Project name: Y710C_4D

Status: done

Started: 2026-05-10 08:20:15
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICCDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:21:04)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (13:34:22)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (13:35:07)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (13:35:52)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (13:36:38)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (13:37:23)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (13:38:08)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (13:38:54)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (13:39:39)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (13:40:24)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (13:41:09)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (13:41:55)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (13:42:40)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (13:43:25)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (13:44:54)
[INFO]       Main:     Simulation completed successfully.                                          (13:45:38)
Show buried residues

Minimal score value
-4.016
Maximal score value
5.27
Average score
-0.5435
Total score value
-1261.571

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 -1.0366
2 G A 0.0000
3 P A -0.7610
4 G A -0.9555
5 A A 0.0000
6 R A -2.4416
7 G A -1.8183
8 R A -1.8016
9 R A -2.7120
10 R A -2.1938
11 R A -3.0818
12 R A -2.8094
13 R A -1.3491
14 P A -0.3641
15 M A 0.5176
16 S A 0.0272
17 P A -0.3943
18 P A -0.4278
19 P A -0.8476
20 P A -0.8448
21 P A -0.5599
22 P A -0.1422
23 P A 0.0507
24 V A 0.7481
25 R A -0.8653
26 A A -0.2361
27 L A 0.4814
28 P A 0.1684
29 L A 0.6505
30 L A 0.7971
31 L A 0.8596
32 L A 0.9641
33 L A 0.7703
34 A A 0.0269
35 G A -0.4754
36 P A -0.6355
37 G A -0.6580
38 A A 0.1860
39 A A 0.2646
40 A A 0.3917
41 P A -0.1936
42 P A 0.0902
43 C A 0.0000
44 L A 0.5473
45 D A -0.6518
46 G A -0.8492
47 S A -0.5514
48 P A -0.6708
49 C A -0.6059
50 A A -0.5713
51 N A -0.5990
52 G A -0.7390
53 G A -0.3139
54 R A 0.0000
55 C A 0.6869
56 T A 0.5670
57 Q A 0.2075
58 L A 0.6523
59 P A -0.4133
60 S A -0.9645
61 R A -1.5586
62 E A -0.7490
63 A A 0.0000
64 A A 0.0000
65 C A 0.0000
66 L A 0.9917
67 C A 0.0000
68 P A -0.3525
69 P A -1.0421
70 G A -1.2454
71 W A 0.0000
72 V A 0.0000
73 G A -1.6830
74 E A -2.1350
75 R A -1.3638
76 C A 0.0000
77 Q A -1.0883
78 L A -1.3016
79 E A -2.2034
80 D A -1.5801
81 P A -1.0674
82 C A 0.0000
83 H A -1.2578
84 S A -1.0655
85 G A -0.7533
86 P A -1.3449
87 C A -0.9195
88 A A -1.1437
89 G A -1.7009
90 R A -2.2987
91 G A -1.7451
92 V A -1.0364
93 C A -0.4900
94 Q A -0.7888
95 S A -0.8434
96 S A 0.0000
97 V A 0.0000
98 V A 0.0609
99 A A -0.2491
100 G A -0.4665
101 T A -0.2128
102 A A 0.0000
103 R A -0.6064
104 F A 0.9870
105 S A 0.5730
106 C A 0.4370
107 R A -0.9148
108 C A -0.8910
109 P A -1.5884
110 R A -2.7318
111 G A -1.6117
112 F A -1.9285
113 R A -2.2838
114 G A -1.5563
115 P A -1.4398
116 D A -1.8672
117 C A -1.1291
118 S A -2.0400
119 L A 0.0000
120 P A 0.0000
121 D A -0.7880
122 P A -0.1139
123 C A 0.0000
124 L A 1.6254
125 S A 0.4311
126 S A 0.2489
127 P A 0.1155
128 C A -0.1649
129 A A -0.3588
130 H A -1.1313
131 G A -0.9912
132 A A -0.7322
133 R A -1.0891
134 C A 0.0383
135 S A 0.2790
136 V A -0.0899
137 G A -0.7771
138 P A -1.7302
139 D A -2.7711
140 G A -2.4410
141 R A -2.1699
142 F A 0.1263
143 L A 1.3931
144 C A 0.0000
145 S A -0.5216
146 C A 0.0000
147 P A -0.2443
148 P A -0.2634
149 G A -0.4523
150 Y A -0.3013
151 Q A -1.6811
152 G A -1.8193
153 R A -2.2482
154 S A -1.1479
155 C A -0.1060
156 R A -1.5868
157 S A -1.5389
158 D A -1.2889
159 V A -0.9501
160 D A -2.2119
161 E A -1.7271
162 C A 0.0000
163 R A -2.2213
164 V A -0.1247
165 G A -1.0765
166 E A -2.0713
167 P A -1.9084
168 C A -2.1935
169 R A -2.8616
170 H A -2.3608
171 G A -1.5118
172 G A -1.7134
173 T A -1.6706
174 C A -1.3334
175 L A -0.6309
176 N A -1.6595
177 T A -1.3383
178 P A -1.1014
179 G A -0.9799
180 S A -0.9739
181 F A 0.0000
182 R A -1.3955
183 C A -1.5157
184 Q A -1.5480
185 C A -1.1357
186 P A -0.6912
187 A A -0.1662
188 G A 0.0162
189 Y A 0.5488
190 T A -0.5259
191 G A -0.5766
192 P A -0.5992
193 L A -0.3800
194 C A -1.1704
195 E A -1.6174
196 N A -1.2353
197 P A -0.2297
198 A A -0.0057
199 V A 0.0000
200 P A -0.1147
201 C A 0.0000
202 A A -0.5216
203 P A -0.5943
204 S A -1.1013
205 P A -1.0506
206 C A 0.0000
207 R A -0.8125
208 N A -1.1464
209 G A -1.1942
210 G A -1.2215
211 T A 0.0000
212 C A -1.8736
213 R A -2.8903
214 Q A -2.6203
215 S A -1.8128
216 G A -1.4932
217 D A -1.5075
218 L A -0.2189
219 T A -0.9611
220 Y A 0.0000
221 D A -2.2146
222 C A -1.0761
223 A A -0.2441
224 C A 0.5262
225 L A 1.4050
226 P A 0.6439
227 G A 0.4496
228 F A 0.7121
229 E A -1.2435
230 G A -1.4042
231 Q A -1.1422
232 N A -0.5403
233 C A -0.3850
234 E A -0.7591
235 V A -0.2768
236 N A 0.0000
237 V A -0.2067
238 D A -1.2852
239 D A -1.8867
240 C A -0.5019
241 P A -0.6767
242 G A -0.7676
243 H A -0.8204
244 R A -1.6983
245 C A 0.0000
246 L A 0.3164
247 N A -0.8206
248 G A -0.9512
249 G A -1.0257
250 T A 0.0000
251 C A 0.4491
252 V A 0.8147
253 D A -0.2196
254 G A 0.0270
255 V A -0.1338
256 N A -1.0672
257 T A -0.5033
258 Y A 0.0734
259 N A -0.4488
260 C A 0.0000
261 Q A -0.9835
262 C A 0.0000
263 P A -0.8714
264 P A -0.6640
265 E A -1.2165
266 W A -0.9613
267 T A -0.7939
268 G A -1.1126
269 Q A -1.3037
270 F A -0.5528
271 C A -0.6724
272 T A -1.1143
273 E A -1.8733
274 D A -1.2860
275 V A -0.5405
276 D A -0.7409
277 E A -1.0691
278 C A 0.0000
279 Q A -1.5785
280 L A -0.5807
281 Q A -1.3837
282 P A -1.3148
283 N A -1.1374
284 A A -0.8814
285 C A 0.0000
286 H A -1.4468
287 N A -0.5950
288 G A 0.0000
289 G A 0.0000
290 T A 0.0000
291 C A 0.0000
292 F A 0.0000
293 N A 0.0000
294 T A 0.0000
295 L A 0.0000
296 G A -0.3472
297 G A -0.6183
298 H A -1.3449
299 S A -0.8521
300 C A -0.3840
301 V A 0.3179
302 C A 0.0000
303 V A 1.5306
304 N A 0.1802
305 G A -0.4702
306 W A -0.7520
307 T A -1.1390
308 G A -1.4747
309 E A -2.2292
310 S A -1.4699
311 C A 0.0000
312 S A -1.2957
313 Q A -1.6502
314 N A -1.8488
315 I A -1.2954
316 D A -2.2114
317 D A -1.0221
318 C A -0.2250
319 A A 0.3272
320 T A 0.2602
321 A A 0.5806
322 V A 1.0579
323 C A 1.3443
324 F A 1.7411
325 H A -0.1041
326 G A 0.0173
327 A A 0.2695
328 T A 0.2447
329 C A 0.2639
330 H A -1.1476
331 D A -1.4494
332 R A -0.8690
333 V A -0.5345
334 A A -0.5420
335 S A 0.0000
336 F A 0.0000
337 Y A 0.0000
338 C A 0.0000
339 A A 0.5355
340 C A 0.2048
341 P A -0.2133
342 M A 0.0964
343 G A -1.4945
344 K A -2.0371
345 T A 0.0000
346 G A 0.0000
347 L A 0.8357
348 L A 1.0877
349 C A 0.0000
350 H A -0.5968
351 L A -1.0700
352 D A -2.5099
353 D A -1.6180
354 A A -0.6015
355 C A 0.0000
356 V A 0.0283
357 S A -0.8194
358 N A 0.0000
359 P A -1.2159
360 C A -0.7094
361 H A -1.4627
362 E A -2.3345
363 D A -2.3721
364 A A -0.4318
365 I A 1.4476
366 C A 1.2655
367 D A 0.4010
368 T A 0.0000
369 N A 0.0000
370 P A 0.0000
371 V A 1.2778
372 N A 0.0000
373 G A -0.3833
374 R A -0.5917
375 A A -0.5205
376 I A -0.0548
377 C A 0.0000
378 T A 0.3145
379 C A 0.0000
380 P A 0.0277
381 P A -0.8399
382 G A 0.0000
383 F A 0.5454
384 T A -0.2659
385 G A -0.9154
386 G A -0.9956
387 A A 0.0000
388 C A -0.5926
389 D A -1.3330
390 Q A -1.5425
391 D A -2.0326
392 V A -1.4686
393 D A -2.0879
394 E A -0.8925
395 C A 0.1127
396 S A 0.2390
397 I A 1.2542
398 G A 0.4715
399 A A 0.2602
400 N A -0.2869
401 P A -1.0297
402 C A -1.5713
403 E A -1.6862
404 H A -0.8233
405 L A -0.0055
406 G A -0.9103
407 R A -1.6840
408 C A -0.5754
409 V A -0.2205
410 N A -0.9568
411 T A -1.1379
412 Q A -1.9640
413 G A -1.0769
414 S A -0.7630
415 F A 0.0000
416 L A -0.2322
417 C A 0.0000
418 Q A -1.3720
419 C A 0.0000
420 G A -0.3217
421 R A 0.0000
422 G A 0.2049
423 Y A -0.6311
424 T A -0.6666
425 G A -1.4309
426 P A -1.5961
427 R A -2.3640
428 C A 0.0000
429 E A -2.7486
430 T A -1.6974
431 D A 0.0000
432 V A 0.3476
433 N A -0.0669
434 E A 0.0000
435 C A 0.0000
436 L A 1.1002
437 S A 0.4942
438 G A 0.2005
439 P A 0.0000
440 C A 0.0000
441 R A -1.0500
442 N A -1.7382
443 Q A -1.6353
444 A A -0.2273
445 T A 0.5606
446 C A 1.2402
447 L A 0.5595
448 D A -0.6603
449 R A -1.4951
450 I A 0.0000
451 G A -1.0223
452 Q A -1.6691
453 F A 0.0000
454 T A 0.3677
455 C A 0.0000
456 I A 1.8031
457 C A 0.0000
458 M A -0.1506
459 A A -0.5908
460 G A -0.2809
461 F A 0.0000
462 T A 0.0000
463 G A 0.0000
464 T A 0.0000
465 Y A 0.3975
466 C A 0.0000
467 E A -1.0855
468 V A -0.5028
469 D A 0.0000
470 I A -0.7968
471 D A -1.6580
472 E A -1.5931
473 C A 0.0000
474 Q A -2.0826
475 S A -1.3289
476 S A -1.0267
477 P A -0.8640
478 C A -0.8258
479 V A -0.5459
480 N A -1.5393
481 G A -1.1811
482 G A -1.1841
483 V A 0.0000
484 C A -1.1517
485 K A -2.2629
486 D A -1.7924
487 R A -1.5720
488 V A 0.3927
489 N A -0.8163
490 G A -0.3273
491 F A 0.0419
492 S A -0.7354
493 C A 0.0000
494 T A -0.5474
495 C A -0.7441
496 P A -0.7409
497 S A -0.8979
498 G A -1.3224
499 F A -0.9586
500 S A 0.0000
501 G A -0.9121
502 S A -0.6800
503 T A -0.4677
504 C A -0.7898
505 Q A -1.0183
506 L A -0.6316
507 D A -1.4947
508 V A -0.3680
509 D A -2.1269
510 E A -2.3810
511 C A -0.9296
512 A A -0.9344
513 S A -0.2985
514 T A -0.1887
515 P A -0.5886
516 C A -0.4882
517 R A -2.0234
518 N A -1.9029
519 G A -1.6529
520 A A -1.7373
521 K A -2.4205
522 C A -1.6292
523 V A -1.5770
524 D A -2.7967
525 Q A -2.6506
526 P A -1.9388
527 D A -1.9936
528 G A -1.7611
529 Y A -1.2930
530 E A -2.0647
531 C A -1.5959
532 R A -2.4423
533 C A -1.6012
534 A A -1.2947
535 E A -1.7293
536 G A -0.8841
537 F A -0.8259
538 E A -1.8764
539 G A -1.1157
540 T A -0.2303
541 L A 1.0844
542 C A -0.0120
543 D A -0.6796
544 R A -1.5148
545 N A -1.1863
546 V A -0.8305
547 D A -1.6530
548 D A -2.0360
549 C A -1.2825
550 S A -1.2379
551 P A -1.4319
552 D A -2.2771
553 P A -1.6845
554 C A -1.6399
555 H A -1.4771
556 H A -1.9071
557 G A -1.6055
558 R A -1.7243
559 C A -0.2218
560 V A 0.7686
561 D A -0.6557
562 G A 0.2909
563 I A 0.9046
564 A A 0.3828
565 S A 0.0910
566 F A 0.0028
567 S A -0.0073
568 C A 0.0000
569 A A -0.4227
570 C A -1.1294
571 A A -1.2184
572 P A -1.3960
573 G A -1.7748
574 Y A 0.0000
575 T A -1.5207
576 G A -0.7589
577 T A -0.7835
578 R A 0.0000
579 C A -1.1185
580 E A -2.4561
581 S A -2.1620
582 Q A -2.2689
583 V A -1.9462
584 D A -2.7710
585 E A -1.4056
586 C A -0.6512
587 R A -1.7516
588 S A -1.3692
589 Q A -1.5171
590 P A -0.7132
591 C A -0.8454
592 R A 0.0000
593 H A -1.2870
594 G A -1.6256
595 G A -1.6532
596 K A -1.7798
597 C A -0.1429
598 L A 1.1182
599 D A 0.4845
600 L A 1.8504
601 V A 0.9778
602 D A -1.3059
603 K A -1.1793
604 Y A 0.0587
605 L A 1.0785
606 C A -0.4936
607 R A -1.6360
608 C A -1.2567
609 P A -0.6465
610 S A -0.3021
611 G A -0.8831
612 T A -0.6163
613 T A -0.1842
614 G A -0.0827
615 V A 0.5838
616 N A -0.6236
617 C A -0.1777
618 E A -0.3611
619 V A 0.8710
620 N A -0.0890
621 I A -0.1256
622 D A -1.9521
623 D A -2.5451
624 C A -1.2872
625 A A -0.8954
626 S A -1.0076
627 N A -1.1540
628 P A -0.4871
629 C A 0.0000
630 T A 0.2063
631 F A 1.6771
632 G A 1.3472
633 V A 1.4350
634 C A 0.5815
635 R A -0.4733
636 D A 0.0000
637 G A -0.4036
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2266 W A -1.6698
2267 S A -1.4608
2268 E A -2.2181
2269 S A 0.0000
2270 T A -1.0046
2271 P A -0.6028
2272 S A -0.6475
2273 P A -0.1640
2274 A A -0.0504
2275 T A -0.0586
2276 A A 0.0000
2277 T A -0.0019
2278 G A 0.0584
2279 A A 0.6795
2280 M A 1.2606
2281 A A 0.8991
2282 T A 0.5449
2283 T A 0.2714
2284 T A 0.0302
2285 G A -0.1754
2286 A A 0.1377
2287 L A 0.3383
2288 P A -0.3491
2289 A A -0.0990
2290 Q A 0.0000
2291 P A -0.1690
2292 L A 0.1295
2293 P A 0.2486
2294 L A 1.2441
2295 S A 0.6382
2296 V A 0.3734
2297 P A -0.1046
2298 S A -0.6371
2299 S A -0.8716
2300 L A -0.6099
2301 A A -0.8866
2302 Q A -1.4674
2303 A A -1.2333
2304 Q A -1.8573
2305 T A -1.1962
2306 Q A -1.0806
2307 L A 0.5348
2308 G A -0.4388
2309 P A -0.8310
2310 Q A -1.0836
2311 P A -0.3667
2312 E A -0.9270
2313 V A 0.2040
2314 T A -1.1022
2315 P A -1.6832
2316 K A -2.7435
2317 R A -2.6144
2318 Q A -1.3719
2319 V A 0.5779
2320 L A 1.3376
2321 A A 0.3654
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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, -0.5435 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 -0.5435 View CSV PDB
model_8 -0.5475 View CSV PDB
model_6 -0.5521 View CSV PDB
model_10 -0.5583 View CSV PDB
model_4 -0.5588 View CSV PDB
model_2 -0.5658 View CSV PDB
model_5 -0.5707 View CSV PDB
model_7 -0.5722 View CSV PDB
CABS_average -0.5722 View CSV PDB
model_3 -0.5815 View CSV PDB
model_1 -0.5936 View CSV PDB
model_11 -0.6075 View CSV PDB
model_9 -0.6149 View CSV PDB
input -0.7624 View CSV PDB