0.3837
105 S A 0.0000
106 C A -0.4985
107 R A -0.7279
108 C A 0.0000
109 P A -0.9238
110 R A -1.6674
111 G A 0.0282
112 F A 1.2361
113 R A 0.0000
114 G A -0.6460
115 P A -0.5712
116 D A -1.7129
117 C A -0.3148
118 S A -0.2882
119 L A 0.8441
120 P A 0.6178
121 D A 0.0000
122 P A 0.5104
123 C A 1.2133
124 L A 1.2863
125 S A 0.1596
126 S A 0.0044
127 P A -0.2869
128 C A 0.0000
129 A A -1.3081
130 H A -1.8328
131 G A -1.0297
132 A A -0.8518
133 R A -0.2188
134 C A 0.0000
135 S A 0.7469
136 V A 0.8469
137 G A 0.0000
138 P A 0.0000
139 D A -2.2990
140 G A -1.2549
141 R A -1.2482
142 F A 1.8528
143 L A 2.3909
144 C A 1.0298
145 S A 0.5662
146 C A -0.7702
147 P A 0.0000
148 P A -1.2381
149 G A -1.1302
150 Y A 0.0000
151 Q A 0.0000
152 G A -1.3798
153 R A -2.4509
154 S A -1.6366
155 C A -0.2752
156 R A -2.2285
157 S A -1.8149
158 D A -2.1571
159 V A -1.3719
160 D A -1.9122
161 E A 0.0000
162 C A 0.0000
163 R A -2.0977
164 V A -0.5673
165 G A -1.6349
166 E A -2.7765
167 P A -2.2176
168 C A -2.3014
169 R A -2.9757
170 H A -2.1357
171 G A -1.2702
172 G A -0.7834
173 T A -1.2195
174 C A -1.0014
175 L A 0.0343
176 N A -0.6833
177 T A -0.8135
178 P A -1.1921
179 G A 0.0000
180 S A -1.6967
181 F A 0.0000
182 R A -1.7517
183 C A -0.9163
184 Q A 0.0000
185 C A 0.3497
186 P A -0.0165
187 A A 0.3881
188 G A 0.3347
189 Y A 0.7775
190 T A -0.9009
191 G A 0.0000
192 P A 0.0000
193 L A -2.8433
194 C A 0.0000
195 E A -2.8537
196 N A -1.3245
197 P A 0.0000
198 A A -0.0237
199 V A 0.0000
200 P A 0.2526
201 C A 0.0000
202 A A -0.5441
203 P A -0.3940
204 S A -0.9904
205 P A -0.8087
206 C A -1.0317
207 R A -2.2347
208 N A -2.1127
209 G A -1.1433
210 G A -0.5811
211 T A -0.4731
212 C A -1.4503
213 R A -3.1049
214 Q A -2.7245
215 S A -1.8492
216 G A -1.4681
217 D A -1.4503
218 L A 0.4307
219 T A -0.6673
220 Y A 0.0000
221 D A -2.3875
222 C A 0.0000
223 A A -0.7239
224 C A 0.0000
225 L A 0.7019
226 P A -0.2586
227 G A -0.3807
228 F A -0.4004
229 E A -1.7179
230 G A -1.6696
231 Q A -2.2125
232 N A -2.4535
233 C A -1.5612
234 E A -1.3309
235 V A -0.7382
236 N A 0.0000
237 V A -0.5086
238 D A -2.0235
239 D A -2.6306
240 C A 0.0000
241 P A -1.7199
242 G A -1.7012
243 H A -2.1132
244 R A -2.1559
245 C A 0.0000
246 L A 0.0000
247 N A 0.0000
248 G A -1.2629
249 G A -1.0704
250 T A -1.0539
251 C A -1.0638
252 V A -0.2378
253 D A -2.0863
254 G A -1.0529
255 V A -0.1286
256 N A -1.6386
257 T A -1.2001
258 Y A -1.3723
259 N A -1.6579
260 C A -1.0457
261 Q A -1.0637
262 C A -0.4480
263 P A -0.2331
264 P A -0.5198
265 E A 0.0000
266 W A 0.0000
267 T A -0.9967
268 G A -1.5656
269 Q A -1.6796
270 F A -0.2366
271 C A 0.0000
272 T A -0.2982
273 E A -1.5357
274 D A -1.8137
275 V A 0.0000
276 D A -1.2747
277 E A 0.0000
278 C A -0.8101
279 Q A -1.2348
280 L A -0.4912
281 Q A 0.0000
282 P A -1.0982
283 N A -1.6176
284 A A 0.0000
285 C A 0.0000
286 H A -0.8521
287 N A -0.7753
288 G A -0.8974
289 G A -0.8756
290 T A 0.0000
291 C A 0.0000
292 F A -0.5600
293 N A -0.5920
294 T A 0.0000
295 L A 0.6045
296 G A 0.0000
297 G A 0.0000
298 H A 0.0000
299 S A 0.0000
300 C A 0.0000
301 V A 0.0000
302 C A 0.0000
303 V A 0.0000
304 N A -0.3146
305 G A -0.2806
306 W A 0.0000
307 T A -0.8331
308 G A -1.3570
309 E A -1.4725
310 S A -1.0226
311 C A 0.0000
312 S A 0.0000
313 Q A 0.0000
314 N A 0.0000
315 I A 0.0000
316 D A 0.0000
317 D A 0.0000
318 C A 0.0000
319 A A 0.5470
320 T A 0.0000
321 A A 0.0000
322 V A 2.1784
323 C A 1.7149
324 F A 2.1519
325 H A 0.5950
326 G A -0.2340
327 A A 0.3320
328 T A 0.0014
329 C A -0.0076
330 H A -1.1230
331 D A 0.0000
332 R A 0.0000
333 V A 0.0000
334 A A -0.0842
335 S A 0.0000
336 F A 0.0000
337 Y A -0.1711
338 C A 0.0000
339 A A -0.1266
340 C A 0.1821
341 P A 0.0000
342 M A 0.4160
343 G A 0.0000
344 K A 0.0000
345 T A 0.0000
346 G A 0.0000
347 L A 0.0000
348 L A 0.0000
349 C A 0.0000
350 H A -1.1028
351 L A -0.7366
352 D A -1.4968
353 D A -1.2167
354 A A -0.4373
355 C A -0.0414
356 V A -0.4498
357 S A -1.0601
358 N A -1.5904
359 P A 0.0000
360 C A -1.2011
361 H A 0.0000
362 E A -3.4795
363 D A -3.3092
364 A A -1.7788
365 I A -0.2097
366 C A 0.0000
367 D A 0.0000
368 T A 0.0000
369 N A 0.0000
370 P A 0.0000
371 V A 0.0000
372 N A -0.8713
373 G A -1.0827
374 R A -0.6742
375 A A -0.2601
376 I A 0.4961
377 C A 0.5144
378 T A 0.0000
379 C A 0.0000
380 P A 0.0000
381 P A -0.5155
382 G A -0.3655
383 F A 0.0399
384 T A -0.4241
385 G A -0.0377
386 G A 0.0000
387 A A -0.7208
388 C A 0.0000
389 D A -2.2147
390 Q A 0.0000
391 D A -2.3778
392 V A -1.7419
393 D A -2.3762
394 E A -2.2395
395 C A -0.7813
396 S A -0.2006
397 I A 0.7629
398 G A 0.0770
399 A A -0.0499
400 N A -0.4449
401 P A -0.8625
402 C A 0.0000
403 E A -2.2290
404 H A -1.8936
405 L A -0.9394
406 G A -1.5419
407 R A -1.8087
408 C A -0.9240
409 V A 0.0702
410 N A 0.0000
411 T A 0.4108
412 Q A -0.9764
413 G A -0.7023
414 S A -0.2564
415 F A -0.4831
416 L A -0.6450
417 C A 0.0000
418 Q A -1.2155
419 C A -1.3286
420 G A -1.2326
421 R A -1.4335
422 G A -0.5946
423 Y A -0.2096
424 T A -0.4819
425 G A 0.0000
426 P A -1.0617
427 R A -1.9680
428 C A -1.0676
429 E A -1.0572
430 T A -1.1250
431 D A -0.9974
432 V A -0.5061
433 N A -0.7818
434 E A -0.6793
435 C A 0.0962
436 L A 0.0873
437 S A 0.0000
438 G A -0.9665
439 P A -1.1928
440 C A -1.0299
441 R A -2.6134
442 N A -2.3867
443 Q A -1.5959
444 A A 0.0000
445 T A 0.0000
446 C A 0.0000
447 L A 0.0000
448 D A 0.0000
449 R A -0.0594
450 I A 1.0855
451 G A -0.4078
452 Q A -0.5442
453 F A 0.5915
454 T A 0.5456
455 C A 0.8856
456 I A 1.0130
457 C A 0.0000
458 M A 0.6987
459 A A 0.4634
460 G A 0.2056
461 F A 1.6001
462 T A 0.5040
463 G A 0.0551
464 T A 0.2380
465 Y A 0.5954
466 C A 0.0000
467 E A -0.8713
468 V A 0.1519
469 D A 0.1453
470 I A 0.7419
471 D A -0.9386
472 E A -2.1072
473 C A 0.0000
474 Q A -2.3122
475 S A -1.4283
476 S A -0.7623
477 P A -0.4508
478 C A 0.0174
479 V A 0.3928
480 N A -0.9669
481 G A -0.9457
482 G A -0.8608
483 V A -0.6191
484 C A 0.0000
485 K A -2.2291
486 D A -2.0758
487 R A -1.7910
488 V A 0.4153
489 N A -0.8161
490 G A -0.1949
491 F A 0.3859
492 S A -0.3755
493 C A 0.1442
494 T A -0.0674
495 C A 0.2502
496 P A -0.1968
497 S A -0.3136
498 G A 0.4146
499 F A 1.0256
500 S A 0.1891
501 G A -0.1857
502 S A 0.0000
503 T A 0.4081
504 C A 0.4710
505 Q A 0.2495
506 L A -0.4834
507 D A -2.0356
508 V A -1.7920
509 D A -2.1803
510 E A -2.0256
511 C A 0.0000
512 A A -0.9160
513 S A -0.9208
514 T A -0.3687
515 P A -0.6689
516 C A -0.5585
517 R A -1.0898
518 N A -1.8872
519 G A -1.7440
520 A A -1.4403
521 K A -2.0042
522 C A -1.1677
523 V A -0.8488
524 D A -2.0851
525 Q A -2.1339
526 P A -2.1554
527 D A -2.4393
528 G A -1.4558
529 Y A -0.5552
530 E A -1.4570
531 C A -0.8638
532 R A -1.2197
533 C A -0.3565
534 A A -0.1762
535 E A -0.4598
536 G A 0.1776
537 F A 0.6460
538 E A -0.3569
539 G A -0.8105
540 T A 0.1715
541 L A 1.0739
542 C A 0.3154
543 D A -1.4811
544 R A -0.8857
545 N A -0.8649
546 V A 0.2252
547 D A -1.0663
548 D A -1.9233
549 C A -0.9778
550 S A -1.5609
551 P A -2.4734
552 D A -3.0234
553 P A -2.4182
554 C A -2.4414
555 H A -2.2393
556 H A -2.1780
557 G A -1.9925
558 R A -1.6577
559 C A 0.0336
560 V A 1.4499
561 D A 0.2497
562 G A 0.7330
563 I A 1.7481
564 A A 0.4387
565 S A -0.3390
566 F A 0.0000
567 S A -0.4609
568 C A 0.0000
569 A A -1.0839
570 C A 0.0000
571 A A -0.8293
572 P A -0.8136
573 G A -0.6629
574 Y A 0.0000
575 T A -1.2500
576 G A -1.5856
577 T A -1.2298
578 R A -2.9938
579 C A 0.0000
580 E A -2.9395
581 S A -2.3884
582 Q A -1.9170
583 V A -1.2002
584 D A -2.1854
585 E A -1.9092
586 C A -0.9310
587 R A -2.7551
588 S A -1.6275
589 Q A -2.0862
590 P A -2.2887
591 C A 0.0000
592 R A -2.5811
593 H A -2.2763
594 G A -2.3319
595 G A -1.6356
596 K A -1.8007
597 C A -0.3584
598 L A 1.0077
599 D A -0.3458
600 L A 0.8958
601 V A -0.1407
602 D A -1.8959
603 K A -1.4905
604 Y A -0.6892
605 L A 0.4092
606 C A -0.8466
607 R A -1.8141
608 C A -1.6769
609 P A -1.1148
610 S A -0.6230
611 G A -0.8320
612 T A -0.9817
613 T A -1.0759
614 G A -0.5148
615 V A 0.5941
616 N A -1.1391
617 C A 0.0000
618 E A -2.6553
619 V A -1.5851
620 N A -0.9746
621 I A -0.1081
622 D A -1.6298
623 D A -2.0130
624 C A 0.0000
625 A A -0.9410
626 S A -1.0203
627 N A -1.0596
628 P A -0.5170
629 C A 0.1780
630 T A 0.3951
631 F A 0.6583
632 G A 0.2440
633 V A 0.6124
634 C A 0.0621
635 R A -1.0922
636 D A -1.8480
637 G A -0.8611
638 I A 0.0827
639 N A -1.2724
640 R A -2.3565
641 Y A 0.0000
642 D A -1.0018
643 C A 0.0000
644 V A 1.1718
645 C A 0.8758
646 Q A -0.2091
647 P A -0.5014
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1974 T A 0.0000
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1995 F A 1.3548
1996 A A 0.0000
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2271 P A -0.5304
2272 S A -0.7114
2273 P A -0.6141
2274 A A -0.1489
2275 T A 0.0000
2276 A A -0.8261
2277 T A -0.8834
2278 G A -0.6041
2279 A A -0.0925
2280 M A 0.8642
2281 A A 0.4629
2282 T A 0.1573
2283 T A -0.1107
2284 T A -0.3353
2285 G A -0.1800
2286 A A 0.5173
2287 L A 1.3332
2288 P A 0.1863
2289 A A 0.0734
2290 Q A -0.5852
2291 P A -0.3141
2292 L A 0.1332
2293 P A 0.2379
2294 L A 0.5128
2295 S A 0.3493
2296 V A 0.3909
2297 P A -0.1219
2298 S A 0.0000
2299 S A 0.1090
2300 L A 0.3153
2301 A A 0.0568
2302 Q A -0.0535
2303 A A -0.2156
2304 Q A -0.4084
2305 T A -0.4552
2306 Q A -0.5017
2307 L A 0.1461
2308 G A -0.5470
2309 P A -0.8018
2310 Q A -1.5387
2311 P A -1.6428
2312 E A -2.2571
2313 V A -1.4212
2314 T A -1.6667
2315 P A -2.5293
2316 K A -3.3089
2317 R A -3.5262
2318 Q A -1.2298
2319 V A 0.8794
2320 L A 0.1304
2321 A A -0.7615
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CABS-flex predictions of flexibility of input structure

In dynamic mode, A4D analysis is performed on the set of models reflecting fluctuations of the input structure (predicted by CABS-flex method, models are numbered from 0 to 11) and the input model. Their A4D scores are provided below in the table.
The right panel presents comparison of the most aggregation prone model (with the highest A4D score, -0.5929 in this case) with the input model (the most aggregation prone model in blue, input in red) and RMSF plot which shows the extent of residue fluctuations in Angstroms (predicted by CABS-flex).

Model
Average A4D Score
model_1 -0.5929 View CSV PDB
model_4 -0.628 View CSV PDB
model_8 -0.6449 View CSV PDB
model_0 -0.6451 View CSV PDB
model_6 -0.6488 View CSV PDB
model_7 -0.6537 View CSV PDB
CABS_average -0.6562 View CSV PDB
model_9 -0.6576 View CSV PDB
model_2 -0.66 View CSV PDB
model_10 -0.6636 View CSV PDB
model_5 -0.6693 View CSV PDB
model_3 -0.6849 View CSV PDB
model_11 -0.7256 View CSV PDB
input -0.7688 View CSV PDB