Project name: C540G_4D

Status: done

Started: 2026-05-14 00:51:40
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGGLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:17:13)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (10:20:18)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (10:20:59)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (10:21:39)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (10:22:19)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (10:23:00)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (10:23:40)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (10:24:21)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (10:25:01)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (10:25:42)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (10:26:22)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (10:27:02)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (10:27:43)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (10:28:23)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (10:29:45)
[INFO]       Main:     Simulation completed successfully.                                          (10:30:25)
Show buried residues

Minimal score value
-3.6992
Maximal score value
4.1785
Average score
-0.5862
Total score value
-1360.6263

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 0.9111
2 G A 0.0673
3 P A -0.4321
4 G A -0.4677
5 A A 0.0000
6 R A -2.7341
7 G A -2.4483
8 R A -2.7194
9 R A -2.8561
10 R A -2.4847
11 R A -2.0211
12 R A -1.9733
13 R A -2.2139
14 P A -0.8726
15 M A 0.0883
16 S A -0.1122
17 P A -0.3260
18 P A -0.3614
19 P A -0.7814
20 P A -0.6491
21 P A -0.2308
22 P A -0.3407
23 P A 0.0012
24 V A 0.7357
25 R A -0.6823
26 A A 0.4299
27 L A 1.6782
28 P A 1.5530
29 L A 3.1696
30 L A 3.3097
31 L A 2.5827
32 L A 1.7085
33 L A 1.2534
34 A A 0.1565
35 G A -0.6239
36 P A -0.1067
37 G A -0.5019
38 A A -0.0820
39 A A -0.4338
40 A A 0.0000
41 P A -1.6992
42 P A -1.7926
43 C A 0.0000
44 L A -1.4923
45 D A -2.1141
46 G A -1.3519
47 S A -0.9135
48 P A -0.7279
49 C A 0.0000
50 A A -0.5312
51 N A -0.1114
52 G A 0.0000
53 G A 0.0000
54 R A 0.0000
55 C A -0.5216
56 T A 0.0000
57 Q A -1.7447
58 L A 0.0000
59 P A -0.9335
60 S A -1.4461
61 R A -2.8516
62 E A -3.0644
63 A A -1.8259
64 A A 0.0000
65 C A 0.0000
66 L A 0.0000
67 C A 0.0000
68 P A -0.2202
69 P A -0.7213
70 G A 0.0000
71 W A -1.1405
72 V A 0.0000
73 G A 0.0000
74 E A -2.5547
75 R A -2.9200
76 C A 0.0000
77 Q A -1.9968
78 L A -1.7084
79 E A -1.8781
80 D A -1.3892
81 P A -0.7979
82 C A 0.0000
83 H A -1.1306
84 S A -0.7883
85 G A -0.3180
86 P A -0.4654
87 C A -0.5514
88 A A -0.9877
89 G A -1.8035
90 R A -2.2447
91 G A -1.6048
92 V A -0.8553
93 C A -0.6223
94 Q A -1.1003
95 S A -0.6522
96 S A -0.7290
97 V A 0.0000
98 V A -0.7749
99 A A -1.2725
100 G A -1.1077
101 T A -0.6577
102 A A -0.9253
103 R A -1.0102
104 F A 0.4326
105 S A -0.4433
106 C A -1.2777
107 R A -2.7177
108 C A 0.0000
109 P A -2.5048
110 R A -2.6060
111 G A -1.7566
112 F A -2.2115
113 R A -2.6477
114 G A -2.7669
115 P A -2.2228
116 D A -2.4345
117 C A -1.5819
118 S A -1.4330
119 L A -1.6324
120 P A -1.8134
121 D A -2.0215
122 P A -0.8349
123 C A 0.2518
124 L A 0.9960
125 S A 0.3353
126 S A 0.2756
127 P A 0.0052
128 C A -0.2108
129 A A -0.4783
130 H A -1.2292
131 G A -1.1727
132 A A -1.0573
133 R A -1.7113
134 C A -0.2120
135 S A -0.6144
136 V A -1.0044
137 G A -1.4015
138 P A -1.6863
139 D A -2.4249
140 G A -2.3067
141 R A -2.3874
142 F A -0.5345
143 L A -0.0013
144 C A 0.0000
145 S A -0.6973
146 C A -0.8379
147 P A 0.0000
148 P A -0.0733
149 G A 0.0257
150 Y A 0.2149
151 Q A -1.1108
152 G A -1.6183
153 R A -1.8277
154 S A -1.2075
155 C A -0.9183
156 R A -1.0681
157 S A -0.5948
158 D A 0.0304
159 V A 0.4288
160 D A -0.6463
161 E A -1.3680
162 C A -1.0799
163 R A -1.6208
164 V A -0.2328
165 G A -1.2588
166 E A -2.6259
167 P A -1.9648
168 C A 0.0000
169 R A -2.9129
170 H A -2.3910
171 G A -1.5654
172 G A -1.3917
173 T A -1.2513
174 C A -1.3086
175 L A -0.4911
176 N A -1.0537
177 T A -0.8210
178 P A -0.7324
179 G A -1.1580
180 S A -0.9981
181 F A 0.0000
182 R A -2.3224
183 C A 0.0000
184 Q A -1.8180
185 C A -1.6273
186 P A -1.0466
187 A A -0.3067
188 G A -0.4692
189 Y A 0.0000
190 T A 0.0000
191 G A -0.9514
192 P A -0.9514
193 L A -0.9656
194 C A 0.0000
195 E A -2.0638
196 N A -1.8239
197 P A -0.9938
198 A A -0.3063
199 V A -0.2074
200 P A 0.0720
201 C A 0.7473
202 A A 0.3322
203 P A -0.1922
204 S A -0.5174
205 P A -1.1419
206 C A -1.3992
207 R A -2.3855
208 N A -1.9798
209 G A -1.2897
210 G A -0.7812
211 T A -0.9923
212 C A -1.3557
213 R A -2.4487
214 Q A -2.2142
215 S A -1.6128
216 G A -1.2452
217 D A -1.4955
218 L A 0.2275
219 T A -0.4864
220 Y A -0.9409
221 D A -1.5267
222 C A -1.0933
223 A A -0.1896
224 C A 0.0000
225 L A 0.8107
226 P A 0.5514
227 G A 0.5513
228 F A 1.2703
229 E A -0.3138
230 G A -0.4284
231 Q A -1.2094
232 N A -1.0483
233 C A -0.6835
234 E A -1.3900
235 V A 0.0000
236 N A 0.0000
237 V A 0.5150
238 D A -0.2427
239 D A -0.6754
240 C A -0.6011
241 P A -0.6821
242 G A -1.5693
243 H A -1.2373
244 R A -1.5384
245 C A -0.3564
246 L A -0.0019
247 N A -1.2035
248 G A -0.8703
249 G A 0.0000
250 T A -0.2195
251 C A 0.2469
252 V A 0.7319
253 D A -1.1159
254 G A -0.6890
255 V A 0.2022
256 N A -1.4611
257 T A -1.0207
258 Y A -0.8344
259 N A -1.5496
260 C A 0.0000
261 Q A -1.1764
262 C A 0.0000
263 P A -1.4658
264 P A -1.6738
265 E A -2.6022
266 W A -0.8420
267 T A -0.4673
268 G A -0.2766
269 Q A -0.2714
270 F A 0.8180
271 C A 0.0000
272 T A -0.2492
273 E A -1.3666
274 D A -2.5855
275 V A 0.0000
276 D A -2.8237
277 E A -1.7677
278 C A -1.1176
279 Q A -1.4359
280 L A -0.8457
281 Q A -1.5146
282 P A -1.3259
283 N A -1.6752
284 A A -1.2027
285 C A 0.0000
286 H A -1.8131
287 N A -1.6675
288 G A -1.4130
289 G A -0.3660
290 T A 0.6533
291 C A 0.6978
292 F A 1.5582
293 N A -0.1202
294 T A 0.2774
295 L A 0.6059
296 G A -0.8680
297 G A -0.5434
298 H A -0.7045
299 S A 0.2884
300 C A 1.0688
301 V A 1.8733
302 C A 0.0000
303 V A 1.4021
304 N A 0.1870
305 G A 0.4632
306 W A 0.6353
307 T A -0.1655
308 G A -0.9274
309 E A -1.2616
310 S A -0.2858
311 C A 0.0000
312 S A -0.2462
313 Q A -0.8245
314 N A 0.2459
315 I A 0.9291
316 D A -0.7417
317 D A 0.0000
318 C A 0.0000
319 A A -0.4906
320 T A -0.3953
321 A A -0.1543
322 V A 0.0000
323 C A 0.0000
324 F A 0.0000
325 H A -0.7729
326 G A -0.8878
327 A A 0.0000
328 T A -0.3703
329 C A -0.5070
330 H A -1.0655
331 D A -1.4161
332 R A -1.4619
333 V A 0.5784
334 A A -0.2006
335 S A -0.5691
336 F A 0.0000
337 Y A -0.1987
338 C A 0.0000
339 A A 0.2246
340 C A 0.0000
341 P A 0.0000
342 M A -0.0604
343 G A -0.1766
344 K A 0.0000
345 T A 0.2611
346 G A 0.2033
347 L A 0.8289
348 L A 0.9897
349 C A 0.0000
350 H A 0.0000
351 L A 0.0000
352 D A 0.0000
353 D A 0.0000
354 A A 0.0000
355 C A 0.0000
356 V A 0.0000
357 S A -0.6955
358 N A -1.0088
359 P A -0.6202
360 C A 0.0000
361 H A -1.0844
362 E A -2.0754
363 D A -1.2741
364 A A 0.0000
365 I A 0.7678
366 C A 0.0000
367 D A -0.1929
368 T A 0.0000
369 N A 0.0000
370 P A 0.0000
371 V A 0.0000
372 N A -1.1160
373 G A -0.9329
374 R A -1.2656
375 A A -0.6436
376 I A -0.0528
377 C A 0.0000
378 T A 0.2717
379 C A 0.0000
380 P A 0.0063
381 P A 0.0000
382 G A 0.0437
383 F A 0.5784
384 T A 0.0000
385 G A 0.0000
386 G A 0.0000
387 A A -0.0857
388 C A 0.0000
389 D A -0.0524
390 Q A 0.0000
391 D A 0.0000
392 V A 0.2173
393 D A -0.2383
394 E A -0.6409
395 C A 0.0000
396 S A -0.1553
397 I A 0.2381
398 G A -0.3095
399 A A -0.3871
400 N A -0.5388
401 P A -0.7489
402 C A -1.1343
403 E A 0.0000
404 H A 0.0000
405 L A 0.0000
406 G A -1.2374
407 R A -1.4965
408 C A 0.0000
409 V A 0.8138
410 N A 0.0000
411 T A 0.5566
412 Q A 0.0000
413 G A 0.2671
414 S A 1.1100
415 F A 1.9146
416 L A 1.4445
417 C A -0.1228
418 Q A -1.1044
419 C A -0.9662
420 G A -0.8502
421 R A -1.0149
422 G A -0.5749
423 Y A -0.2543
424 T A -0.6027
425 G A -0.9012
426 P A -1.0255
427 R A -1.8707
428 C A 0.0000
429 E A -1.7097
430 T A -0.7540
431 D A 0.0000
432 V A -0.4615
433 N A -0.6774
434 E A -0.3834
435 C A 0.2287
436 L A 1.1353
437 S A 0.5506
438 G A 0.0889
439 P A -0.9382
440 C A 0.0000
441 R A -2.8947
442 N A -2.5847
443 Q A -1.7152
444 A A -0.9006
445 T A 0.0000
446 C A -0.0579
447 L A 0.0000
448 D A -0.8523
449 R A 0.0000
450 I A 0.0000
451 G A -0.5292
452 Q A -0.3409
453 F A 0.0673
454 T A 0.0000
455 C A 0.0000
456 I A 0.0863
457 C A 0.0000
458 M A -0.3401
459 A A 0.0779
460 G A -0.4460
461 F A -0.5417
462 T A -0.0040
463 G A -0.3809
464 T A -0.0475
465 Y A 0.7552
466 C A 0.0000
467 E A -1.6060
468 V A -0.1852
469 D A 0.0000
470 I A -0.2252
471 D A -1.4834
472 E A -2.8656
473 C A 0.0000
474 Q A -1.7085
475 S A -1.1682
476 S A 0.0000
477 P A -0.4985
478 C A 0.0000
479 V A -1.0835
480 N A -1.5386
481 G A -1.1988
482 G A -1.1119
483 V A -1.0107
484 C A -1.5169
485 K A -2.8127
486 D A -3.5261
487 R A -2.7779
488 V A -0.5758
489 N A -1.2475
490 G A -1.2046
491 F A -0.4285
492 S A -0.5840
493 C A -0.2395
494 T A -0.0507
495 C A 0.2259
496 P A -0.3016
497 S A -0.5153
498 G A -0.7639
499 F A 0.3847
500 S A -0.2695
501 G A -0.4468
502 S A -0.2539
503 T A -0.0767
504 C A 0.0000
505 Q A 0.0000
506 L A 0.0000
507 D A -2.3110
508 V A -2.2714
509 D A -3.4259
510 E A -2.6525
511 C A -0.9504
512 A A -0.2254
513 S A -0.4464
514 T A -0.1486
515 P A -0.7172
516 C A -0.7489
517 R A -2.1000
518 N A -1.9081
519 G A -1.8880
520 A A -1.8321
521 K A -2.4181
522 C A -1.3407
523 V A -1.0496
524 D A -2.6021
525 Q A -2.4260
526 P A -2.3609
527 D A -2.7014
528 G A -1.6730
529 Y A -1.4842
530 E A -2.1171
531 C A -1.7225
532 R A -2.3590
533 C A -1.6214
534 A A -1.3017
535 E A -1.5983
536 G A -1.7767
537 F A -0.7492
538 E A -2.0653
539 G A -1.0332
540 G A -0.0082
541 L A 0.9275
542 C A -0.0452
543 D A -2.0248
544 R A -2.7725
545 N A -3.0150
546 V A -1.8092
547 D A -2.8678
548 D A -2.9526
549 C A -2.1992
550 S A -1.9315
551 P A -1.4288
552 D A -1.5845
553 P A -1.1475
554 C A -1.4721
555 H A -1.6701
556 H A -1.8869
557 G A -1.5073
558 R A -1.6858
559 C A -1.0263
560 V A 0.5857
561 D A -1.2445
562 G A 0.3194
563 I A 1.6300
564 A A 0.7687
565 S A -0.1399
566 F A -0.8306
567 S A -0.7451
568 C A 0.0000
569 A A -1.0614
570 C A -1.1525
571 A A -0.4491
572 P A -0.4084
573 G A -0.2449
574 Y A -0.2853
575 T A -0.8715
576 G A -1.4785
577 T A -1.2843
578 R A -2.6767
579 C A -2.1920
580 E A -2.4660
581 S A -1.4176
582 Q A -0.9438
583 V A 0.0404
584 D A -1.2728
585 E A -1.9393
586 C A 0.0000
587 R A -2.5221
588 S A -2.1909
589 Q A -2.3845
590 P A -1.6354
591 C A -1.5511
592 R A -1.2738
593 H A -2.0051
594 G A -1.9362
595 G A -1.7791
596 K A -1.5290
597 C A -0.4367
598 L A 1.0015
599 D A 0.1074
600 L A 1.3701
601 V A 0.4829
602 D A -1.5718
603 K A -1.0400
604 Y A 0.4583
605 L A 1.6245
606 C A -0.1192
607 R A -1.6616
608 C A -0.9751
609 P A -0.5606
610 S A -0.3486
611 G A -0.2496
612 T A -0.3710
613 T A -0.4228
614 G A -0.0749
615 V A 0.8060
616 N A -0.7720
617 C A -0.4521
618 E A -0.9202
619 V A -0.5281
620 N A -0.7487
621 I A 0.3114
622 D A -1.3809
623 D A -2.1939
624 C A -1.4040
625 A A -0.6176
626 S A -0.7049
627 N A -1.2017
628 P A -0.5498
629 C A 0.8651
630 T A 0.9586
631 F A 2.3546
632 G A 1.7081
633 V A 2.1212
634 C A 0.6450
635 R A -1.6538
636 D A -2.0226
637 G A 0.0000
638 I A 0.0000
639 N A -2.4677
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2257 S A 0.2811
2258 P A -0.4439
2259 S A -0.7943
2260 P A -0.5023
2261 P A -0.0376
2262 S A 0.0682
2263 L A 0.7719
2264 S A -0.2190
2265 D A -1.2263
2266 W A 0.0000
2267 S A -0.9478
2268 E A -1.2641
2269 S A -0.9439
2270 T A -0.8017
2271 P A -0.5804
2272 S A -0.8820
2273 P A -0.7691
2274 A A 0.0000
2275 T A 0.5735
2276 A A 0.4498
2277 T A -0.1630
2278 G A -0.1143
2279 A A -0.4482
2280 M A 0.0000
2281 A A -0.6059
2282 T A 0.0000
2283 T A -0.3738
2284 T A -0.4337
2285 G A -0.4303
2286 A A 0.1325
2287 L A 0.3690
2288 P A -0.1766
2289 A A -0.4729
2290 Q A -1.1367
2291 P A -0.5848
2292 L A -0.1501
2293 P A 0.3632
2294 L A 0.7798
2295 S A 0.8053
2296 V A 1.5726
2297 P A 0.5493
2298 S A 0.3256
2299 S A 0.5526
2300 L A 1.2192
2301 A A 0.7781
2302 Q A -0.0502
2303 A A 0.0681
2304 Q A -0.6461
2305 T A -0.4623
2306 Q A 0.0000
2307 L A 0.4693
2308 G A 0.1003
2309 P A 0.1450
2310 Q A 0.0000
2311 P A -0.0140
2312 E A 0.2869
2313 V A 1.2932
2314 T A 0.1816
2315 P A -0.2421
2316 K A 0.0000
2317 R A -0.9743
2318 Q A -1.1263
2319 V A 0.0000
2320 L A 0.4302
2321 A A 0.1348
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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, -0.5862 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_9 -0.5862 View CSV PDB
model_5 -0.5901 View CSV PDB
model_2 -0.605 View CSV PDB
model_3 -0.6164 View CSV PDB
model_10 -0.6168 View CSV PDB
model_0 -0.6234 View CSV PDB
CABS_average -0.6256 View CSV PDB
model_4 -0.6288 View CSV PDB
model_11 -0.6355 View CSV PDB
model_8 -0.6375 View CSV PDB
model_6 -0.6446 View CSV PDB
model_1 -0.6467 View CSV PDB
model_7 -0.6759 View CSV PDB
input -0.7596 View CSV PDB