Project name: G1347R_4D

Status: done

Started: 2026-05-14 06:15:57
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHRGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:29:08)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (12:05:47)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (12:06:26)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (12:07:05)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (12:07:45)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (12:08:25)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (12:09:05)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (12:09:46)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (12:10:25)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (12:11:05)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (12:11:45)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (12:12:25)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (12:13:06)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (12:13:45)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (12:15:01)
[INFO]       Main:     Simulation completed successfully.                                          (12:15:42)
Show buried residues

Minimal score value
-4.1193
Maximal score value
5.7565
Average score
-0.538
Total score value
-1248.7996

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 -0.7056
2 G A -0.2717
3 P A -0.9893
4 G A -0.7987
5 A A -0.9377
6 R A -2.3241
7 G A -2.1571
8 R A -2.8039
9 R A -2.9948
10 R A 0.0000
11 R A -3.3230
12 R A -2.9500
13 R A -1.0147
14 P A -0.2286
15 M A 0.2365
16 S A 0.2237
17 P A 0.0466
18 P A -0.3609
19 P A -0.5991
20 P A -1.2031
21 P A -1.1117
22 P A -1.0151
23 P A -0.4698
24 V A 0.0000
25 R A -1.6887
26 A A -0.5402
27 L A 0.2988
28 P A 0.0583
29 L A 0.6635
30 L A 0.7429
31 L A 0.0000
32 L A 0.4426
33 L A 0.6952
34 A A 0.1824
35 G A -0.3560
36 P A -0.9090
37 G A -1.1263
38 A A -0.4807
39 A A -0.4324
40 A A -0.6437
41 P A 0.0000
42 P A -0.9269
43 C A 0.0000
44 L A -1.1498
45 D A -2.0143
46 G A -1.1828
47 S A -0.7571
48 P A -0.7742
49 C A 0.1522
50 A A 0.0000
51 N A 0.1577
52 G A -0.6987
53 G A -1.4424
54 R A -2.0727
55 C A -1.1997
56 T A -0.7368
57 Q A -0.8630
58 L A 0.7782
59 P A 0.2126
60 S A -0.0284
61 R A 0.0000
62 E A -0.7261
63 A A -0.3523
64 A A -0.1608
65 C A -0.2249
66 L A 0.2337
67 C A 0.0000
68 P A -0.3916
69 P A -0.3694
70 G A -0.3887
71 W A -0.1248
72 V A 0.1234
73 G A -0.3419
74 E A -0.5813
75 R A -0.6697
76 C A 0.1584
77 Q A -0.0440
78 L A 0.0000
79 E A -0.7228
80 D A -0.9150
81 P A 0.0000
82 C A -0.8490
83 H A -1.0548
84 S A -0.8395
85 G A -0.9364
86 P A -0.7554
87 C A 0.0000
88 A A -1.0430
89 G A -1.4361
90 R A -2.5933
91 G A -1.4590
92 V A -1.0582
93 C A -0.9961
94 Q A -1.5127
95 S A -1.2370
96 S A -0.7587
97 V A 0.1771
98 V A 0.8084
99 A A 0.0399
100 G A -0.5742
101 T A -0.9681
102 A A 0.0000
103 R A -2.7561
104 F A 0.0000
105 S A -2.1607
106 C A 0.0000
107 R A -2.3612
108 C A -1.9120
109 P A -1.6936
110 R A -2.4114
111 G A -1.6296
112 F A 0.0000
113 R A -1.6238
114 G A 0.0000
115 P A -1.7580
116 D A -2.4474
117 C A 0.0000
118 S A -1.1571
119 L A 0.0000
120 P A -0.9343
121 D A 0.0000
122 P A 0.3592
123 C A 1.2624
124 L A 2.0583
125 S A 0.5215
126 S A 0.0755
127 P A -0.1705
128 C A -0.7492
129 A A -0.3173
130 H A -0.9755
131 G A -1.1038
132 A A -1.1808
133 R A -1.2779
134 C A 0.7017
135 S A 1.4300
136 V A 1.5941
137 G A 0.5063
138 P A -0.7276
139 D A -1.7498
140 G A -0.6067
141 R A 0.0000
142 F A 2.9436
143 L A 2.5204
144 C A 0.9849
145 S A -0.2349
146 C A -0.9251
147 P A -0.8921
148 P A -0.9031
149 G A -1.2960
150 Y A 0.0000
151 Q A -1.6716
152 G A -1.0093
153 R A -1.7309
154 S A -1.0471
155 C A -0.7713
156 R A -1.4618
157 S A -1.8229
158 D A -2.6748
159 V A -2.4215
160 D A -3.2931
161 E A -2.9366
162 C A -1.4257
163 R A -2.5054
164 V A -1.5799
165 G A -1.4888
166 E A -2.3157
167 P A -1.2824
168 C A -0.7055
169 R A -1.1669
170 H A -1.4949
171 G A -1.2722
172 G A -0.9548
173 T A -0.6821
174 C A -0.2514
175 L A 0.2946
176 N A -0.7561
177 T A -0.5342
178 P A -0.8687
179 G A 0.0000
180 S A -1.1756
181 F A 0.0000
182 R A -1.2482
183 C A 0.0000
184 Q A -0.9630
185 C A -0.7712
186 P A -0.2547
187 A A -0.1006
188 G A -0.2766
189 Y A -0.0797
190 T A -0.6848
191 G A -0.8140
192 P A -0.7184
193 L A -0.3111
194 C A -1.1045
195 E A -1.6998
196 N A -1.5054
197 P A -0.8523
198 A A -0.4348
199 V A 0.2246
200 P A -0.4101
201 C A -0.8397
202 A A -0.8877
203 P A -1.3611
204 S A -1.0434
205 P A -1.2756
206 C A -1.5227
207 R A -1.9104
208 N A -1.2723
209 G A -0.9766
210 G A -1.1449
211 T A -1.1126
212 C A 0.0000
213 R A -2.1972
214 Q A 0.0000
215 S A -1.0247
216 G A -1.1609
217 D A -1.4080
218 L A 0.5901
219 T A 0.1205
220 Y A 0.3782
221 D A -1.0155
222 C A -0.3627
223 A A -0.0905
224 C A -0.2610
225 L A 0.6380
226 P A -0.1838
227 G A -0.5590
228 F A -0.7402
229 E A -1.6311
230 G A -1.6820
231 Q A -2.0282
232 N A -1.7874
233 C A -1.0926
234 E A 0.0000
235 V A 0.0000
236 N A -1.4857
237 V A -1.1544
238 D A -2.5599
239 D A -2.3719
240 C A -0.5288
241 P A -0.6505
242 G A -1.0657
243 H A -1.3465
244 R A -2.2224
245 C A -1.3696
246 L A -1.0749
247 N A -1.2663
248 G A -0.7444
249 G A -0.3880
250 T A -0.2585
251 C A 0.3936
252 V A 0.0000
253 D A -1.7506
254 G A -0.2595
255 V A 0.6068
256 N A -1.1351
257 T A -0.9149
258 Y A -0.8483
259 N A 0.0000
260 C A 0.0000
261 Q A 0.0000
262 C A 0.0000
263 P A -0.0295
264 P A -0.6364
265 E A -1.0965
266 W A 0.0000
267 T A 0.0000
268 G A 0.0000
269 Q A -0.2829
270 F A -0.6050
271 C A 0.0000
272 T A 0.0000
273 E A -1.0679
274 D A 0.0000
275 V A -0.6364
276 D A -0.6580
277 E A -0.8389
278 C A 0.0000
279 Q A -0.2026
280 L A 0.3882
281 Q A -0.4253
282 P A -0.5882
283 N A -0.5822
284 A A -0.7142
285 C A 0.0000
286 H A 0.0000
287 N A -0.4190
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 -0.8817
297 G A 0.0000
298 H A -0.6970
299 S A -0.2614
300 C A -0.4276
301 V A 0.0000
302 C A 0.0000
303 V A 0.1273
304 N A -0.1234
305 G A 0.1611
306 W A -0.0540
307 T A -0.3460
308 G A -1.1014
309 E A -2.1476
310 S A -1.3099
311 C A 0.0000
312 S A -1.1647
313 Q A -0.8233
314 N A -0.3401
315 I A 0.6675
316 D A -0.5705
317 D A -1.0037
318 C A -0.8648
319 A A 0.0000
320 T A 0.0000
321 A A 0.0000
322 V A 0.0000
323 C A 0.0000
324 F A 0.4962
325 H A 0.0000
326 G A -0.0176
327 A A 0.1056
328 T A 0.0000
329 C A -0.1231
330 H A -0.4031
331 D A -1.4908
332 R A -1.8002
333 V A -0.8066
334 A A 0.0000
335 S A 0.0000
336 F A 0.0000
337 Y A -0.1045
338 C A 0.0000
339 A A 0.0000
340 C A 0.0000
341 P A 0.0000
342 M A 0.4420
343 G A 0.0205
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 0.0000
350 H A 0.2054
351 L A 0.8483
352 D A -0.1672
353 D A -0.3850
354 A A -0.1337
355 C A 0.0000
356 V A -0.0793
357 S A -0.3749
358 N A -0.5587
359 P A -0.6688
360 C A 0.0000
361 H A 0.0000
362 E A -1.4581
363 D A -1.0693
364 A A 0.0000
365 I A -0.0913
366 C A 0.0000
367 D A -0.3674
368 T A 0.0000
369 N A 0.0000
370 P A 0.0000
371 V A 0.3354
372 N A 0.0000
373 G A 0.0539
374 R A 0.0000
375 A A -0.0326
376 I A 0.0000
377 C A 0.0000
378 T A 0.0000
379 C A 0.0000
380 P A 0.0000
381 P A -0.4038
382 G A -0.8447
383 F A -0.1562
384 T A -0.3520
385 G A -0.5560
386 G A -0.5617
387 A A 0.0000
388 C A 0.0000
389 D A -1.0120
390 Q A 0.0000
391 D A -1.4721
392 V A 0.0000
393 D A -1.0760
394 E A 0.0000
395 C A 0.0000
396 S A -0.5987
397 I A -0.2612
398 G A -0.4292
399 A A -0.0862
400 N A 0.0000
401 P A -0.8176
402 C A -1.1699
403 E A -2.3675
404 H A -2.2541
405 L A -1.3917
406 G A -1.3472
407 R A -1.5696
408 C A -0.3679
409 V A -0.0456
410 N A -0.8671
411 T A -0.7881
412 Q A -1.6416
413 G A 0.0000
414 S A 0.0000
415 F A 0.0000
416 L A -0.0412
417 C A 0.0000
418 Q A 0.0000
419 C A 0.0000
420 G A 0.0000
421 R A 0.0000
422 G A 0.8897
423 Y A 0.0000
424 T A 0.0000
425 G A 0.0000
426 P A 0.0000
427 R A 0.0000
428 C A 0.0000
429 E A -0.5004
430 T A -0.1424
431 D A 0.4391
432 V A 1.3557
433 N A 0.0000
434 E A 0.0000
435 C A 0.8921
436 L A 1.6949
437 S A 0.0000
438 G A 0.0000
439 P A -0.2090
440 C A -1.0475
441 R A -2.1715
442 N A -1.1781
443 Q A -0.8436
444 A A -0.1209
445 T A 0.2760
446 C A 0.5638
447 L A 0.3737
448 D A -0.8395
449 R A -1.3908
450 I A 0.1235
451 G A 0.0000
452 Q A -1.0595
453 F A 0.0000
454 T A 0.0647
455 C A 0.6633
456 I A 1.2025
457 C A 0.0000
458 M A 0.5139
459 A A 0.0000
460 G A 0.2949
461 F A 1.4049
462 T A 0.4011
463 G A 0.3050
464 T A 0.1673
465 Y A 0.0000
466 C A 0.0000
467 E A -0.7532
468 V A -0.1978
469 D A -0.3405
470 I A -0.3573
471 D A -1.4908
472 E A -1.9583
473 C A -1.3559
474 Q A -1.5212
475 S A -0.8061
476 S A -0.4777
477 P A -0.4963
478 C A 0.0000
479 V A 0.6593
480 N A -0.7610
481 G A -0.9408
482 G A -1.0665
483 V A 0.0000
484 C A 0.0000
485 K A 0.0000
486 D A 0.0000
487 R A -0.0763
488 V A 0.1290
489 N A -0.9968
490 G A -0.8844
491 F A -0.3505
492 S A 0.0000
493 C A 0.0000
494 T A 0.0000
495 C A -0.1856
496 P A 0.1296
497 S A 0.1241
498 G A 0.0584
499 F A 1.2651
500 S A 0.1367
501 G A 0.0914
502 S A -0.4068
503 T A -0.0996
504 C A -0.4036
505 Q A -1.1552
506 L A -0.1002
507 D A -1.1410
508 V A -0.0308
509 D A -1.9392
510 E A -2.3834
511 C A -1.1768
512 A A -0.7150
513 S A -0.6730
514 T A -0.2873
515 P A -0.7934
516 C A -0.6270
517 R A -2.5451
518 N A -2.8006
519 G A -2.0960
520 A A -2.1808
521 K A -2.3235
522 C A -1.2841
523 V A -1.1456
524 D A -1.8141
525 Q A -2.5280
526 P A -2.1101
527 D A -2.5599
528 G A -1.9572
529 Y A -1.5607
530 E A -1.1256
531 C A 0.0000
532 R A -1.5816
533 C A 0.0000
534 A A -1.3273
535 E A -1.8843
536 G A -1.0137
537 F A 0.3146
538 E A -0.7608
539 G A -0.5404
540 T A 0.0937
541 L A 0.7918
542 C A -0.1538
543 D A -2.2900
544 R A -2.5972
545 N A -2.1246
546 V A -0.8715
547 D A -1.5293
548 D A -1.3831
549 C A -1.0401
550 S A -1.2171
551 P A -1.0927
552 D A -1.7304
553 P A -1.3872
554 C A -1.3815
555 H A -1.7249
556 H A -1.8410
557 G A -1.4854
558 R A -1.7636
559 C A -0.7792
560 V A 0.2548
561 D A -0.6368
562 G A 0.0994
563 I A 0.7603
564 A A 0.2435
565 S A -0.2453
566 F A 0.0000
567 S A -0.2907
568 C A 0.0000
569 A A -0.7753
570 C A -1.1597
571 A A -0.7671
572 P A -0.5632
573 G A -1.2000
574 Y A -0.9829
575 T A 0.0000
576 G A -0.9639
577 T A -0.6075
578 R A -1.6299
579 C A 0.0000
580 E A -2.3146
581 S A -1.7833
582 Q A -2.0196
583 V A -1.9436
584 D A -3.0664
585 E A -2.3711
586 C A -1.3790
587 R A -2.3283
588 S A -1.5387
589 Q A -0.8827
590 P A -1.2658
591 C A -1.8071
592 R A -2.3004
593 H A -2.2718
594 G A -1.8991
595 G A -2.1619
596 K A -2.3854
597 C A 0.0000
598 L A 0.1888
599 D A -0.6046
600 L A 1.2938
601 V A 0.7716
602 D A -1.1753
603 K A -1.7507
604 Y A -1.1911
605 L A -0.5148
606 C A 0.0000
607 R A -2.6990
608 C A 0.0000
609 P A -1.4715
610 S A -1.3127
611 G A -1.2973
612 T A -0.9350
613 T A -0.4710
614 G A -0.0460
615 V A 0.8181
616 N A -0.8649
617 C A -0.9047
618 E A -1.4317
619 V A 0.0000
620 N A -2.0770
621 I A -2.0908
622 D A -2.9521
623 D A -1.9774
624 C A -0.6998
625 A A -0.6199
626 S A -0.6909
627 N A -0.8186
628 P A 0.5194
629 C A 0.7644
630 T A 1.0283
631 F A 2.2787
632 G A 1.4505
633 V A 1.9449
634 C A 0.3416
635 R A -1.6915
636 D A -2.2108
637 G A 0.0000
638 I A -0.4525
639 N A -1.7822
640 R A -3.0499
641 Y A 0.0000
642 D A -0.8290
643 C A 0.0000
644 V A 1.7533
645 C A 1.7400
646 Q A 0.6345
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2271 P A -0.8553
2272 S A -0.6134
2273 P A -0.0409
2274 A A 0.0146
2275 T A 0.2355
2276 A A 0.0471
2277 T A -0.1124
2278 G A -0.4319
2279 A A 0.0615
2280 M A 0.3163
2281 A A 0.0151
2282 T A -0.0410
2283 T A -0.1551
2284 T A -0.0653
2285 G A 0.0000
2286 A A 0.0000
2287 L A 0.0000
2288 P A 0.0000
2289 A A 0.0000
2290 Q A 0.0000
2291 P A 0.1683
2292 L A 0.6173
2293 P A 0.5132
2294 L A 1.0109
2295 S A 1.1200
2296 V A 2.0256
2297 P A 1.3596
2298 S A 0.6511
2299 S A 0.6035
2300 L A 0.7160
2301 A A -0.2576
2302 Q A -1.0722
2303 A A -0.7371
2304 Q A -0.8411
2305 T A 0.0000
2306 Q A 0.0000
2307 L A -0.4119
2308 G A 0.0000
2309 P A 0.0000
2310 Q A 0.0000
2311 P A -1.1309
2312 E A -1.9704
2313 V A -1.3246
2314 T A -1.2515
2315 P A -1.7361
2316 K A -2.8647
2317 R A -2.7083
2318 Q A -1.9193
2319 V A -0.3131
2320 L A 0.5087
2321 A A 0.5652
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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, -0.538 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 -0.538 View CSV PDB
model_8 -0.5395 View CSV PDB
model_7 -0.5556 View CSV PDB
model_5 -0.561 View CSV PDB
model_2 -0.5637 View CSV PDB
model_3 -0.5726 View CSV PDB
model_4 -0.5855 View CSV PDB
CABS_average -0.5871 View CSV PDB
model_0 -0.5918 View CSV PDB
model_10 -0.6034 View CSV PDB
model_6 -0.6322 View CSV PDB
model_11 -0.6389 View CSV PDB
model_9 -0.6624 View CSV PDB
input -0.7374 View CSV PDB