Project name: C311Y_4D

Status: done

Started: 2026-05-12 07:14:46
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESYSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:18:25)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (12:46:52)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (12:47:33)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (12:48:14)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (12:48:56)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (12:49:38)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (12:50:20)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (12:51:02)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (12:51:44)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (12:52:26)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (12:53:08)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (12:53:49)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (12:54:31)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (12:55:14)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (12:56:36)
[INFO]       Main:     Simulation completed successfully.                                          (12:57:17)
Show buried residues

Minimal score value
-3.9499
Maximal score value
3.9518
Average score
-0.6129
Total score value
-1422.5969

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 0.9083
2 G A 0.0895
3 P A 0.4065
4 G A -0.4852
5 A A -0.9300
6 R A -2.7759
7 G A -1.9497
8 R A -2.3920
9 R A -2.9704
10 R A -3.1058
11 R A -2.8592
12 R A -2.9562
13 R A -2.4912
14 P A -2.0260
15 M A 0.0000
16 S A -1.4952
17 P A 0.0000
18 P A -0.9350
19 P A -0.9542
20 P A -0.7020
21 P A -0.5736
22 P A -0.7052
23 P A -0.7022
24 V A -0.8618
25 R A -1.7330
26 A A -0.4145
27 L A 1.0139
28 P A 0.7508
29 L A 0.8441
30 L A 1.8320
31 L A 1.7788
32 L A 1.8460
33 L A 1.9497
34 A A 1.2878
35 G A 0.2277
36 P A 0.2948
37 G A -0.3861
38 A A -0.4892
39 A A -0.4838
40 A A -0.7660
41 P A -0.7993
42 P A -1.2142
43 C A 0.0000
44 L A -1.6023
45 D A -2.2348
46 G A -1.3815
47 S A -1.0816
48 P A -1.2527
49 C A 0.0000
50 A A -1.3626
51 N A -1.2906
52 G A -0.2156
53 G A 0.0000
54 R A -0.8665
55 C A 0.0000
56 T A 0.0000
57 Q A -1.5560
58 L A -0.9537
59 P A -1.1814
60 S A -1.5656
61 R A -2.8373
62 E A -2.8478
63 A A -1.7930
64 A A -0.7779
65 C A -0.5922
66 L A 0.4225
67 C A 0.0275
68 P A 0.1222
69 P A -0.3542
70 G A -0.9525
71 W A 0.0000
72 V A -1.3012
73 G A -1.0610
74 E A -1.3239
75 R A -1.7229
76 C A 0.0000
77 Q A 0.0000
78 L A -1.5218
79 E A -2.3390
80 D A -2.3437
81 P A -1.7314
82 C A 0.0000
83 H A -1.4867
84 S A -1.2996
85 G A -0.9000
86 P A -0.4180
87 C A 0.0000
88 A A -1.1021
89 G A -1.5775
90 R A -1.9314
91 G A -1.5954
92 V A 0.0000
93 C A -1.5570
94 Q A -1.9325
95 S A -1.2085
96 S A -0.7284
97 V A -0.0476
98 V A 0.7913
99 A A 0.3824
100 G A -0.3962
101 T A -0.2519
102 A A -0.9921
103 R A -2.0540
104 F A -1.9108
105 S A -2.1933
106 C A 0.0000
107 R A -3.3838
108 C A 0.0000
109 P A -1.5526
110 R A -2.1417
111 G A -1.8011
112 F A 0.0000
113 R A -3.1273
114 G A 0.0000
115 P A -2.2121
116 D A -2.8273
117 C A 0.0000
118 S A -1.4752
119 L A -0.9236
120 P A 0.0000
121 D A -1.6138
122 P A 0.0933
123 C A 0.9914
124 L A 1.0231
125 S A 0.2910
126 S A -0.5666
127 P A -0.4081
128 C A -0.4049
129 A A -0.2810
130 H A -0.8755
131 G A -1.1305
132 A A -1.0608
133 R A -1.4863
134 C A -0.1807
135 S A -0.0737
136 V A -0.0265
137 G A -0.9663
138 P A -1.2927
139 D A -2.1650
140 G A -1.5255
141 R A -1.6684
142 F A -0.0444
143 L A 0.6745
144 C A 0.0584
145 S A -0.5062
146 C A 0.0000
147 P A -0.5897
148 P A -0.2449
149 G A 0.0658
150 Y A 0.2238
151 Q A -1.2427
152 G A -1.7962
153 R A -2.0791
154 S A -1.0632
155 C A -0.4074
156 R A -0.9616
157 S A -1.1027
158 D A -0.5961
159 V A 0.2674
160 D A -1.2286
161 E A 0.0000
162 C A 0.0735
163 R A -0.7386
164 V A 0.9190
165 G A -0.0798
166 E A -0.5314
167 P A -1.1571
168 C A -1.4551
169 R A -2.4130
170 H A -2.3388
171 G A -1.2161
172 G A -0.9312
173 T A -0.9345
174 C A -0.5051
175 L A 0.2172
176 N A -0.9121
177 T A -0.6306
178 P A -0.5068
179 G A 0.0000
180 S A -0.3633
181 F A -0.4009
182 R A -1.4705
183 C A 0.0000
184 Q A -1.2624
185 C A -1.5038
186 P A -0.9316
187 A A -0.5002
188 G A -0.7983
189 Y A -1.1380
190 T A -0.8694
191 G A -0.9046
192 P A -0.7164
193 L A 0.3730
194 C A -1.1649
195 E A -1.9301
196 N A -1.4733
197 P A -1.0705
198 A A -0.6256
199 V A 0.0000
200 P A -0.7086
201 C A 0.0000
202 A A -0.8952
203 P A -1.0039
204 S A -1.0303
205 P A -1.1468
206 C A 0.0000
207 R A -2.2374
208 N A -1.7762
209 G A -1.2594
210 G A -1.2213
211 T A -1.3955
212 C A 0.0000
213 R A -2.8042
214 Q A -2.3735
215 S A -1.7164
216 G A -1.6380
217 D A -1.8898
218 L A -0.6883
219 T A -1.3254
220 Y A 0.0000
221 D A -2.5826
222 C A 0.0000
223 A A -0.8155
224 C A -0.7458
225 L A -0.6114
226 P A -0.3128
227 G A -0.3232
228 F A 0.2220
229 E A -1.8691
230 G A -1.8744
231 Q A -2.4262
232 N A -2.0896
233 C A 0.0000
234 E A -2.1124
235 V A -1.0549
236 N A -1.1068
237 V A 0.0000
238 D A 0.0000
239 D A 0.0000
240 C A 0.0000
241 P A 0.0000
242 G A -1.3321
243 H A -1.8414
244 R A -2.6829
245 C A 0.0000
246 L A -1.4444
247 N A -1.8110
248 G A -1.5259
249 G A -1.4921
250 T A 0.0000
251 C A -1.1775
252 V A -0.6285
253 D A -1.4280
254 G A -0.7956
255 V A -0.7511
256 N A -1.3316
257 T A -0.6900
258 Y A -0.1886
259 N A -0.8449
260 C A 0.0000
261 Q A -1.4500
262 C A 0.0000
263 P A -0.9822
264 P A -1.3011
265 E A -1.7291
266 W A -1.4376
267 T A -1.5702
268 G A -1.6122
269 Q A -1.6584
270 F A 0.0000
271 C A -1.0441
272 T A -0.8265
273 E A -1.6189
274 D A -2.2443
275 V A 0.0000
276 D A -1.6705
277 E A -1.3981
278 C A 0.0000
279 Q A -0.6724
280 L A -0.7083
281 Q A -0.2438
282 P A 0.0000
283 N A 0.0000
284 A A 0.0000
285 C A 0.0000
286 H A 0.0000
287 N A 0.0000
288 G A -0.2096
289 G A 0.1075
290 T A 0.3865
291 C A 0.6346
292 F A 0.8128
293 N A -0.2902
294 T A -0.5034
295 L A -0.8576
296 G A -0.6702
297 G A -0.4550
298 H A -0.5802
299 S A 0.0000
300 C A 0.0000
301 V A 0.0449
302 C A 0.0000
303 V A 0.4781
304 N A 0.0000
305 G A 0.0000
306 W A 0.0000
307 T A -0.6315
308 G A -1.4575
309 E A -2.3981
310 S A -1.1572
311 Y A -0.6798
312 S A 0.0000
313 Q A -0.8775
314 N A 0.0000
315 I A -0.3468
316 D A 0.0000
317 D A 0.0000
318 C A 0.5558
319 A A 0.0000
320 T A 0.0000
321 A A 0.0000
322 V A 1.1880
323 C A 0.0000
324 F A 1.6716
325 H A -0.1016
326 G A -0.2267
327 A A 0.5505
328 T A 0.6161
329 C A 0.5772
330 H A -0.2621
331 D A -0.4265
332 R A -0.8703
333 V A 0.0000
334 A A 0.0000
335 S A 0.0000
336 F A 0.2745
337 Y A 0.9657
338 C A 1.2091
339 A A 0.6579
340 C A 0.6031
341 P A 0.0000
342 M A 0.2550
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 -0.3394
350 H A 0.0000
351 L A -1.9356
352 D A -2.5157
353 D A 0.0000
354 A A 0.0000
355 C A 0.0000
356 V A -0.1776
357 S A -0.7036
358 N A -1.0742
359 P A -0.6143
360 C A -0.6224
361 H A -1.8703
362 E A -2.6682
363 D A -2.2535
364 A A 0.0000
365 I A 0.6455
366 C A 0.0000
367 D A -0.7696
368 T A -0.5482
369 N A -0.7621
370 P A -0.3729
371 V A 0.0450
372 N A 0.0000
373 G A -0.6250
374 R A -0.6618
375 A A -0.1464
376 I A 0.4759
377 C A 0.0000
378 T A 0.2295
379 C A 0.0000
380 P A -0.4643
381 P A -0.5406
382 G A -0.4725
383 F A 0.2759
384 T A 0.2868
385 G A 0.0000
386 G A -0.2447
387 A A -0.0642
388 C A 0.2474
389 D A 0.0980
390 Q A 0.2845
391 D A 0.0000
392 V A 0.0343
393 D A 0.0000
394 E A -1.8575
395 C A 0.0000
396 S A 0.2246
397 I A 0.3549
398 G A -0.8534
399 A A -0.8953
400 N A -1.1654
401 P A 0.0000
402 C A -0.1559
403 E A -0.5295
404 H A -0.3085
405 L A 0.0830
406 G A -0.0466
407 R A 0.0000
408 C A 0.0000
409 V A 0.0000
410 N A 0.0000
411 T A -0.7119
412 Q A -1.3859
413 G A -0.9257
414 S A -0.2508
415 F A 0.6664
416 L A 0.8955
417 C A 0.4500
418 Q A -0.3375
419 C A 0.0000
420 G A -0.5692
421 R A 0.0000
422 G A 0.0213
423 Y A 0.2611
424 T A -0.3722
425 G A -0.8277
426 P A -0.9347
427 R A -1.2603
428 C A 0.0000
429 E A -1.5172
430 T A -0.6499
431 D A 0.0000
432 V A -0.1331
433 N A -0.6009
434 E A -0.7208
435 C A 0.0000
436 L A 1.2856
437 S A 0.3215
438 G A -0.3855
439 P A -0.7970
440 C A -1.0837
441 R A -2.5534
442 N A -2.6284
443 Q A -2.3616
444 A A -1.2258
445 T A -0.0504
446 C A 0.2355
447 L A 0.6288
448 D A -0.6377
449 R A -1.6990
450 I A -0.5137
451 G A 0.0000
452 Q A -1.2670
453 F A -0.5353
454 T A 0.0845
455 C A 0.0000
456 I A 1.1916
457 C A 0.0000
458 M A 0.7584
459 A A -0.4645
460 G A -0.4172
461 F A 1.3785
462 T A 0.1041
463 G A -0.0873
464 T A 0.2188
465 Y A 0.6383
466 C A 0.0000
467 E A -1.1258
468 V A 0.0000
469 D A -2.3782
470 I A -2.2429
471 D A -3.7577
472 E A -3.4197
473 C A 0.0000
474 Q A -2.0018
475 S A -1.5566
476 S A -0.9665
477 P A -0.2549
478 C A 0.0000
479 V A 1.4522
480 N A 0.2504
481 G A -0.0962
482 G A 0.3350
483 V A 1.0667
484 C A -0.1151
485 K A -1.9724
486 D A -2.7433
487 R A -3.1865
488 V A 0.0000
489 N A -2.3301
490 G A -1.4415
491 F A -0.8950
492 S A -0.2624
493 C A 0.2215
494 T A 0.5433
495 C A 0.6160
496 P A 0.0831
497 S A -0.3698
498 G A -0.8611
499 F A 0.1967
500 S A -0.4682
501 G A -0.7263
502 S A -0.5735
503 T A -0.2740
504 C A 0.0000
505 Q A -0.9896
506 L A -0.2242
507 D A -1.5778
508 V A -1.7953
509 D A -3.2639
510 E A -3.1382
511 C A -1.1910
512 A A -0.6373
513 S A -0.8659
514 T A -0.5557
515 P A -0.7533
516 C A -1.4520
517 R A -2.3870
518 N A -2.3713
519 G A -2.1408
520 A A -2.0634
521 K A -2.6062
522 C A -1.4257
523 V A -1.0260
524 D A -2.8656
525 Q A -3.0839
526 P A -2.4514
527 D A -3.4380
528 G A -2.6210
529 Y A -2.4641
530 E A -2.7787
531 C A -2.0577
532 R A -2.8408
533 C A -2.3885
534 A A -2.2561
535 E A -3.1898
536 G A -2.0310
537 F A -1.9959
538 E A -1.5880
539 G A -1.0865
540 T A 0.2635
541 L A 1.0352
542 C A -0.2031
543 D A -0.5512
544 R A -2.2000
545 N A -1.2714
546 V A 0.1581
547 D A -1.7476
548 D A -1.2612
549 C A -1.1124
550 S A -1.2526
551 P A -1.7267
552 D A -2.5774
553 P A -2.0507
554 C A 0.0000
555 H A -1.8935
556 H A -1.9343
557 G A -1.5376
558 R A -2.0811
559 C A -0.9825
560 V A -0.0588
561 D A -0.7882
562 G A -0.1078
563 I A 1.3292
564 A A 0.4503
565 S A 0.0928
566 F A 0.4278
567 S A 0.0000
568 C A 0.0000
569 A A -0.9369
570 C A -1.0543
571 A A -0.6473
572 P A -0.8687
573 G A -1.1545
574 Y A -1.2412
575 T A -1.1956
576 G A -1.1760
577 T A -1.3513
578 R A -2.5182
579 C A 0.0000
580 E A -2.2300
581 S A -1.7966
582 Q A -1.8728
583 V A -2.0065
584 D A -2.5746
585 E A -3.0607
586 C A 0.0000
587 R A -3.0303
588 S A -2.4597
589 Q A -2.3078
590 P A -1.7710
591 C A -2.1628
592 R A -2.7766
593 H A -2.5514
594 G A -1.8143
595 G A -2.1365
596 K A -2.6024
597 C A -1.9410
598 L A -0.8697
599 D A -1.6389
600 L A 0.0073
601 V A -0.1586
602 D A -1.9573
603 K A -1.6773
604 Y A -1.0077
605 L A -0.5962
606 C A -1.3381
607 R A -1.8047
608 C A 0.0000
609 P A -1.1478
610 S A -0.7043
611 G A -0.7157
612 T A 0.2937
613 T A 0.6458
614 G A 0.4288
615 V A 0.9650
616 N A -0.7130
617 C A -0.3523
618 E A 0.5119
619 V A 1.7132
620 N A 0.7460
621 I A 0.6515
622 D A -1.2299
623 D A -1.5816
624 C A -0.4371
625 A A -0.1823
626 S A -0.1941
627 N A -0.4396
628 P A -0.5589
629 C A 0.2925
630 T A 0.9857
631 F A 1.6442
632 G A 1.5327
633 V A 1.5762
634 C A 0.2494
635 R A -1.6495
636 D A -1.6248
637 G A -1.6347
638 I A -1.2722
639 N A -2.3166
640 R A -2.7041
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2264 S A -1.2335
2265 D A -1.9315
2266 W A 0.0000
2267 S A -1.0578
2268 E A -1.4561
2269 S A -0.9797
2270 T A -0.6914
2271 P A 0.0000
2272 S A -0.3819
2273 P A -0.3842
2274 A A -0.1816
2275 T A -0.0712
2276 A A -0.0126
2277 T A 0.0000
2278 G A -0.1255
2279 A A 0.2703
2280 M A 0.7389
2281 A A 0.3195
2282 T A 0.0727
2283 T A 0.0335
2284 T A -0.0362
2285 G A -0.1200
2286 A A 0.5396
2287 L A 1.3025
2288 P A 0.4105
2289 A A 0.2038
2290 Q A -0.2003
2291 P A 0.0000
2292 L A 0.0000
2293 P A -0.4445
2294 L A 0.0000
2295 S A -0.2930
2296 V A -0.1875
2297 P A -0.3236
2298 S A -0.3867
2299 S A -0.4515
2300 L A 0.0000
2301 A A -0.1369
2302 Q A -0.1375
2303 A A 0.0941
2304 Q A 0.0000
2305 T A 0.0040
2306 Q A -0.4460
2307 L A 0.5872
2308 G A -0.0544
2309 P A 0.0000
2310 Q A -0.8084
2311 P A -0.3516
2312 E A 0.0340
2313 V A 1.1574
2314 T A -0.2520
2315 P A -1.3297
2316 K A -1.8485
2317 R A -1.8457
2318 Q A -0.9723
2319 V A 0.9284
2320 L A 1.5160
2321 A A 0.9301
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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, -0.6129 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_3 -0.6129 View CSV PDB
model_2 -0.6166 View CSV PDB
model_4 -0.6209 View CSV PDB
model_0 -0.6499 View CSV PDB
model_11 -0.6598 View CSV PDB
CABS_average -0.6619 View CSV PDB
model_8 -0.6676 View CSV PDB
model_1 -0.671 View CSV PDB
model_5 -0.6805 View CSV PDB
model_7 -0.6809 View CSV PDB
model_6 -0.6883 View CSV PDB
model_10 -0.6955 View CSV PDB
model_9 -0.6983 View CSV PDB
input -0.7474 View CSV PDB