Project name: R640C_4D

Status: done

Started: 2026-05-09 14:25:34
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINCYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimization                                          (00:00:01)
[INFO]       CABS:     Running CABS flex simulation                                                (00:24:34)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (12:16:56)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (12:17:41)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (12:18:26)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (12:19:12)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (12:19:57)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (12:20:43)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (12:21:28)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (12:22:13)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (12:22:58)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (12:23:44)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (12:24:29)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (12:25:14)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (12:25:59)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (12:27:27)
[INFO]       Main:     Simulation completed successfully.                                          (12:28:11)
Show buried residues

Minimal score value
-5.0501
Maximal score value
3.2462
Average score
-0.5887
Total score value
-1366.4592

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 0.5784
2 G A -0.3868
3 P A -0.4603
4 G A -0.6302
5 A A -1.1484
6 R A -1.6505
7 G A -2.0944
8 R A -3.7213
9 R A -4.3399
10 R A -4.7933
11 R A -5.0501
12 R A -4.1782
13 R A -3.2410
14 P A -1.6411
15 M A -0.1582
16 S A -0.0070
17 P A 0.0106
18 P A -0.1929
19 P A -0.3490
20 P A -0.4965
21 P A -0.2818
22 P A -0.1089
23 P A 0.3229
24 V A 0.8798
25 R A -0.8098
26 A A 0.2225
27 L A 1.0323
28 P A 0.5761
29 L A 0.4370
30 L A 0.7448
31 L A 0.7994
32 L A 0.2982
33 L A 0.0000
34 A A 0.1348
35 G A 0.1036
36 P A -0.1915
37 G A -0.5921
38 A A -0.1716
39 A A -0.1195
40 A A -0.5513
41 P A -0.6451
42 P A -0.4026
43 C A 0.0000
44 L A 1.0142
45 D A -0.2063
46 G A -0.3724
47 S A -0.5367
48 P A -0.5793
49 C A -0.3568
50 A A -0.4514
51 N A -1.1017
52 G A -0.8830
53 G A -1.0033
54 R A -1.0446
55 C A -0.2751
56 T A -0.3173
57 Q A -0.5919
58 L A 0.4978
59 P A 0.2323
60 S A -0.3511
61 R A -2.0564
62 E A -2.2555
63 A A -0.6837
64 A A -0.7323
65 C A -0.4923
66 L A -0.8263
67 C A 0.0000
68 P A -0.5328
69 P A -0.6663
70 G A -0.8086
71 W A -0.7783
72 V A -0.7373
73 G A -1.6718
74 E A -2.3333
75 R A -2.5509
76 C A 0.0000
77 Q A -1.7883
78 L A 0.0000
79 E A -2.1636
80 D A 0.0000
81 P A -1.1947
82 C A -1.0218
83 H A -1.3653
84 S A -1.1470
85 G A -0.5975
86 P A -0.2904
87 C A -0.5026
88 A A -0.8827
89 G A -1.3623
90 R A -2.3652
91 G A -1.7413
92 V A 0.0000
93 C A -0.8997
94 Q A -1.4248
95 S A -1.1203
96 S A -1.1603
97 V A 0.0000
98 V A 0.2757
99 A A -0.6268
100 G A -0.4600
101 T A -0.5502
102 A A -0.9864
103 R A -1.5218
104 F A -0.4659
105 S A -0.7973
106 C A -1.2712
107 R A -2.2186
108 C A -1.8292
109 P A -1.8384
110 R A -1.9617
111 G A -1.5691
112 F A 0.0000
113 R A -2.1264
114 G A -1.8263
115 P A -1.2581
116 D A -1.9173
117 C A -1.0477
118 S A -1.4435
119 L A -1.9899
120 P A 0.0000
121 D A -1.9982
122 P A 0.0000
123 C A 0.6506
124 L A 1.5020
125 S A 0.5137
126 S A 0.2972
127 P A -0.1497
128 C A -0.4542
129 A A -0.9825
130 H A -1.3582
131 G A -1.0552
132 A A -1.0848
133 R A -1.6156
134 C A -0.2293
135 S A -0.4091
136 V A 0.0000
137 G A -1.1737
138 P A -1.8786
139 D A -3.0700
140 G A -2.4687
141 R A -2.0082
142 F A 0.1452
143 L A 1.0830
144 C A -0.0895
145 S A -0.0663
146 C A 0.1573
147 P A -0.5834
148 P A -0.5734
149 G A -1.4224
150 Y A -1.7155
151 Q A -2.3653
152 G A -2.0289
153 R A -2.1955
154 S A -1.0996
155 C A 0.0000
156 R A -2.4757
157 S A -1.7279
158 D A -2.1175
159 V A 0.0000
160 D A -2.6139
161 E A -3.0608
162 C A 0.0000
163 R A -2.3968
164 V A -0.6600
165 G A -1.4865
166 E A -2.2939
167 P A -1.7568
168 C A -1.8002
169 R A -2.8576
170 H A -2.3166
171 G A -1.7474
172 G A -1.3505
173 T A -1.6812
174 C A 0.0000
175 L A -0.9131
176 N A -1.8167
177 T A -1.3881
178 P A -1.6307
179 G A -1.3568
180 S A -1.4274
181 F A 0.0000
182 R A -2.0288
183 C A 0.0000
184 Q A -1.3444
185 C A -0.6002
186 P A -0.0574
187 A A 0.6696
188 G A 0.6901
189 Y A 0.5499
190 T A -0.4029
191 G A -1.0485
192 P A -1.1371
193 L A -1.1124
194 C A -1.2275
195 E A -1.9349
196 N A -1.6577
197 P A -0.5174
198 A A 0.2145
199 V A 0.9471
200 P A -0.2643
201 C A 0.0000
202 A A 0.0904
203 P A -0.4421
204 S A -1.1160
205 P A -1.1334
206 C A -1.2863
207 R A -2.3418
208 N A -2.2406
209 G A -1.5949
210 G A -1.4292
211 T A 0.0000
212 C A -1.9170
213 R A -3.1594
214 Q A -2.8864
215 S A -2.0203
216 G A -1.6402
217 D A -1.9365
218 L A -0.1836
219 T A -0.6889
220 Y A -1.6789
221 D A -2.4289
222 C A -1.5739
223 A A -0.9682
224 C A 0.0471
225 L A 0.1063
226 P A -0.3447
227 G A -1.0069
228 F A -0.4242
229 E A -1.7095
230 G A -1.7040
231 Q A -2.0440
232 N A -1.8126
233 C A 0.0000
234 E A -1.4076
235 V A -0.8637
236 N A -1.8602
237 V A 0.0000
238 D A -2.9715
239 D A -3.4887
240 C A -1.8524
241 P A -1.2021
242 G A -1.2109
243 H A -1.8706
244 R A -2.2418
245 C A -0.8730
246 L A 0.2463
247 N A -0.7269
248 G A -0.7240
249 G A -0.6292
250 T A 0.0215
251 C A 0.2361
252 V A 0.5371
253 D A -1.0689
254 G A -0.8420
255 V A -0.2272
256 N A -1.8166
257 T A -0.3992
258 Y A 0.0000
259 N A -0.1117
260 C A 0.0000
261 Q A -0.4126
262 C A -0.8778
263 P A -1.0840
264 P A -1.5651
265 E A -2.1543
266 W A -1.4186
267 T A -1.2448
268 G A -0.5041
269 Q A -1.0315
270 F A 0.8506
271 C A -0.2441
272 T A -0.9089
273 E A -2.1031
274 D A -2.5185
275 V A -1.3814
276 D A -1.1218
277 E A -0.8486
278 C A -0.2433
279 Q A -0.8228
280 L A -0.1138
281 Q A -0.9431
282 P A -1.0758
283 N A -0.7639
284 A A -0.3473
285 C A -0.0259
286 H A -0.3994
287 N A -1.1279
288 G A -0.4515
289 G A 0.2450
290 T A 0.8907
291 C A 1.1318
292 F A 1.9242
293 N A 0.6217
294 T A 0.8161
295 L A 0.8096
296 G A 0.0000
297 G A -0.4362
298 H A -0.2529
299 S A 0.1784
300 C A 0.5944
301 V A 1.1811
302 C A 0.0000
303 V A 0.5828
304 N A 0.0491
305 G A 0.1786
306 W A 0.5346
307 T A -0.1274
308 G A -0.7155
309 E A -2.0170
310 S A -1.2170
311 C A -0.6034
312 S A 0.0000
313 Q A 0.0000
314 N A 0.0000
315 I A -0.0732
316 D A -1.6455
317 D A -1.1553
318 C A -0.0347
319 A A 0.9395
320 T A 0.8541
321 A A 1.2521
322 V A 2.4694
323 C A 1.9080
324 F A 2.5425
325 H A 0.9089
326 G A 0.1018
327 A A 0.7888
328 T A 0.2820
329 C A 0.5283
330 H A -1.3352
331 D A -2.6460
332 R A -2.6653
333 V A -1.2802
334 A A -0.7252
335 S A -0.8066
336 F A 0.0000
337 Y A 0.5089
338 C A 0.0000
339 A A 0.4952
340 C A 0.0000
341 P A 0.1828
342 M A 1.0519
343 G A 0.1825
344 K A 0.0866
345 T A -0.1489
346 G A 0.2830
347 L A 0.7957
348 L A 1.1255
349 C A 0.0000
350 H A 0.5516
351 L A 0.6539
352 D A -0.8504
353 D A -1.0033
354 A A -0.6251
355 C A 0.0000
356 V A 0.5154
357 S A -0.0589
358 N A -0.4010
359 P A -0.4420
360 C A -0.2759
361 H A -1.8574
362 E A -2.7151
363 D A -2.4182
364 A A 0.0000
365 I A 1.1261
366 C A 0.8354
367 D A -0.5049
368 T A 0.0000
369 N A -1.4004
370 P A -1.1773
371 V A -0.9518
372 N A -2.0431
373 G A -1.7972
374 R A -2.2749
375 A A -1.2849
376 I A -0.1576
377 C A 0.0000
378 T A 0.2951
379 C A 0.0000
380 P A -0.6369
381 P A -1.0730
382 G A -1.3679
383 F A -0.7984
384 T A -1.1362
385 G A -0.8002
386 G A -0.8448
387 A A -0.7229
388 C A -0.6310
389 D A -2.0653
390 Q A -2.2874
391 D A -2.0492
392 V A -1.6910
393 D A -2.1858
394 E A 0.0000
395 C A -0.5765
396 S A 0.3602
397 I A 1.1642
398 G A 0.4374
399 A A 0.0000
400 N A -1.0890
401 P A -1.1516
402 C A -1.5990
403 E A -2.0958
404 H A -1.9035
405 L A -0.3448
406 G A 0.0000
407 R A -0.3114
408 C A 0.0000
409 V A 0.0000
410 N A 0.0000
411 T A -0.1864
412 Q A -1.3622
413 G A -0.8642
414 S A 0.3837
415 F A 1.5032
416 L A 0.8519
417 C A 0.0000
418 Q A 0.0000
419 C A 0.0000
420 G A -1.7936
421 R A -2.1933
422 G A -1.1510
423 Y A -0.5928
424 T A -0.3615
425 G A 0.0000
426 P A -1.1505
427 R A -1.2910
428 C A -1.1164
429 E A -0.8864
430 T A -0.2281
431 D A 0.0000
432 V A 0.2871
433 N A -0.8867
434 E A -1.5008
435 C A 0.0000
436 L A 0.6996
437 S A -0.1980
438 G A -0.6605
439 P A -0.3719
440 C A -0.3327
441 R A -1.5590
442 N A -1.3795
443 Q A -0.8134
444 A A 0.1169
445 T A 0.9499
446 C A 0.9394
447 L A 0.2939
448 D A -1.3122
449 R A -1.3320
450 I A 0.5704
451 G A -0.1317
452 Q A -0.6337
453 F A 0.7316
454 T A 0.0000
455 C A 0.0000
456 I A 1.8193
457 C A 0.8195
458 M A 0.2913
459 A A -0.2162
460 G A -1.1191
461 F A 0.0000
462 T A 0.1336
463 G A 0.3546
464 T A 0.4992
465 Y A 1.1585
466 C A 0.0000
467 E A -1.0010
468 V A 0.3336
469 D A -0.7016
470 I A -1.1865
471 D A -3.1456
472 E A -3.2079
473 C A 0.0000
474 Q A -2.6361
475 S A -1.7026
476 S A -1.0201
477 P A -0.6006
478 C A -0.6920
479 V A -0.3112
480 N A -1.3587
481 G A -1.1333
482 G A -1.2566
483 V A -0.8713
484 C A -1.5188
485 K A -2.6338
486 D A -2.9427
487 R A -3.1677
488 V A -1.6031
489 N A -2.0276
490 G A -1.6158
491 F A -1.0804
492 S A -0.7884
493 C A -0.2525
494 T A -0.0427
495 C A 0.1400
496 P A -0.1840
497 S A -0.4174
498 G A -0.1100
499 F A 0.6614
500 S A -0.2037
501 G A 0.1108
502 S A 0.0623
503 T A -0.1143
504 C A -0.1406
505 Q A -0.7479
506 L A -0.1233
507 D A -1.9571
508 V A -1.7865
509 D A -2.8757
510 E A -2.5038
511 C A -1.2060
512 A A -0.4853
513 S A -0.2899
514 T A -0.1713
515 P A -0.5649
516 C A -1.6207
517 R A -2.3373
518 N A -2.5366
519 G A -1.9540
520 A A -1.7393
521 K A -2.6831
522 C A -1.2818
523 V A -1.1900
524 D A -1.9999
525 Q A -2.0253
526 P A -2.0998
527 D A -2.8591
528 G A -1.6144
529 Y A -0.9786
530 E A -1.0501
531 C A 0.0000
532 R A -2.7131
533 C A 0.0000
534 A A -1.7192
535 E A -2.2319
536 G A -2.2771
537 F A -2.6215
538 E A -2.8638
539 G A -1.6621
540 T A -0.3640
541 L A 0.2392
542 C A -1.1483
543 D A -2.4277
544 R A -3.0042
545 N A -2.8307
546 V A -1.9912
547 D A -2.7974
548 D A -2.2407
549 C A -0.5568
550 S A -1.0828
551 P A -0.9367
552 D A -1.1399
553 P A -0.6224
554 C A -0.1853
555 H A -1.2129
556 H A -1.4876
557 G A -1.7875
558 R A -2.0938
559 C A -1.0058
560 V A -0.5077
561 D A -1.7121
562 G A -0.8919
563 I A -0.4492
564 A A -0.5316
565 S A -0.3605
566 F A -0.3968
567 S A -0.6886
568 C A -1.0234
569 A A -0.8904
570 C A 0.0000
571 A A -0.3307
572 P A -0.1889
573 G A -0.1965
574 Y A 0.6130
575 T A -0.3094
576 G A -0.9021
577 T A -1.4175
578 R A -2.1058
579 C A -0.9610
580 E A -1.6771
581 S A -0.8676
582 Q A -0.4783
583 V A 0.1523
584 D A -1.0507
585 E A -2.6246
586 C A 0.0000
587 R A -2.7298
588 S A -2.1308
589 Q A -1.7566
590 P A -1.4794
591 C A -1.3204
592 R A -1.7845
593 H A -1.3370
594 G A -1.1329
595 G A -1.5839
596 K A -1.8310
597 C A -0.7460
598 L A 0.4987
599 D A 0.0844
600 L A 1.4096
601 V A 1.4360
602 D A -0.8117
603 K A -1.2396
604 Y A -0.4642
605 L A 0.8825
606 C A -0.4659
607 R A -1.9581
608 C A -1.1470
609 P A -0.7293
610 S A -0.5160
611 G A -0.5724
612 T A 0.2262
613 T A 0.4700
614 G A 0.2930
615 V A 1.2901
616 N A -0.1842
617 C A 0.0000
618 E A -0.4981
619 V A 0.0384
620 N A 0.0000
621 I A 0.7956
622 D A -1.1571
623 D A -1.6789
624 C A -0.3448
625 A A -0.5350
626 S A -0.4702
627 N A -0.4442
628 P A -0.1099
629 C A 0.3678
630 T A 0.4288
631 F A 0.8269
632 G A 0.4371
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2252 P A -1.1556
2253 E A -1.3845
2254 H A -0.7917
2255 W A 0.7425
2256 A A 0.1814
2257 S A -0.1407
2258 P A -0.0974
2259 S A -0.1791
2260 P A -0.2439
2261 P A -0.6795
2262 S A -0.8551
2263 L A -0.2711
2264 S A -1.0172
2265 D A -1.9372
2266 W A -0.7623
2267 S A -1.2552
2268 E A -1.9220
2269 S A -1.4264
2270 T A -0.8094
2271 P A -0.7806
2272 S A -0.5098
2273 P A 0.0000
2274 A A -0.2794
2275 T A -0.8924
2276 A A -0.8448
2277 T A -0.5177
2278 G A -0.0911
2279 A A 0.4988
2280 M A 1.4969
2281 A A 0.6047
2282 T A 0.3530
2283 T A -0.0460
2284 T A -0.1442
2285 G A -0.3050
2286 A A 0.2610
2287 L A 0.6568
2288 P A 0.0847
2289 A A -0.2590
2290 Q A -0.8415
2291 P A 0.0247
2292 L A 0.9812
2293 P A 0.4462
2294 L A 0.9454
2295 S A 1.1076
2296 V A 1.7141
2297 P A 0.5326
2298 S A -0.0482
2299 S A -0.7710
2300 L A -0.8380
2301 A A -2.1137
2302 Q A -3.0352
2303 A A -3.2036
2304 Q A -2.9882
2305 T A -2.0686
2306 Q A -1.1869
2307 L A 0.3292
2308 G A -0.2582
2309 P A 0.1176
2310 Q A 0.0965
2311 P A 0.3638
2312 E A -0.1426
2313 V A 0.4586
2314 T A -0.7299
2315 P A -1.3664
2316 K A -2.7823
2317 R A -2.7672
2318 Q A -1.7488
2319 V A 0.0000
2320 L A 1.2742
2321 A A 0.7408
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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, -0.5887 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 -0.5887 View CSV PDB
model_9 -0.5948 View CSV PDB
model_5 -0.602 View CSV PDB
model_7 -0.6087 View CSV PDB
model_6 -0.6116 View CSV PDB
model_8 -0.6184 View CSV PDB
model_4 -0.6186 View CSV PDB
CABS_average -0.6193 View CSV PDB
model_3 -0.6197 View CSV PDB
model_2 -0.6343 View CSV PDB
model_10 -0.6343 View CSV PDB
model_0 -0.637 View CSV PDB
model_11 -0.6639 View CSV PDB
input -0.7647 View CSV PDB