Project name: Wild-type

Status: done

Started: 2026-05-11 07:34:12
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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]                                                (00:00:13)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:13)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:13)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:13)
[INFO]       FoldX:    Starting FoldX energy minimization                                          (00:00:14)
[INFO]       CABS:     Running CABS flex simulation                                                (00:17:36)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (13:59:33)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (14:00:23)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (14:01:12)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (14:01:58)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (14:02:44)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (14:03:30)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (14:04:16)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (14:05:02)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (14:05:47)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (14:06:33)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (14:07:18)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (14:08:04)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (14:08:49)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (14:10:20)
[INFO]       Main:     Simulation completed successfully.                                          (14:11:05)
Show buried residues

Minimal score value
-4.3574
Maximal score value
6.5698
Average score
-0.5368
Total score value
-1245.8186

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 -0.0605
2 G A -0.6429
3 P A -1.0678
4 G A -1.2586
5 A A -1.3540
6 R A -2.5667
7 G A -2.4360
8 R A -3.0951
9 R A -4.3574
10 R A -4.1792
11 R A -3.5549
12 R A -2.6663
13 R A 0.0000
14 P A -0.2892
15 M A 0.0000
16 S A -0.2156
17 P A 0.0000
18 P A -0.5836
19 P A -0.7732
20 P A -0.5525
21 P A -0.7468
22 P A 0.0000
23 P A 0.0000
24 V A -2.2731
25 R A -3.3172
26 A A -1.2675
27 L A 0.2118
28 P A 0.8721
29 L A 1.9491
30 L A 2.2789
31 L A 1.7219
32 L A 0.0000
33 L A 1.0181
34 A A 0.2988
35 G A -0.1980
36 P A -0.4611
37 G A -0.0311
38 A A 0.1250
39 A A 0.1473
40 A A -0.2924
41 P A -0.6247
42 P A -0.7176
43 C A 0.0000
44 L A -0.5031
45 D A -1.6558
46 G A -1.5376
47 S A -0.7484
48 P A -0.6918
49 C A -0.8451
50 A A -1.1244
51 N A -1.7988
52 G A -1.5217
53 G A -1.4655
54 R A -1.9240
55 C A -0.7073
56 T A -1.0761
57 Q A -1.8401
58 L A -1.3019
59 P A -1.4790
60 S A -1.2638
61 R A -2.3265
62 E A -2.6123
63 A A -1.7374
64 A A 0.0000
65 C A -1.1509
66 L A 0.0000
67 C A 0.0000
68 P A -1.2216
69 P A -1.2102
70 G A -1.5124
71 W A -1.6991
72 V A 0.0000
73 G A -1.6716
74 E A -1.6840
75 R A 0.0000
76 C A 0.0000
77 Q A -1.1100
78 L A 0.0000
79 E A -3.0288
80 D A -3.1717
81 P A 0.0000
82 C A -1.6373
83 H A -2.0048
84 S A -1.4907
85 G A -0.8477
86 P A -0.2561
87 C A -0.3237
88 A A -0.3946
89 G A -1.3096
90 R A -2.3056
91 G A -1.5173
92 V A -0.7613
93 C A -1.2360
94 Q A -1.8212
95 S A -1.4871
96 S A -1.2182
97 V A -0.0624
98 V A 1.2167
99 A A 0.2877
100 G A -0.3212
101 T A -0.0971
102 A A -1.0404
103 R A -1.7224
104 F A -1.5262
105 S A -1.3388
106 C A 0.0000
107 R A -2.7012
108 C A -1.9912
109 P A -1.7990
110 R A -2.2284
111 G A -1.1481
112 F A -1.3538
113 R A -2.5326
114 G A 0.0000
115 P A -1.3689
116 D A -1.1574
117 C A -0.3080
118 S A -0.3808
119 L A 0.0000
120 P A -0.7635
121 D A -1.4379
122 P A -1.1732
123 C A -0.4127
124 L A 0.9153
125 S A 0.6426
126 S A 0.5009
127 P A -0.2974
128 C A -0.6114
129 A A -0.9356
130 H A -1.2195
131 G A -1.0578
132 A A -1.1083
133 R A -1.4908
134 C A 0.3033
135 S A 0.7234
136 V A 0.9229
137 G A -0.0446
138 P A -1.2358
139 D A -2.4801
140 G A -1.8469
141 R A -1.2176
142 F A 1.4394
143 L A 2.0040
144 C A 0.8544
145 S A 0.1575
146 C A -0.1082
147 P A -0.4060
148 P A -0.4556
149 G A -0.0766
150 Y A 0.3714
151 Q A -1.0221
152 G A -1.5963
153 R A -2.4862
154 S A -1.4078
155 C A -1.0671
156 R A -2.2620
157 S A -1.0226
158 D A -0.8137
159 V A 0.0272
160 D A -1.0756
161 E A -1.9484
162 C A 0.0000
163 R A -2.2518
164 V A -0.1937
165 G A -1.3807
166 E A -2.5898
167 P A -1.9960
168 C A 0.0000
169 R A -2.9787
170 H A -2.5329
171 G A -1.9108
172 G A -1.7810
173 T A 0.0000
174 C A -1.4723
175 L A -0.8910
176 N A -1.5715
177 T A -1.0674
178 P A -1.0124
179 G A -1.2447
180 S A -1.0825
181 F A -1.5951
182 R A -2.2823
183 C A -1.9705
184 Q A -1.8084
185 C A 0.0000
186 P A -0.4072
187 A A -0.3106
188 G A 0.0000
189 Y A -0.0451
190 T A -0.6824
191 G A -0.6918
192 P A -0.6665
193 L A -1.0173
194 C A 0.0000
195 E A -2.4667
196 N A -1.6199
197 P A -0.8458
198 A A -0.4243
199 V A 0.2187
200 P A 0.4412
201 C A 0.8361
202 A A 0.4558
203 P A -0.0616
204 S A -0.2053
205 P A -0.5250
206 C A -0.6054
207 R A -0.7736
208 N A 0.0000
209 G A -0.2285
210 G A -0.4035
211 T A -0.7102
212 C A -1.2020
213 R A -2.5423
214 Q A -2.3341
215 S A -1.7213
216 G A -1.2997
217 D A -1.5882
218 L A -0.1467
219 T A -0.5908
220 Y A -1.1044
221 D A -2.3286
222 C A -1.3878
223 A A 0.0000
224 C A 0.0000
225 L A 1.3552
226 P A 0.7700
227 G A 0.9000
228 F A 1.6268
229 E A -0.3032
230 G A -0.8029
231 Q A -1.2179
232 N A -2.2450
233 C A -1.3056
234 E A 0.0000
235 V A 0.0000
236 N A 0.0000
237 V A 1.0317
238 D A -0.4439
239 D A -1.8191
240 C A -1.3761
241 P A -1.6828
242 G A -1.7124
243 H A -2.0695
244 R A -2.3937
245 C A -1.2092
246 L A -1.2392
247 N A -1.6293
248 G A -1.0944
249 G A -0.9662
250 T A -0.5096
251 C A -0.4016
252 V A 0.0000
253 D A -0.1118
254 G A 0.5656
255 V A 0.6339
256 N A -0.3449
257 T A -0.2242
258 Y A 0.1861
259 N A 0.5285
260 C A 0.0000
261 Q A 0.0000
262 C A 0.0000
263 P A 0.0000
264 P A -1.1040
265 E A -0.8968
266 W A -0.8563
267 T A -0.6111
268 G A -0.2350
269 Q A -0.6517
270 F A 0.7548
271 C A 0.0000
272 T A -1.2270
273 E A -1.3914
274 D A 0.0000
275 V A 0.8232
276 D A 0.0000
277 E A -0.4918
278 C A 0.0000
279 Q A -0.5949
280 L A -0.4901
281 Q A 0.0000
282 P A -0.3738
283 N A 0.0000
284 A A 0.0000
285 C A 0.0000
286 H A -0.5576
287 N A -0.8987
288 G A -0.6234
289 G A 0.3974
290 T A 0.9876
291 C A 1.0908
292 F A 1.9030
293 N A 0.8419
294 T A 0.9893
295 L A 1.4749
296 G A 0.2730
297 G A 0.0572
298 H A 0.3631
299 S A 0.7918
300 C A 1.6682
301 V A 2.5638
302 C A 1.6365
303 V A 2.4407
304 N A 0.9635
305 G A 0.5058
306 W A 0.8493
307 T A -0.5359
308 G A -1.2495
309 E A -1.8923
310 S A -1.3299
311 C A 0.0000
312 S A -0.6875
313 Q A 0.0000
314 N A -1.1188
315 I A -0.3288
316 D A -1.7855
317 D A -1.6037
318 C A -0.7375
319 A A -0.1603
320 T A 0.6550
321 A A 1.8617
322 V A 2.3259
323 C A 2.0793
324 F A 2.0809
325 H A -0.0252
326 G A -0.3556
327 A A 0.3001
328 T A -0.0590
329 C A 0.0015
330 H A -1.5188
331 D A -2.3522
332 R A -1.8666
333 V A 0.4516
334 A A 0.0943
335 S A -0.5747
336 F A -0.0526
337 Y A 1.1519
338 C A 0.0000
339 A A 0.9539
340 C A 0.0000
341 P A -0.0958
342 M A 0.0921
343 G A -0.5206
344 K A -0.5845
345 T A -0.0957
346 G A 1.3809
347 L A 2.8970
348 L A 2.3957
349 C A 0.0000
350 H A 0.4658
351 L A 0.0000
352 D A -1.4721
353 D A -1.5450
354 A A -0.9854
355 C A 0.1123
356 V A 0.1264
357 S A -0.3992
358 N A -1.2009
359 P A -0.9535
360 C A -0.1870
361 H A -1.1076
362 E A -1.5079
363 D A -1.4014
364 A A -0.2418
365 I A 1.5440
366 C A 1.3167
367 D A 0.0000
368 T A -0.7377
369 N A -1.6116
370 P A -0.9588
371 V A 0.7127
372 N A -1.2744
373 G A -1.7870
374 R A -2.1650
375 A A -0.8730
376 I A 0.0177
377 C A 0.0000
378 T A 0.5808
379 C A 0.0000
380 P A 0.3118
381 P A -0.4084
382 G A 0.0000
383 F A 0.9951
384 T A 0.1918
385 G A -0.8143
386 G A -1.3475
387 A A 0.0000
388 C A 0.0000
389 D A -1.1826
390 Q A -1.2264
391 D A -1.0141
392 V A 0.0000
393 D A -2.3095
394 E A -1.1401
395 C A 0.4991
396 S A 0.6852
397 I A 1.8196
398 G A 0.3333
399 A A 0.2795
400 N A -0.4226
401 P A -0.4830
402 C A -0.5513
403 E A -0.9133
404 H A 0.0000
405 L A 0.3125
406 G A -0.2544
407 R A -1.6839
408 C A -0.1956
409 V A 0.0000
410 N A 0.0000
411 T A -0.7411
412 Q A -1.7556
413 G A -1.3899
414 S A -0.8555
415 F A 0.0000
416 L A 0.0000
417 C A 0.0000
418 Q A 0.0000
419 C A 0.0000
420 G A 0.0000
421 R A -0.5418
422 G A -1.1728
423 Y A 0.0000
424 T A -1.4618
425 G A -1.5945
426 P A -1.3511
427 R A -1.8594
428 C A 0.0000
429 E A -1.8246
430 T A -1.5909
431 D A -2.0187
432 V A 0.0000
433 N A -0.5289
434 E A 0.0000
435 C A 0.0000
436 L A 1.2870
437 S A 0.4614
438 G A 0.0000
439 P A -0.6585
440 C A 0.0000
441 R A -2.6924
442 N A -2.5068
443 Q A -1.6752
444 A A -0.5252
445 T A 0.5423
446 C A 1.1192
447 L A 1.1414
448 D A 0.0000
449 R A 0.0000
450 I A 0.0000
451 G A 0.0000
452 Q A 0.0000
453 F A 0.0000
454 T A 0.0000
455 C A 0.0000
456 I A 1.4477
457 C A 0.0000
458 M A 1.1187
459 A A 0.3674
460 G A -0.0659
461 F A 1.3628
462 T A 0.1865
463 G A -0.3447
464 T A -0.4048
465 Y A 0.0000
466 C A 0.0000
467 E A -1.3774
468 V A -0.8901
469 D A -1.6392
470 I A -1.4651
471 D A -2.7966
472 E A -2.5305
473 C A -1.1942
474 Q A -1.3593
475 S A -0.3813
476 S A -0.3986
477 P A -0.5120
478 C A -0.1509
479 V A -0.1083
480 N A -1.0711
481 G A -1.0330
482 G A -1.0011
483 V A -0.6237
484 C A -0.8143
485 K A -1.8223
486 D A -2.1871
487 R A -2.2877
488 V A -0.8321
489 N A -1.6076
490 G A -1.0881
491 F A -0.1387
492 S A -0.4643
493 C A 0.0000
494 T A -0.0957
495 C A -0.1561
496 P A -0.2375
497 S A -0.5989
498 G A -0.8651
499 F A -0.1138
500 S A -0.6988
501 G A -0.9877
502 S A -0.6626
503 T A 0.0611
504 C A 0.0000
505 Q A -1.5186
506 L A -1.2508
507 D A -2.2554
508 V A -1.7852
509 D A -2.4474
510 E A -1.6758
511 C A 0.0000
512 A A -0.8823
513 S A -0.6802
514 T A -0.6708
515 P A -1.1078
516 C A -1.8419
517 R A -3.0826
518 N A -3.2611
519 G A -2.6876
520 A A 0.0000
521 K A -2.6457
522 C A -1.3967
523 V A -0.9265
524 D A -1.6220
525 Q A -1.8122
526 P A -2.2054
527 D A -2.8510
528 G A -1.4823
529 Y A -0.6609
530 E A -1.6225
531 C A -1.3886
532 R A -1.8886
533 C A -0.9634
534 A A -1.5006
535 E A -2.4241
536 G A -1.5327
537 F A 0.0598
538 E A -1.6981
539 G A -0.8864
540 T A 0.1960
541 L A 1.1698
542 C A -0.0948
543 D A -1.6583
544 R A -3.0371
545 N A -2.4571
546 V A -1.6186
547 D A -2.8234
548 D A -2.8793
549 C A 0.0000
550 S A -1.5162
551 P A -1.8257
552 D A -2.7224
553 P A -2.1610
554 C A -1.7468
555 H A -1.6319
556 H A -1.8419
557 G A -1.6293
558 R A -2.1189
559 C A -1.0686
560 V A -0.1290
561 D A -1.1274
562 G A 0.1291
563 I A 1.3864
564 A A 0.6958
565 S A 0.2794
566 F A 0.3066
567 S A -0.5115
568 C A 0.0000
569 A A -1.5156
570 C A 0.0000
571 A A -1.0962
572 P A -0.6652
573 G A -0.9688
574 Y A -1.5867
575 T A -1.2598
576 G A -1.5802
577 T A -1.6755
578 R A -3.1327
579 C A 0.0000
580 E A -3.2262
581 S A -1.9139
582 Q A -1.5612
583 V A -0.3773
584 D A -2.6600
585 E A -3.3162
586 C A -2.1434
587 R A -2.8356
588 S A -2.5532
589 Q A -2.5259
590 P A -1.7828
591 C A -1.8930
592 R A -2.0066
593 H A -2.1811
594 G A -1.7373
595 G A -2.0989
596 K A -2.4193
597 C A -1.2612
598 L A -0.6177
599 D A -1.0607
600 L A 0.6740
601 V A 0.7963
602 D A -1.7705
603 K A -1.7093
604 Y A 0.0000
605 L A -0.0347
606 C A -1.2274
607 R A -2.1035
608 C A -1.7803
609 P A -1.4510
610 S A -1.1534
611 G A -0.7334
612 T A -0.4553
613 T A -0.3600
614 G A -0.0811
615 V A 0.2777
616 N A -1.7266
617 C A 0.0000
618 E A -1.6714
619 V A -0.2231
620 N A -0.1183
621 I A 0.8421
622 D A 0.0000
623 D A -2.3850
624 C A -1.2211
625 A A -0.5448
626 S A -1.0624
627 N A -1.3478
628 P A -0.2700
629 C A 0.7080
630 T A 0.9217
631 F A 1.5417
632 G A 0.9905
633 V A 1.4749
634 C A -0.1567
635 R A -1.5820
636 D A -1.3028
637 G A 0.0000
638 I A 0.1196
639 N A -1.9194
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2260 P A -0.6032
2261 P A -0.6656
2262 S A -0.6160
2263 L A -0.4064
2264 S A -0.5497
2265 D A -1.5158
2266 W A 0.2011
2267 S A -0.7014
2268 E A -0.6957
2269 S A -0.9016
2270 T A -0.6171
2271 P A -0.2933
2272 S A -0.4490
2273 P A -0.7817
2274 A A -0.1439
2275 T A -0.2316
2276 A A 0.0000
2277 T A 0.0000
2278 G A 0.0000
2279 A A 0.0000
2280 M A -0.2241
2281 A A -0.1336
2282 T A -0.1774
2283 T A -0.2624
2284 T A -0.2500
2285 G A -0.2990
2286 A A 0.5340
2287 L A 1.5763
2288 P A 0.0000
2289 A A -0.0432
2290 Q A -1.3756
2291 P A -1.1280
2292 L A 0.0000
2293 P A -0.4945
2294 L A -0.6974
2295 S A -0.7837
2296 V A 0.1775
2297 P A -0.1698
2298 S A 0.3041
2299 S A 0.0370
2300 L A 0.1239
2301 A A 0.0839
2302 Q A 0.0434
2303 A A -0.2475
2304 Q A -0.5060
2305 T A -0.6161
2306 Q A -0.6592
2307 L A 0.2809
2308 G A -0.6661
2309 P A -0.7951
2310 Q A -1.3892
2311 P A -0.9178
2312 E A -0.8565
2313 V A -0.9559
2314 T A -1.4784
2315 P A -1.5826
2316 K A -2.1457
2317 R A -1.8557
2318 Q A -1.3713
2319 V A -0.1036
2320 L A 1.0612
2321 A A 0.2232
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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, -0.5368 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 -0.5368 View CSV PDB
model_2 -0.5553 View CSV PDB
model_5 -0.5592 View CSV PDB
model_9 -0.561 View CSV PDB
model_3 -0.5614 View CSV PDB
model_4 -0.5661 View CSV PDB
model_0 -0.5682 View CSV PDB
model_6 -0.5741 View CSV PDB
CABS_average -0.5803 View CSV PDB
model_8 -0.6035 View CSV PDB
model_7 -0.6097 View CSV PDB
model_10 -0.6174 View CSV PDB
model_11 -0.6513 View CSV PDB
input -0.7537 View CSV PDB