Project name: P572L_4D

Status: done

Started: 2026-05-15 06:35:54
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACALGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:17:23)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (16:28:08)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (16:29:11)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (16:30:15)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (16:31:21)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (16:32:23)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (16:33:28)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (16:34:35)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (16:35:40)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (16:36:43)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (16:37:49)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (16:38:47)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (16:39:45)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (16:40:44)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (16:42:40)
[INFO]       Main:     Simulation completed successfully.                                          (16:43:37)
Show buried residues

Minimal score value
-3.7032
Maximal score value
4.2883
Average score
-0.5857
Total score value
-1359.4257

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 1.0830
2 G A -0.1580
3 P A -0.7008
4 G A -0.8514
5 A A -0.6578
6 R A -1.8701
7 G A -1.6496
8 R A -1.7730
9 R A -2.9447
10 R A -2.3629
11 R A -2.9907
12 R A -3.5991
13 R A -2.9513
14 P A -1.3126
15 M A -0.0634
16 S A -0.6736
17 P A -0.9233
18 P A -1.0611
19 P A -0.7695
20 P A -0.9612
21 P A -0.8300
22 P A -0.8240
23 P A -0.3147
24 V A -0.2780
25 R A -1.6984
26 A A 0.0000
27 L A -0.9394
28 P A -0.8659
29 L A 0.0000
30 L A 0.6655
31 L A 0.0000
32 L A 1.5995
33 L A 1.1925
34 A A 0.0889
35 G A -0.3836
36 P A -0.5464
37 G A -0.2265
38 A A 0.3002
39 A A 0.5666
40 A A 0.0543
41 P A -0.3322
42 P A -1.5862
43 C A 0.0000
44 L A -1.7683
45 D A -2.1869
46 G A -1.5520
47 S A -1.3077
48 P A -1.2006
49 C A 0.0000
50 A A -0.9779
51 N A -1.5096
52 G A -1.5640
53 G A -1.8814
54 R A -2.3307
55 C A -1.3231
56 T A -1.0086
57 Q A -1.3405
58 L A -0.1246
59 P A -0.7965
60 S A -1.3784
61 R A -2.5170
62 E A -2.5089
63 A A -1.9178
64 A A 0.0000
65 C A 0.0000
66 L A -1.3695
67 C A 0.0000
68 P A -1.0998
69 P A -1.0555
70 G A -1.3538
71 W A -1.2522
72 V A -0.8260
73 G A -1.2190
74 E A -1.9923
75 R A -1.7135
76 C A 0.0000
77 Q A -1.3525
78 L A 0.0000
79 E A -1.9425
80 D A -2.5021
81 P A -1.4972
82 C A -1.0180
83 H A -1.5656
84 S A -1.0570
85 G A -0.9299
86 P A -0.5961
87 C A 0.1377
88 A A -0.1897
89 G A -0.6842
90 R A -1.2180
91 G A -0.8382
92 V A -0.4146
93 C A -0.0752
94 Q A -0.5347
95 S A -0.2377
96 S A 0.0876
97 V A 0.4489
98 V A 0.8037
99 A A 0.3194
100 G A -0.5593
101 T A -0.6225
102 A A 0.0000
103 R A -1.6160
104 F A -0.9299
105 S A -1.0440
106 C A 0.0000
107 R A -1.6858
108 C A 0.0000
109 P A -0.5485
110 R A -0.8096
111 G A -0.2183
112 F A 0.3631
113 R A 0.0000
114 G A -0.8115
115 P A -1.0906
116 D A -1.7937
117 C A -0.4303
118 S A -0.0224
119 L A 0.7147
120 P A 0.2873
121 D A 0.0000
122 P A 0.5237
123 C A 0.5243
124 L A 0.8059
125 S A -0.2882
126 S A -0.3982
127 P A -0.5191
128 C A 0.0000
129 A A -1.0262
130 H A -1.6436
131 G A -1.4269
132 A A -1.5022
133 R A -1.7511
134 C A 0.0000
135 S A 0.0000
136 V A 0.6452
137 G A 0.0000
138 P A -0.9850
139 D A -2.0670
140 G A -1.4408
141 R A -1.4206
142 F A 1.2267
143 L A 0.8997
144 C A 0.4856
145 S A -0.4436
146 C A -1.1548
147 P A -0.9122
148 P A -0.8000
149 G A -1.5174
150 Y A -1.6770
151 Q A -2.2265
152 G A -2.3358
153 R A -2.9438
154 S A -1.4174
155 C A -0.6806
156 R A -2.1571
157 S A -2.0782
158 D A -2.5149
159 V A -0.8781
160 D A -1.1291
161 E A -1.6229
162 C A -0.7596
163 R A -1.0618
164 V A 0.2783
165 G A -0.7009
166 E A -1.8915
167 P A -1.3576
168 C A -1.6650
169 R A -2.3007
170 H A -1.9317
171 G A -1.3297
172 G A -0.9406
173 T A -0.6923
174 C A -0.2581
175 L A 0.5512
176 N A -0.5434
177 T A -0.4281
178 P A -0.3169
179 G A -0.9566
180 S A -0.4349
181 F A -0.2843
182 R A -0.7383
183 C A 0.0000
184 Q A -1.5748
185 C A 0.0000
186 P A -0.7216
187 A A -0.5098
188 G A 0.3144
189 Y A 0.8939
190 T A 0.0000
191 G A -0.2137
192 P A -0.4071
193 L A 0.3945
194 C A 0.0000
195 E A -0.9375
196 N A -0.9532
197 P A 0.1922
198 A A 0.6882
199 V A 1.0900
200 P A -0.1743
201 C A -0.3961
202 A A -0.1248
203 P A -0.4470
204 S A -0.2823
205 P A -0.3789
206 C A 0.0000
207 R A -1.6862
208 N A -0.9640
209 G A -0.3131
210 G A -0.7589
211 T A -0.7059
212 C A -1.2307
213 R A -2.4444
214 Q A -2.1936
215 S A -1.3835
216 G A -1.2878
217 D A -1.2059
218 L A 0.7005
219 T A -0.3649
220 Y A -0.8697
221 D A -1.5735
222 C A -0.7682
223 A A -0.0860
224 C A 0.8106
225 L A 1.5374
226 P A 0.4117
227 G A -0.4480
228 F A -0.6829
229 E A -1.3470
230 G A -1.4106
231 Q A -1.4554
232 N A -1.2464
233 C A -0.5656
234 E A -1.0374
235 V A -0.2148
236 N A 0.0000
237 V A 0.0000
238 D A -0.5731
239 D A -0.8998
240 C A 0.0000
241 P A -0.8232
242 G A -0.9824
243 H A -1.0998
244 R A -1.5718
245 C A -0.2932
246 L A 0.8829
247 N A 0.2740
248 G A -0.2443
249 G A 0.0000
250 T A 0.0000
251 C A 0.4155
252 V A 0.0000
253 D A -0.0196
254 G A 0.4331
255 V A 1.2139
256 N A 0.1176
257 T A 0.2445
258 Y A 0.0000
259 N A 0.0989
260 C A 0.0000
261 Q A -0.2434
262 C A -0.4070
263 P A -0.4410
264 P A -0.8318
265 E A -1.6583
266 W A -1.3861
267 T A -0.8577
268 G A -0.9455
269 Q A -0.2764
270 F A 0.4483
271 C A 0.0000
272 T A -1.0500
273 E A -2.0378
274 D A -2.5980
275 V A -1.4131
276 D A -2.5668
277 E A -1.5987
278 C A -1.0986
279 Q A -1.1501
280 L A -0.7568
281 Q A -1.5521
282 P A -0.9426
283 N A -0.6620
284 A A -0.2183
285 C A 0.3080
286 H A -0.7416
287 N A -1.5179
288 G A -1.0721
289 G A -1.0270
290 T A -0.0262
291 C A 0.5527
292 F A 1.5074
293 N A -0.0620
294 T A 0.4161
295 L A 1.1584
296 G A -0.2204
297 G A -0.1791
298 H A -0.4926
299 S A 0.2438
300 C A 0.9718
301 V A 1.4256
302 C A 1.0977
303 V A 0.7106
304 N A -1.0028
305 G A -1.3346
306 W A 0.0000
307 T A -1.0710
308 G A -1.0269
309 E A 0.0000
310 S A -0.5461
311 C A -0.5245
312 S A -0.8638
313 Q A -1.0837
314 N A 0.0000
315 I A 0.0000
316 D A -0.9214
317 D A -0.7241
318 C A 0.0000
319 A A 0.0000
320 T A -0.2876
321 A A -0.3322
322 V A -0.6638
323 C A 0.0000
324 F A 0.0000
325 H A -1.6247
326 G A -1.1919
327 A A 0.0000
328 T A 0.0000
329 C A 0.0000
330 H A 0.0000
331 D A -0.9054
332 R A -0.3874
333 V A 0.2957
334 A A -0.0587
335 S A -0.3525
336 F A 0.0000
337 Y A 0.0000
338 C A 0.0000
339 A A 0.0000
340 C A 0.0000
341 P A -0.7763
342 M A -0.2904
343 G A -0.7113
344 K A -0.6896
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 -0.9512
351 L A 0.0000
352 D A -1.3619
353 D A -1.5055
354 A A -0.4839
355 C A -0.3754
356 V A -0.5204
357 S A -0.8074
358 N A -1.0352
359 P A -0.7517
360 C A -0.6117
361 H A -1.0433
362 E A -1.9288
363 D A 0.0000
364 A A 0.0000
365 I A 0.0000
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 -0.5136
372 N A -1.4008
373 G A -1.5573
374 R A -1.8070
375 A A -1.1187
376 I A -0.3650
377 C A 0.0000
378 T A -0.2430
379 C A 0.0000
380 P A -0.3392
381 P A 0.0000
382 G A -0.8843
383 F A -0.3315
384 T A -0.5657
385 G A -0.8601
386 G A -0.7647
387 A A -0.8700
388 C A 0.0000
389 D A -2.2662
390 Q A -1.6779
391 D A -1.0908
392 V A -0.6837
393 D A -1.8235
394 E A 0.0000
395 C A 0.0000
396 S A 0.0000
397 I A 0.2624
398 G A -0.2598
399 A A -0.3707
400 N A -0.8429
401 P A -0.8152
402 C A -1.0045
403 E A -0.8958
404 H A -0.8677
405 L A 0.0000
406 G A -1.1350
407 R A -1.5778
408 C A 0.0000
409 V A 0.0000
410 N A 0.0000
411 T A 0.0000
412 Q A -1.4713
413 G A 0.0000
414 S A 0.0000
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 -0.5931
421 R A 0.0000
422 G A -1.3125
423 Y A 0.0000
424 T A -0.9032
425 G A 0.0000
426 P A -1.2498
427 R A -2.2901
428 C A -1.7216
429 E A -1.6412
430 T A 0.0000
431 D A -0.8171
432 V A -0.7966
433 N A -2.0254
434 E A -2.1218
435 C A -0.2256
436 L A 0.6505
437 S A 0.0687
438 G A -0.4095
439 P A -0.7137
440 C A -1.2848
441 R A -2.5619
442 N A -2.3868
443 Q A -1.8844
444 A A -0.7032
445 T A 0.1998
446 C A 0.7242
447 L A 0.6782
448 D A 0.0000
449 R A -0.8635
450 I A 0.0000
451 G A -1.3709
452 Q A -1.5171
453 F A 0.0000
454 T A 0.1924
455 C A 0.0000
456 I A 0.9170
457 C A 0.0000
458 M A 0.8908
459 A A 0.1979
460 G A -0.3214
461 F A 0.5434
462 T A -0.1730
463 G A 0.2144
464 T A 0.0484
465 Y A 0.5743
466 C A 0.0000
467 E A -1.2876
468 V A -0.8438
469 D A -1.3816
470 I A -0.8093
471 D A -2.7265
472 E A -2.1722
473 C A -1.6841
474 Q A -2.0080
475 S A -1.1490
476 S A -0.8616
477 P A -0.8197
478 C A -0.0302
479 V A -0.4636
480 N A -1.4381
481 G A -1.1129
482 G A 0.2438
483 V A 1.0531
484 C A -0.3567
485 K A -2.2436
486 D A -2.5542
487 R A -2.2098
488 V A -0.6462
489 N A -1.1531
490 G A -1.1251
491 F A -1.0163
492 S A -0.9477
493 C A -0.4843
494 T A 0.2461
495 C A 0.0000
496 P A -0.2672
497 S A -0.7904
498 G A -0.9498
499 F A -0.1435
500 S A -0.7029
501 G A -0.6112
502 S A -0.4158
503 T A -0.2416
504 C A 0.0000
505 Q A -0.8953
506 L A -0.8362
507 D A -1.6385
508 V A -1.2695
509 D A -2.3771
510 E A -2.4729
511 C A -1.2652
512 A A -0.8297
513 S A -0.7832
514 T A -0.8164
515 P A -0.5600
516 C A -0.5079
517 R A -2.3813
518 N A -2.5828
519 G A -2.0384
520 A A -1.7978
521 K A -1.4710
522 C A -1.0076
523 V A -0.6877
524 D A -2.0992
525 Q A -2.5627
526 P A -2.3912
527 D A -2.9925
528 G A -2.3221
529 Y A -2.0537
530 E A -1.9470
531 C A -0.6321
532 R A -0.7282
533 C A -1.3254
534 A A -1.5370
535 E A -1.8035
536 G A -1.4098
537 F A -0.2641
538 E A -1.7358
539 G A -0.6443
540 T A 0.3968
541 L A 1.0767
542 C A -0.2817
543 D A -1.9343
544 R A -2.9819
545 N A -2.6433
546 V A -1.4620
547 D A -2.0049
548 D A -1.2850
549 C A -0.5382
550 S A -1.1578
551 P A -1.7035
552 D A -2.4434
553 P A -1.8273
554 C A -2.1768
555 H A -2.3963
556 H A -2.2064
557 G A -1.9697
558 R A -1.6249
559 C A 0.1282
560 V A 1.0210
561 D A -0.3786
562 G A 0.2874
563 I A 1.6449
564 A A 0.4844
565 S A 0.0219
566 F A 0.5332
567 S A 0.0270
568 C A -0.9566
569 A A -1.1345
570 C A 0.0000
571 A A -0.9628
572 L A -0.0310
573 G A -0.2054
574 Y A 0.1652
575 T A -0.4966
576 G A -0.9935
577 T A -1.3249
578 R A -2.0440
579 C A -1.7882
580 E A -1.6460
581 S A -1.0845
582 Q A -1.4579
583 V A -1.1410
584 D A -2.8421
585 E A -2.8112
586 C A -0.7903
587 R A -1.7779
588 S A -1.5625
589 Q A -1.0712
590 P A -0.7668
591 C A -0.8301
592 R A -1.4730
593 H A -1.5956
594 G A -1.4229
595 G A -2.0643
596 K A -2.3410
597 C A -0.8630
598 L A -0.5187
599 D A -1.0917
600 L A 0.4357
601 V A 0.0469
602 D A -1.9672
603 K A -1.8907
604 Y A 0.0000
605 L A -0.5183
606 C A 0.0000
607 R A -2.8038
608 C A -1.6855
609 P A -1.6618
610 S A -0.7779
611 G A -0.9347
612 T A -1.3094
613 T A 0.0000
614 G A -1.0470
615 V A -0.7434
616 N A -1.3251
617 C A -0.2780
618 E A -0.8854
619 V A 0.7087
620 N A 0.2887
621 I A 1.1425
622 D A -1.0682
623 D A -1.0220
624 C A -0.6292
625 A A -0.3004
626 S A -0.7303
627 N A -1.0418
628 P A -0.1986
629 C A 0.7529
630 T A 0.9653
631 F A 2.4944
632 G A 1.5655
633 V A 1.4701
634 C A -0.2012
635 R A -1.8298
636 D A -2.1355
637 G A -1.4001
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2259 S A -0.5469
2260 P A -0.2882
2261 P A -0.3035
2262 S A 0.0105
2263 L A 0.7116
2264 S A -0.4965
2265 D A -1.6204
2266 W A -1.0130
2267 S A -0.9404
2268 E A -1.1079
2269 S A -0.5881
2270 T A -0.2519
2271 P A -0.2293
2272 S A 0.0000
2273 P A -0.5133
2274 A A -0.5993
2275 T A -0.3069
2276 A A -0.2149
2277 T A -0.2502
2278 G A -0.8160
2279 A A 0.0000
2280 M A 0.0000
2281 A A -0.4396
2282 T A 0.0000
2283 T A -0.3477
2284 T A -0.4849
2285 G A -1.0744
2286 A A -1.0654
2287 L A -0.6325
2288 P A -0.4318
2289 A A -0.4407
2290 Q A -1.1923
2291 P A -1.0849
2292 L A 0.0000
2293 P A -0.5533
2294 L A 0.0000
2295 S A -0.3760
2296 V A -0.0596
2297 P A -0.2192
2298 S A -0.2797
2299 S A -0.2123
2300 L A -0.0411
2301 A A -0.1181
2302 Q A -0.5311
2303 A A -0.3312
2304 Q A -1.3098
2305 T A -1.4490
2306 Q A -1.3184
2307 L A -0.8061
2308 G A 0.0000
2309 P A -1.1946
2310 Q A -1.8148
2311 P A -1.7534
2312 E A -2.2134
2313 V A -1.6226
2314 T A -1.2864
2315 P A -1.5711
2316 K A -2.7800
2317 R A -2.7724
2318 Q A -1.9297
2319 V A -0.5046
2320 L A -0.6799
2321 A A 0.0000
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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, -0.5857 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_0 -0.5857 View CSV PDB
model_1 -0.5991 View CSV PDB
model_5 -0.6019 View CSV PDB
model_2 -0.604 View CSV PDB
model_11 -0.6308 View CSV PDB
model_10 -0.6411 View CSV PDB
CABS_average -0.6421 View CSV PDB
model_4 -0.6441 View CSV PDB
model_3 -0.6489 View CSV PDB
model_9 -0.6575 View CSV PDB
model_6 -0.6706 View CSV PDB
model_7 -0.7089 View CSV PDB
model_8 -0.7127 View CSV PDB
input -0.748 View CSV PDB