Project name: D1171V_10_4D

Status: done

Started: 2026-06-12 13:50:02
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLVSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:26:54)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (12:34:15)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (12:34:59)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (12:35:42)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (12:36:26)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (12:37:10)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (12:37:54)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (12:38:38)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (12:39:22)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (12:40:07)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (12:40:52)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (12:41:37)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (12:42:23)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (12:43:07)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (12:44:35)
[INFO]       Main:     Simulation completed successfully.                                          (12:45:17)
Show buried residues

Minimal score value
-4.3996
Maximal score value
5.6758
Average score
-0.5403
Total score value
-1254.0513

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 0.4932
2 G A 0.0000
3 P A -0.5971
4 G A -0.8695
5 A A -0.6908
6 R A -0.6707
7 G A -1.1079
8 R A -1.5300
9 R A -2.6422
10 R A -2.7424
11 R A -3.1656
12 R A -2.5855
13 R A -1.6728
14 P A -0.6899
15 M A -0.8979
16 S A -0.5518
17 P A -0.1388
18 P A -0.0635
19 P A 0.0000
20 P A -0.3679
21 P A -0.5954
22 P A 0.0000
23 P A -0.7930
24 V A -1.1773
25 R A -2.3091
26 A A -1.4496
27 L A 0.0000
28 P A 0.0419
29 L A 0.0000
30 L A 1.2116
31 L A 2.3043
32 L A 2.4904
33 L A 0.0000
34 A A 0.9344
35 G A 0.2644
36 P A -0.6158
37 G A 0.0000
38 A A 0.0000
39 A A 0.0000
40 A A 0.0000
41 P A 0.0000
42 P A 0.0000
43 C A 0.0000
44 L A 0.0000
45 D A -2.1006
46 G A -1.3757
47 S A -0.8156
48 P A -0.8251
49 C A 0.0000
50 A A -0.5824
51 N A -0.6366
52 G A -0.9453
53 G A -0.9039
54 R A -1.4813
55 C A -0.5294
56 T A -0.6074
57 Q A -0.9433
58 L A -1.0542
59 P A -1.4403
60 S A -1.4508
61 R A 0.0000
62 E A -2.3619
63 A A 0.0000
64 A A -0.0473
65 C A 0.0000
66 L A 0.7888
67 C A -0.0423
68 P A -0.3202
69 P A -0.8881
70 G A -1.0843
71 W A -0.4513
72 V A 0.0000
73 G A -0.6442
74 E A 0.0522
75 R A 0.0000
76 C A 0.0000
77 Q A -1.1072
78 L A 0.0000
79 E A -2.6622
80 D A -2.6659
81 P A -1.2983
82 C A -0.5408
83 H A -0.8090
84 S A 0.0000
85 G A -0.2500
86 P A -0.7257
87 C A -1.1164
88 A A -1.1448
89 G A -1.5302
90 R A -1.9401
91 G A -0.9458
92 V A 0.9313
93 C A 0.9583
94 Q A 0.5978
95 S A 0.3600
96 S A 0.0000
97 V A 0.0000
98 V A 0.0000
99 A A -0.8281
100 G A -1.2680
101 T A -1.2226
102 A A 0.0000
103 R A 0.0000
104 F A 0.2210
105 S A 0.0000
106 C A 0.0000
107 R A -0.9084
108 C A 0.0000
109 P A -1.3821
110 R A -2.5552
111 G A -1.4425
112 F A -0.9973
113 R A -1.7823
114 G A 0.0000
115 P A -1.1985
116 D A -1.8354
117 C A -1.0828
118 S A -0.8600
119 L A -0.7802
120 P A -1.0477
121 D A -0.8488
122 P A 0.0546
123 C A 0.0000
124 L A 1.0255
125 S A 0.4107
126 S A 0.0415
127 P A -0.4321
128 C A 0.0000
129 A A -0.7043
130 H A -1.5186
131 G A -1.1787
132 A A -1.3134
133 R A -1.7136
134 C A -0.1898
135 S A -0.0603
136 V A -0.3243
137 G A -1.2858
138 P A -1.6010
139 D A -2.5933
140 G A -2.1815
141 R A -2.2962
142 F A 0.0000
143 L A 0.0417
144 C A 0.0000
145 S A -0.9499
146 C A 0.0000
147 P A -1.0100
148 P A -0.4474
149 G A -0.4016
150 Y A -0.3343
151 Q A -1.1544
152 G A 0.0000
153 R A -2.1117
154 S A -1.4763
155 C A -1.5114
156 R A -2.4103
157 S A -1.1846
158 D A 0.0000
159 V A -0.0219
160 D A 0.0000
161 E A 0.0000
162 C A -0.7582
163 R A -1.8993
164 V A -0.8009
165 G A -1.2629
166 E A -2.4104
167 P A -1.4404
168 C A -0.8237
169 R A -2.4182
170 H A -1.8334
171 G A -1.4423
172 G A -1.3852
173 T A -0.9223
174 C A 0.0000
175 L A -0.0990
176 N A 0.0717
177 T A 0.0171
178 P A -0.1867
179 G A -0.1740
180 S A 0.0583
181 F A 0.6906
182 R A -1.0106
183 C A -0.8494
184 Q A -0.5615
185 C A 0.0000
186 P A -0.3285
187 A A 0.1007
188 G A 0.1338
189 Y A 0.8876
190 T A 0.1355
191 G A -0.1790
192 P A 0.2066
193 L A 1.3195
194 C A 0.1450
195 E A -1.5061
196 N A -1.2924
197 P A 0.0000
198 A A 0.0838
199 V A 0.7285
200 P A 0.4006
201 C A 0.4447
202 A A 0.1434
203 P A -0.0388
204 S A 0.0974
205 P A 0.2345
206 C A 0.2823
207 R A -0.7660
208 N A -0.7422
209 G A -0.6202
210 G A -0.5016
211 T A -1.0010
212 C A -1.6963
213 R A -2.9291
214 Q A -2.5202
215 S A -2.0678
216 G A -1.6591
217 D A -1.8262
218 L A 0.0774
219 T A -0.9342
220 Y A -1.4711
221 D A -2.4181
222 C A 0.0000
223 A A -0.2197
224 C A 0.7541
225 L A 1.5334
226 P A 0.3327
227 G A 0.4634
228 F A 1.2036
229 E A 0.0000
230 G A 0.0000
231 Q A -1.8222
232 N A -1.9854
233 C A -1.2106
234 E A -1.4677
235 V A 0.0000
236 N A 0.3033
237 V A 0.9137
238 D A -0.4094
239 D A -1.0731
240 C A -1.2545
241 P A -1.1359
242 G A -1.3383
243 H A -1.4850
244 R A -1.8509
245 C A -1.4209
246 L A -1.2931
247 N A -1.8822
248 G A -1.7542
249 G A -1.4185
250 T A 0.0000
251 C A 0.0000
252 V A -0.4561
253 D A -0.1947
254 G A 0.1986
255 V A 0.8093
256 N A -0.7022
257 T A -0.2939
258 Y A -0.5726
259 N A -1.2443
260 C A 0.0000
261 Q A -0.9929
262 C A 0.0000
263 P A -0.8344
264 P A -1.0088
265 E A -0.8217
266 W A -1.0123
267 T A 0.0000
268 G A -0.9695
269 Q A -0.8524
270 F A 0.8466
271 C A 0.0000
272 T A -0.7471
273 E A -1.4106
274 D A -1.6417
275 V A 0.0000
276 D A 0.0000
277 E A -0.8634
278 C A 0.0000
279 Q A -0.6995
280 L A 0.2137
281 Q A -0.8436
282 P A -0.7514
283 N A -1.2825
284 A A -0.9709
285 C A 0.0000
286 H A -1.0665
287 N A -1.5864
288 G A -0.9888
289 G A -0.3235
290 T A 0.0569
291 C A 0.5523
292 F A 1.2769
293 N A 0.1880
294 T A 0.7031
295 L A 1.1208
296 G A 0.0000
297 G A -0.5379
298 H A -0.8987
299 S A -0.1604
300 C A 0.1326
301 V A 1.2331
302 C A 0.0000
303 V A 0.0000
304 N A 0.0000
305 G A -0.1154
306 W A -0.7802
307 T A -1.0702
308 G A -1.3477
309 E A -2.3167
310 S A -1.8585
311 C A 0.0000
312 S A -1.4785
313 Q A -1.9106
314 N A -1.5921
315 I A -0.9177
316 D A -1.7358
317 D A 0.0000
318 C A -0.4927
319 A A 0.0000
320 T A 0.7967
321 A A 1.0089
322 V A 1.8239
323 C A 1.3743
324 F A 0.8617
325 H A -0.7042
326 G A -0.6178
327 A A -0.1362
328 T A -0.1887
329 C A -0.2278
330 H A -1.1264
331 D A -1.8350
332 R A -1.6781
333 V A 0.2996
334 A A -0.2184
335 S A 0.0000
336 F A 0.0000
337 Y A -0.2922
338 C A 0.0000
339 A A 0.1031
340 C A 0.2078
341 P A 0.0970
342 M A 0.7251
343 G A -0.1591
344 K A -1.4035
345 T A -0.7828
346 G A -0.5239
347 L A 0.1911
348 L A 0.0000
349 C A 0.5571
350 H A -0.2200
351 L A -0.2219
352 D A 0.0000
353 D A -1.0658
354 A A 0.0000
355 C A -0.4120
356 V A 0.2393
357 S A -0.5421
358 N A -1.6576
359 P A -0.8441
360 C A -0.8014
361 H A -2.0069
362 E A -2.9344
363 D A -2.3976
364 A A -1.2216
365 I A -0.1766
366 C A -0.5146
367 D A -1.3342
368 T A 0.0000
369 N A 0.0000
370 P A 0.0000
371 V A 0.2843
372 N A -0.8794
373 G A -0.4068
374 R A -0.3304
375 A A 0.1225
376 I A 0.7516
377 C A 0.0000
378 T A 0.3073
379 C A 0.0000
380 P A -0.9423
381 P A -0.7711
382 G A 0.0000
383 F A 0.0000
384 T A -1.1908
385 G A -0.7824
386 G A 0.1921
387 A A 0.0000
388 C A 0.0000
389 D A -2.0929
390 Q A 0.0000
391 D A -2.3690
392 V A 0.0000
393 D A -0.7858
394 E A 0.0000
395 C A 0.0000
396 S A 0.0000
397 I A -0.0353
398 G A -0.2765
399 A A -0.6381
400 N A -1.9254
401 P A -1.4652
402 C A 0.0000
403 E A -2.1357
404 H A 0.0000
405 L A 0.0000
406 G A 0.0000
407 R A -1.9491
408 C A -0.4309
409 V A 0.4464
410 N A -0.3015
411 T A -0.6285
412 Q A -2.1520
413 G A -1.5449
414 S A -0.1844
415 F A 0.2752
416 L A 0.6578
417 C A 0.0000
418 Q A -1.2031
419 C A -1.4475
420 G A -0.7488
421 R A 0.0000
422 G A -1.2717
423 Y A -1.5767
424 T A -1.1707
425 G A -1.3367
426 P A -0.7113
427 R A -1.1218
428 C A 0.0000
429 E A -2.9329
430 T A -2.1868
431 D A -2.5150
432 V A -1.7851
433 N A -1.7530
434 E A -0.7272
435 C A 0.3883
436 L A 0.8029
437 S A -0.0361
438 G A -0.2834
439 P A -0.6729
440 C A -0.3925
441 R A -1.0692
442 N A -1.8910
443 Q A -1.5472
444 A A -0.0216
445 T A 1.0625
446 C A 1.1836
447 L A 1.2167
448 D A -0.7964
449 R A -1.3336
450 I A -0.6661
451 G A 0.0000
452 Q A 0.0000
453 F A 0.0000
454 T A 1.0645
455 C A 0.0000
456 I A 2.7368
457 C A 1.3756
458 M A 1.6248
459 A A 0.3611
460 G A 0.1616
461 F A 1.6322
462 T A -0.0148
463 G A -0.3290
464 T A -0.1557
465 Y A 0.5911
466 C A 0.0000
467 E A -1.3738
468 V A -0.1943
469 D A -1.1886
470 I A -1.0491
471 D A -2.6943
472 E A -2.2339
473 C A 0.0000
474 Q A -2.4396
475 S A -1.3092
476 S A -0.8221
477 P A -0.2450
478 C A 0.2089
479 V A 1.2992
480 N A 0.0345
481 G A -0.4422
482 G A -0.8133
483 V A 0.0000
484 C A -1.1071
485 K A -2.3662
486 D A -2.4481
487 R A -2.0359
488 V A -0.1313
489 N A -1.4197
490 G A -1.3815
491 F A 0.0000
492 S A -1.2265
493 C A -0.4310
494 T A -0.1547
495 C A 0.2356
496 P A -0.1730
497 S A -0.8724
498 G A -1.0819
499 F A -0.7239
500 S A -0.7303
501 G A -0.6708
502 S A -0.5186
503 T A -0.6606
504 C A 0.0000
505 Q A -1.0698
506 L A -0.3437
507 D A -1.3790
508 V A -0.8610
509 D A -1.6984
510 E A -2.2555
511 C A -0.8922
512 A A -0.3235
513 S A -0.4609
514 T A -0.1623
515 P A -0.5187
516 C A -1.0482
517 R A -2.6762
518 N A -2.6913
519 G A -2.0752
520 A A -2.0218
521 K A -2.2213
522 C A -0.7141
523 V A -0.4549
524 D A -1.3778
525 Q A -1.4241
526 P A -1.3679
527 D A -1.8170
528 G A -0.9307
529 Y A 0.0498
530 E A -0.8349
531 C A -0.8884
532 R A -2.3408
533 C A -1.8054
534 A A -1.1387
535 E A -0.9255
536 G A -0.5571
537 F A -0.2291
538 E A -0.9593
539 G A -0.6413
540 T A 0.0979
541 L A 1.2535
542 C A 0.7709
543 D A -0.1745
544 R A -0.7961
545 N A 0.0000
546 V A 0.3611
547 D A -1.3384
548 D A -0.4001
549 C A -0.4253
550 S A -1.0891
551 P A -1.4065
552 D A -2.0658
553 P A -1.3733
554 C A -1.0581
555 H A -1.6784
556 H A -1.6468
557 G A -0.9536
558 R A -0.5247
559 C A 0.0000
560 V A 1.0554
561 D A 0.0000
562 G A 1.0049
563 I A 2.0490
564 A A 1.2280
565 S A 1.1711
566 F A 2.2363
567 S A 0.9161
568 C A 0.8460
569 A A 0.1574
570 C A -0.4955
571 A A -0.5693
572 P A -0.1943
573 G A -0.3149
574 Y A -0.5839
575 T A -1.1339
576 G A -1.3309
577 T A -1.7776
578 R A -2.1953
579 C A -0.9323
580 E A -1.6863
581 S A -1.1331
582 Q A -0.9359
583 V A 0.1884
584 D A -1.1104
585 E A -1.0852
586 C A 0.0000
587 R A -2.0873
588 S A -1.7540
589 Q A -1.7668
590 P A -1.7251
591 C A -1.9314
592 R A -2.0443
593 H A -1.9780
594 G A -1.4696
595 G A -1.3572
596 K A -1.0226
597 C A -0.1115
598 L A 0.9880
599 D A 0.0382
600 L A 1.3819
601 V A 1.0229
602 D A -1.3096
603 K A -1.1059
604 Y A -0.4260
605 L A 0.0000
606 C A 0.0000
607 R A -1.6423
608 C A -1.7080
609 P A -1.3226
610 S A -0.7235
611 G A -0.4026
612 T A -0.3812
613 T A -0.9695
614 G A -0.8681
615 V A -0.2282
616 N A -1.4201
617 C A 0.0000
618 E A -2.0818
619 V A -0.2718
620 N A -0.1526
621 I A 0.9714
622 D A -0.7480
623 D A -1.7015
624 C A -0.9431
625 A A -0.5033
626 S A -0.3947
627 N A 0.0051
628 P A 0.3171
629 C A 0.7394
630 T A 0.7324
631 F A 1.7202
632 G A 1.0262
633 V A 0.6524
634 C A -0.4912
635 R A -1.8145
636 D A -1.5580
637 G A -0.7374
638 I A 0.5813
639 N A -0.9852
640 R A -1.6905
641 Y A -0.7414
642 D A 0.0000
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2263 L A 1.0661
2264 S A 0.1712
2265 D A -0.1481
2266 W A 0.3464
2267 S A -0.6917
2268 E A -1.7371
2269 S A -1.3282
2270 T A -1.1262
2271 P A -0.7720
2272 S A -0.9962
2273 P A -0.6814
2274 A A -0.4431
2275 T A -0.4616
2276 A A -0.2577
2277 T A -0.2208
2278 G A -0.4277
2279 A A -0.2870
2280 M A -0.2635
2281 A A -0.2458
2282 T A -0.4143
2283 T A -0.6048
2284 T A -0.5855
2285 G A -0.1678
2286 A A 0.2429
2287 L A 0.8019
2288 P A 0.2377
2289 A A 0.0000
2290 Q A -0.5385
2291 P A 0.0000
2292 L A 0.8612
2293 P A 0.6734
2294 L A 0.7324
2295 S A 0.0024
2296 V A 0.0000
2297 P A 0.0000
2298 S A 0.0000
2299 S A 0.0000
2300 L A -0.4681
2301 A A -0.4882
2302 Q A -0.4385
2303 A A -0.1559
2304 Q A -0.4942
2305 T A -0.7636
2306 Q A -1.2032
2307 L A -0.5364
2308 G A -0.6581
2309 P A -1.0730
2310 Q A -1.4146
2311 P A -1.1042
2312 E A -1.2536
2313 V A 0.3198
2314 T A -0.7584
2315 P A -1.6204
2316 K A -3.1069
2317 R A -3.2787
2318 Q A -2.5390
2319 V A 0.1781
2320 L A 1.2130
2321 A A 0.6124
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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, -0.5403 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_6 -0.5403 View CSV PDB
model_2 -0.5605 View CSV PDB
model_1 -0.5689 View CSV PDB
model_4 -0.575 View CSV PDB
model_9 -0.5763 View CSV PDB
model_8 -0.5774 View CSV PDB
model_0 -0.5823 View CSV PDB
model_7 -0.5873 View CSV PDB
CABS_average -0.5937 View CSV PDB
model_3 -0.6038 View CSV PDB
model_10 -0.6116 View CSV PDB
model_5 -0.6479 View CSV PDB
model_11 -0.6934 View CSV PDB
input -0.7619 View CSV PDB