Project name: C988Y_4D

Status: done

Started: 2026-05-12 07:16:16
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTYLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:17:28)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (11:55:53)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (11:56:37)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (11:57:21)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (11:58:04)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (11:58:48)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (11:59:31)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (12:00:14)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (12:00:57)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (12:01:40)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (12:02:23)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (12:03:05)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (12:03:48)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (12:04:30)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (12:05:56)
[INFO]       Main:     Simulation completed successfully.                                          (12:06:37)
Show buried residues

Minimal score value
-3.6697
Maximal score value
4.1979
Average score
-0.5884
Total score value
-1365.6418

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 0.6010
2 G A -0.0583
3 P A -0.1929
4 G A -0.2476
5 A A -0.4112
6 R A -0.8618
7 G A -1.6516
8 R A -2.8159
9 R A -3.2869
10 R A -3.2225
11 R A -3.6375
12 R A -2.7277
13 R A -1.8579
14 P A -0.5785
15 M A -0.3793
16 S A -0.9645
17 P A -1.0935
18 P A -1.5737
19 P A -1.0241
20 P A -0.6715
21 P A -0.6793
22 P A -0.6664
23 P A 0.0000
24 V A 0.1993
25 R A 0.0000
26 A A -0.0566
27 L A 0.5598
28 P A 0.7569
29 L A 1.8426
30 L A 3.1379
31 L A 3.6351
32 L A 3.4505
33 L A 2.8339
34 A A 0.9892
35 G A -0.0518
36 P A -0.4248
37 G A -0.6293
38 A A -0.1381
39 A A -0.0604
40 A A 0.0000
41 P A -0.8997
42 P A -1.7345
43 C A -1.5718
44 L A 0.0000
45 D A -2.3643
46 G A -1.4245
47 S A -1.3127
48 P A -1.1285
49 C A 0.0000
50 A A -1.1845
51 N A -1.5121
52 G A 0.0000
53 G A -1.4804
54 R A -2.0050
55 C A -0.8074
56 T A -0.9793
57 Q A -1.8109
58 L A -0.8783
59 P A -1.1223
60 S A -1.2075
61 R A -1.9412
62 E A -2.4973
63 A A 0.0000
64 A A 0.0000
65 C A 0.0000
66 L A -0.4103
67 C A -0.2459
68 P A -0.4676
69 P A -0.8488
70 G A -1.2024
71 W A -1.0374
72 V A -0.4119
73 G A 0.0000
74 E A -1.1719
75 R A -2.4315
76 C A 0.0000
77 Q A -2.2943
78 L A 0.0000
79 E A -2.8196
80 D A -2.6618
81 P A -1.5972
82 C A -0.9345
83 H A -1.3320
84 S A -0.8318
85 G A -0.6868
86 P A -1.1532
87 C A 0.0000
88 A A -0.4643
89 G A -0.9149
90 R A -1.8807
91 G A -1.4911
92 V A -1.0316
93 C A -0.6955
94 Q A -0.7457
95 S A -0.5412
96 S A -0.1731
97 V A 0.2371
98 V A 0.3542
99 A A -0.5618
100 G A -0.8456
101 T A -0.7016
102 A A -0.9397
103 R A -1.2311
104 F A -0.9541
105 S A -0.8255
106 C A -1.2662
107 R A -2.2565
108 C A 0.0000
109 P A -1.4959
110 R A -1.8520
111 G A -0.6189
112 F A -0.8869
113 R A 0.0000
114 G A -1.7664
115 P A -1.8433
116 D A -1.8823
117 C A -0.9104
118 S A -0.6992
119 L A -0.2017
120 P A -0.3385
121 D A 0.0000
122 P A -0.1104
123 C A 0.0000
124 L A 0.9769
125 S A 0.1562
126 S A 0.1823
127 P A -0.1231
128 C A -0.7489
129 A A -0.6326
130 H A -0.9822
131 G A -1.0904
132 A A -1.1386
133 R A -1.5482
134 C A 0.0757
135 S A 0.2933
136 V A -0.2424
137 G A 0.0000
138 P A -1.6335
139 D A -2.8098
140 G A -2.1412
141 R A -2.0941
142 F A -0.2205
143 L A 0.7470
144 C A 0.0000
145 S A -0.7108
146 C A -0.8398
147 P A -0.9578
148 P A -0.6735
149 G A -0.7685
150 Y A -1.2574
151 Q A -2.2895
152 G A -2.2311
153 R A -2.5296
154 S A -1.4352
155 C A -1.1390
156 R A -1.6639
157 S A -1.7613
158 D A -2.0734
159 V A -0.7997
160 D A -0.8011
161 E A -1.1738
162 C A -1.1490
163 R A -1.6323
164 V A 0.1115
165 G A -1.0050
166 E A -2.3633
167 P A -1.6682
168 C A -1.7470
169 R A -2.3610
170 H A -1.4090
171 G A -1.0240
172 G A -0.8296
173 T A 0.0000
174 C A -1.0286
175 L A -0.0653
176 N A -1.0496
177 T A -0.8379
178 P A -0.8187
179 G A -1.0466
180 S A -0.7917
181 F A -0.7415
182 R A -1.5190
183 C A -1.1911
184 Q A -1.2137
185 C A -0.9882
186 P A -0.7276
187 A A -0.8426
188 G A -1.1368
189 Y A -0.2924
190 T A -0.6607
191 G A -0.3283
192 P A 0.2305
193 L A 0.9970
194 C A -0.0143
195 E A -1.8598
196 N A -1.6134
197 P A -1.2648
198 A A -1.1285
199 V A 0.0000
200 P A -1.0958
201 C A -0.6613
202 A A -0.4070
203 P A -0.4343
204 S A -0.5990
205 P A -1.0572
206 C A 0.0000
207 R A -2.0836
208 N A -1.8894
209 G A -1.1425
210 G A -0.9188
211 T A -0.9390
212 C A -1.2930
213 R A -2.2834
214 Q A -1.9439
215 S A -1.6037
216 G A -1.8424
217 D A -2.2370
218 L A -1.2631
219 T A -0.8687
220 Y A 0.2482
221 D A -0.4297
222 C A -0.8301
223 A A -0.2274
224 C A 0.3347
225 L A 1.0320
226 P A -0.3705
227 G A -0.5296
228 F A -0.9536
229 E A -1.8377
230 G A -2.0118
231 Q A -2.3533
232 N A -2.1976
233 C A -1.4685
234 E A -1.8318
235 V A -1.1885
236 N A 0.0000
237 V A -0.6673
238 D A -1.9915
239 D A -2.1316
240 C A -1.2075
241 P A -1.1289
242 G A -1.7493
243 H A -2.2841
244 R A -2.5560
245 C A -1.4800
246 L A -1.0892
247 N A -1.6427
248 G A -1.3685
249 G A -1.3721
250 T A -1.2252
251 C A 0.0000
252 V A -0.4463
253 D A 0.0000
254 G A -0.6024
255 V A -0.8980
256 N A -1.4289
257 T A -0.2248
258 Y A 0.1108
259 N A -0.3652
260 C A 0.0000
261 Q A -0.9571
262 C A -1.0941
263 P A -0.7947
264 P A -1.4251
265 E A -2.4630
266 W A -1.8972
267 T A 0.0000
268 G A -1.3002
269 Q A -0.9485
270 F A 0.5345
271 C A 0.0000
272 T A -1.6146
273 E A -2.7536
274 D A -1.7883
275 V A -0.5778
276 D A -1.5241
277 E A -1.0479
278 C A 0.0000
279 Q A -1.3272
280 L A 0.4016
281 Q A -0.4070
282 P A -0.7691
283 N A -1.0249
284 A A -0.4838
285 C A -0.6095
286 H A 0.0000
287 N A -1.2265
288 G A -1.1786
289 G A -1.1999
290 T A 0.0000
291 C A 0.0000
292 F A 0.0000
293 N A -1.0774
294 T A -0.4069
295 L A 0.9882
296 G A 0.0895
297 G A -0.8220
298 H A -1.5076
299 S A -1.3104
300 C A 0.0000
301 V A 0.0000
302 C A 0.0000
303 V A 0.0000
304 N A 0.0000
305 G A -1.1842
306 W A -1.2708
307 T A -1.3374
308 G A -1.5985
309 E A -2.1854
310 S A -1.2603
311 C A -1.1561
312 S A -1.2809
313 Q A -1.7044
314 N A -1.8044
315 I A -1.2968
316 D A -2.1314
317 D A 0.0000
318 C A 0.0874
319 A A 0.0425
320 T A 0.0000
321 A A 0.0000
322 V A 0.7295
323 C A 0.8244
324 F A 0.5464
325 H A -0.0666
326 G A -0.0796
327 A A -0.0250
328 T A -0.2227
329 C A -0.2267
330 H A -0.9831
331 D A -1.6580
332 R A -1.1310
333 V A 0.4000
334 A A 0.1246
335 S A 0.0000
336 F A 0.0000
337 Y A 0.4059
338 C A 0.0000
339 A A 0.2198
340 C A 0.0369
341 P A -0.0370
342 M A 0.3219
343 G A -0.7126
344 K A -1.1306
345 T A -0.6030
346 G A 0.0000
347 L A 0.8451
348 L A 0.0000
349 C A 0.0000
350 H A 0.0000
351 L A 0.0000
352 D A 0.0000
353 D A -1.2170
354 A A 0.0000
355 C A 0.0000
356 V A 1.0298
357 S A -0.0889
358 N A -0.1689
359 P A 0.1636
360 C A -0.0938
361 H A -1.0913
362 E A -2.3424
363 D A -2.1416
364 A A -0.4303
365 I A 1.5487
366 C A 1.0972
367 D A -0.0050
368 T A 0.0000
369 N A -1.1815
370 P A -0.8265
371 V A 0.0000
372 N A -0.7467
373 G A 0.0000
374 R A -1.7759
375 A A 0.0000
376 I A 0.2873
377 C A 0.0000
378 T A 0.0716
379 C A 0.0000
380 P A -0.9643
381 P A -1.1772
382 G A -0.7033
383 F A -0.9440
384 T A 0.0000
385 G A -0.5624
386 G A -0.7418
387 A A -0.8625
388 C A 0.0000
389 D A -2.1847
390 Q A 0.0000
391 D A 0.0000
392 V A -0.1037
393 D A 0.0000
394 E A 0.0000
395 C A 1.0167
396 S A 0.7570
397 I A 1.3307
398 G A -0.2212
399 A A -0.6151
400 N A -1.6418
401 P A -1.3111
402 C A 0.0000
403 E A -2.0520
404 H A -1.9434
405 L A -1.2842
406 G A -1.0449
407 R A -1.0167
408 C A 0.0000
409 V A 0.0000
410 N A 0.0000
411 T A 0.0000
412 Q A -0.3492
413 G A -0.5705
414 S A 0.4133
415 F A 1.4049
416 L A 0.3932
417 C A 0.0000
418 Q A -1.3925
419 C A 0.0000
420 G A -0.9955
421 R A -1.1960
422 G A 0.0000
423 Y A 0.0000
424 T A -1.1544
425 G A -0.8331
426 P A -0.6703
427 R A 0.0000
428 C A -0.4730
429 E A -1.5336
430 T A -1.7532
431 D A -2.2760
432 V A -1.2213
433 N A -1.4322
434 E A 0.0000
435 C A 0.0000
436 L A 0.5770
437 S A 0.1041
438 G A 0.0000
439 P A 0.1115
440 C A -0.2072
441 R A -1.8232
442 N A -1.8537
443 Q A -0.4415
444 A A 0.4593
445 T A 1.0204
446 C A 0.0000
447 L A 1.3343
448 D A -0.4960
449 R A -1.3289
450 I A -0.2179
451 G A -0.9734
452 Q A -0.7711
453 F A 0.4764
454 T A 0.7834
455 C A 1.5796
456 I A 2.7711
457 C A 1.3539
458 M A 1.3887
459 A A 0.6003
460 G A 0.2252
461 F A 1.7650
462 T A 0.6017
463 G A 0.8193
464 T A 0.6761
465 Y A 1.2754
466 C A 0.8462
467 E A -0.1647
468 V A 0.0000
469 D A -1.3764
470 I A -0.5801
471 D A -2.3997
472 E A -2.2756
473 C A -1.8930
474 Q A -1.8783
475 S A -0.7753
476 S A -0.1909
477 P A -0.1736
478 C A 0.4531
479 V A 1.2648
480 N A 0.2470
481 G A -0.2786
482 G A -0.5008
483 V A -0.2325
484 C A -1.3000
485 K A -2.7095
486 D A -3.0284
487 R A -1.5397
488 V A 0.2761
489 N A -1.4730
490 G A -1.2749
491 F A -1.1202
492 S A -1.1005
493 C A 0.0000
494 T A 0.0142
495 C A 0.0000
496 P A -0.0655
497 S A -0.4129
498 G A -0.6756
499 F A 0.6991
500 S A -0.3469
501 G A -0.4040
502 S A -0.4739
503 T A -0.4907
504 C A -0.3556
505 Q A -1.0739
506 L A -0.9871
507 D A -2.4301
508 V A -1.9430
509 D A -2.5115
510 E A -2.1582
511 C A 0.0000
512 A A -0.6531
513 S A -0.6848
514 T A -0.8344
515 P A -1.2705
516 C A -2.1371
517 R A -3.0589
518 N A -3.1122
519 G A -1.9818
520 A A -1.9425
521 K A -2.9258
522 C A -1.8183
523 V A -1.1628
524 D A -2.0127
525 Q A -2.0866
526 P A -1.8172
527 D A -2.8771
528 G A -1.7257
529 Y A -1.4085
530 E A -2.1022
531 C A -2.0081
532 R A -3.0740
533 C A 0.0000
534 A A 0.0000
535 E A -2.4503
536 G A -1.5531
537 F A -1.4672
538 E A -2.5401
539 G A -2.1477
540 T A -0.8523
541 L A 0.0429
542 C A -1.4506
543 D A -2.7051
544 R A -3.3115
545 N A -2.4250
546 V A -0.6478
547 D A -1.9091
548 D A -2.0780
549 C A -0.7266
550 S A -1.1339
551 P A -1.4947
552 D A -2.4680
553 P A -1.8850
554 C A -1.9291
555 H A -1.9057
556 H A -1.5339
557 G A -1.4823
558 R A -1.4444
559 C A 0.5168
560 V A 1.2932
561 D A -0.0232
562 G A 0.6681
563 I A 1.7743
564 A A 0.9651
565 S A 1.1074
566 F A 1.9210
567 S A 1.0395
568 C A 0.1015
569 A A -0.6227
570 C A 0.0000
571 A A 0.0000
572 P A -0.9189
573 G A -0.4645
574 Y A -0.5165
575 T A -0.8765
576 G A -1.1309
577 T A -1.1279
578 R A -2.4646
579 C A -2.0889
580 E A -2.4275
581 S A -1.7496
582 Q A -1.2837
583 V A -1.0979
584 D A -1.5054
585 E A -1.0761
586 C A -0.8261
587 R A -2.1473
588 S A -2.3071
589 Q A -2.1312
590 P A -2.4470
591 C A -2.8863
592 R A -2.8211
593 H A -2.4995
594 G A -2.2245
595 G A -2.4646
596 K A -2.4606
597 C A -0.7917
598 L A 0.7021
599 D A -0.0941
600 L A 1.3387
601 V A 1.0490
602 D A -1.3657
603 K A -1.5826
604 Y A -0.7665
605 L A -0.3979
606 C A 0.0000
607 R A -2.4257
608 C A 0.0000
609 P A -1.3414
610 S A -1.6789
611 G A -1.6180
612 T A -1.2584
613 T A -1.4653
614 G A -1.0899
615 V A -0.7675
616 N A -1.8634
617 C A 0.0000
618 E A -2.6712
619 V A 0.0000
620 N A -1.9356
621 I A -1.7652
622 D A -2.7151
623 D A -2.2145
624 C A -1.8279
625 A A -1.3225
626 S A -1.4616
627 N A -1.8954
628 P A -0.9324
629 C A -0.6991
630 T A -0.0771
631 F A 0.7135
632 G A 0.3163
633 V A 0.6446
634 C A -0.2963
635 R A -2.0286
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1995 F A -0.2076
1996 A A -0.3022
1997 N A 0.0000
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2260 P A -0.4204
2261 P A 0.1328
2262 S A 0.2926
2263 L A 1.4282
2264 S A 0.4690
2265 D A -0.0201
2266 W A 0.7574
2267 S A -0.1118
2268 E A -0.9816
2269 S A -0.6697
2270 T A -0.6897
2271 P A -0.6649
2272 S A -0.7168
2273 P A -0.5036
2274 A A -0.6266
2275 T A -0.2330
2276 A A -0.1547
2277 T A -0.1341
2278 G A -0.5445
2279 A A -0.0867
2280 M A 0.0039
2281 A A -0.2899
2282 T A 0.0899
2283 T A 0.3410
2284 T A 0.4077
2285 G A 0.1620
2286 A A 0.5107
2287 L A 1.1968
2288 P A 0.2420
2289 A A -0.0880
2290 Q A -0.7089
2291 P A -0.2927
2292 L A 0.6043
2293 P A 0.0333
2294 L A 0.2251
2295 S A -0.1054
2296 V A 0.0000
2297 P A -0.4251
2298 S A -0.4443
2299 S A -0.4734
2300 L A 0.0000
2301 A A 0.0000
2302 Q A -1.2742
2303 A A -0.6770
2304 Q A -0.8541
2305 T A -0.4942
2306 Q A -0.0818
2307 L A 0.8388
2308 G A -0.0370
2309 P A -0.3200
2310 Q A -0.9340
2311 P A -1.0444
2312 E A -1.3876
2313 V A 0.3080
2314 T A 0.0000
2315 P A -0.8039
2316 K A -0.7238
2317 R A -0.5240
2318 Q A 0.1630
2319 V A 2.0332
2320 L A 2.1663
2321 A A 0.8436
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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, -0.5884 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_7 -0.5884 View CSV PDB
model_5 -0.5945 View CSV PDB
model_6 -0.6008 View CSV PDB
model_11 -0.6008 View CSV PDB
model_9 -0.6028 View CSV PDB
model_3 -0.6163 View CSV PDB
model_4 -0.6172 View CSV PDB
CABS_average -0.6175 View CSV PDB
model_2 -0.6232 View CSV PDB
model_8 -0.6268 View CSV PDB
model_10 -0.6381 View CSV PDB
model_1 -0.6408 View CSV PDB
model_0 -0.6604 View CSV PDB
input -0.7638 View CSV PDB