Project name: C466S_4D

Status: done

Started: 2026-05-14 00:40:22
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYSEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:30:06)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (12:41:56)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (12:42:39)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (12:43:24)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (12:44:07)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (12:44:51)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (12:45:35)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (12:46:18)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (12:47:02)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (12:47:45)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (12:48:29)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (12:49:12)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (12:49:56)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (12:50:39)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (12:52:04)
[INFO]       Main:     Simulation completed successfully.                                          (12:52:46)
Show buried residues

Minimal score value
-4.766
Maximal score value
4.1927
Average score
-0.5823
Total score value
-1351.524

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 -0.8365
2 G A -0.6883
3 P A -0.8558
4 G A -0.9650
5 A A -1.0872
6 R A -2.2866
7 G A -2.0946
8 R A -2.8945
9 R A -4.4110
10 R A -4.7452
11 R A -4.6524
12 R A -4.5438
13 R A -3.4579
14 P A -1.8104
15 M A 0.1453
16 S A 0.0846
17 P A -0.4382
18 P A -0.5276
19 P A -0.7181
20 P A -0.8139
21 P A -0.4715
22 P A -0.3686
23 P A 0.0551
24 V A 0.8186
25 R A 0.0720
26 A A 0.6905
27 L A 1.6309
28 P A 1.2580
29 L A 2.2597
30 L A 1.4930
31 L A 0.7306
32 L A -0.3193
33 L A 0.0000
34 A A -1.4793
35 G A -1.1928
36 P A -1.2671
37 G A -0.9172
38 A A -0.1756
39 A A -0.1333
40 A A -0.3477
41 P A -0.1906
42 P A -0.7537
43 C A -0.3955
44 L A -0.4286
45 D A -1.7876
46 G A -1.2812
47 S A -0.7375
48 P A -0.8993
49 C A 0.0000
50 A A -0.8750
51 N A -1.0338
52 G A -1.1211
53 G A -1.0324
54 R A -0.6861
55 C A 0.1722
56 T A -0.1851
57 Q A -1.0697
58 L A 0.0967
59 P A -0.7027
60 S A -1.3099
61 R A -2.4551
62 E A -2.0939
63 A A 0.0000
64 A A -0.2485
65 C A 0.0000
66 L A 1.6824
67 C A 0.0000
68 P A -0.1313
69 P A -0.5624
70 G A -0.0991
71 W A -0.3051
72 V A 0.0000
73 G A 0.0000
74 E A -1.6984
75 R A -2.0206
76 C A 0.0000
77 Q A -1.0821
78 L A -1.1846
79 E A -2.0091
80 D A -1.4817
81 P A -0.9011
82 C A -0.1055
83 H A -0.8584
84 S A -0.5719
85 G A -0.5849
86 P A -0.9399
87 C A -0.6492
88 A A -0.5385
89 G A -0.7108
90 R A -0.8754
91 G A -0.2970
92 V A 0.0000
93 C A 0.0000
94 Q A 0.0423
95 S A 0.0000
96 S A -0.0657
97 V A 0.0000
98 V A 0.2440
99 A A -0.6028
100 G A -0.5206
101 T A -0.6608
102 A A -0.9762
103 R A -1.5374
104 F A -0.9451
105 S A -0.9424
106 C A 0.0000
107 R A -0.8565
108 C A 0.0000
109 P A 0.0000
110 R A -1.2200
111 G A -0.6856
112 F A -0.4361
113 R A -0.9145
114 G A 0.0000
115 P A -1.1115
116 D A -1.8459
117 C A -1.0823
118 S A -0.7038
119 L A -0.6815
120 P A -0.6030
121 D A -1.0536
122 P A 0.0000
123 C A 0.0000
124 L A -0.2398
125 S A -0.3239
126 S A -0.4807
127 P A -0.7185
128 C A -0.8322
129 A A -0.5275
130 H A -0.9132
131 G A -0.9749
132 A A -1.1820
133 R A -2.0319
134 C A 0.0000
135 S A 0.0000
136 V A 0.0000
137 G A 0.0000
138 P A -1.3907
139 D A -2.1888
140 G A -2.0665
141 R A -1.8804
142 F A 0.0000
143 L A -0.3300
144 C A 0.0000
145 S A 0.0000
146 C A -0.5804
147 P A -0.6391
148 P A -0.2768
149 G A -0.4674
150 Y A 0.0443
151 Q A -1.0081
152 G A -1.0837
153 R A -1.2261
154 S A -0.7005
155 C A -0.4132
156 R A -1.9034
157 S A -1.4558
158 D A -1.4077
159 V A -0.9151
160 D A -1.4722
161 E A -0.9645
162 C A -0.9679
163 R A -1.6085
164 V A 0.1325
165 G A -0.9884
166 E A -2.1138
167 P A -1.8435
168 C A -1.9101
169 R A -2.9095
170 H A -1.9120
171 G A -1.3603
172 G A -1.0350
173 T A -0.6310
174 C A -0.5370
175 L A 0.2097
176 N A -0.6008
177 T A -0.3758
178 P A -0.5736
179 G A 0.0000
180 S A -0.1716
181 F A -0.0129
182 R A -0.4810
183 C A 0.0000
184 Q A -0.7862
185 C A 0.0000
186 P A -0.4973
187 A A -0.3921
188 G A -0.5472
189 Y A 0.1048
190 T A -0.4945
191 G A -0.6509
192 P A -0.8220
193 L A -0.5982
194 C A -1.6454
195 E A -2.6959
196 N A -2.2666
197 P A 0.0000
198 A A -0.3403
199 V A 0.3235
200 P A -0.3242
201 C A 0.0000
202 A A -0.4279
203 P A -0.6555
204 S A -0.6758
205 P A -1.1270
206 C A -0.7071
207 R A -1.1498
208 N A -1.4447
209 G A -0.9080
210 G A -0.7918
211 T A -0.9595
212 C A -1.7164
213 R A -3.0396
214 Q A -2.6840
215 S A -2.0198
216 G A -1.9807
217 D A -2.1808
218 L A -1.4307
219 T A -1.5103
220 Y A 0.0000
221 D A -3.2029
222 C A 0.0000
223 A A -0.7138
224 C A 0.0000
225 L A 1.0661
226 P A 0.1259
227 G A -0.2139
228 F A -0.0144
229 E A -1.6077
230 G A -2.1730
231 Q A -2.4612
232 N A -2.6169
233 C A 0.0000
234 E A -1.4527
235 V A -0.6405
236 N A -0.9228
237 V A 0.0000
238 D A -1.2914
239 D A -1.6192
240 C A 0.0000
241 P A -1.2677
242 G A -1.4033
243 H A -1.7545
244 R A -1.7658
245 C A 0.0000
246 L A 0.0000
247 N A 0.0000
248 G A 0.0000
249 G A -1.2454
250 T A 0.0000
251 C A 0.0000
252 V A -1.1301
253 D A -2.0286
254 G A -1.2481
255 V A -0.2590
256 N A -1.6032
257 T A -1.5577
258 Y A 0.0000
259 N A -1.1800
260 C A 0.0000
261 Q A -0.4084
262 C A 0.0000
263 P A -0.5230
264 P A 0.0000
265 E A -1.0445
266 W A 0.0000
267 T A -0.5191
268 G A 0.0000
269 Q A -1.2052
270 F A 0.0000
271 C A 0.0000
272 T A -0.0714
273 E A -0.6323
274 D A -0.5980
275 V A -0.6614
276 D A -1.8173
277 E A 0.0000
278 C A -0.7679
279 Q A -1.3478
280 L A -0.0938
281 Q A -0.3096
282 P A 0.1075
283 N A 0.0000
284 A A 0.0000
285 C A 0.0000
286 H A 0.0677
287 N A 0.0000
288 G A 0.0000
289 G A 0.0000
290 T A 0.0000
291 C A 0.0000
292 F A 0.0735
293 N A -0.5267
294 T A 0.0000
295 L A -0.4079
296 G A 0.0000
297 G A 0.0000
298 H A 0.0000
299 S A 0.0000
300 C A 0.0000
301 V A 0.0000
302 C A 0.0000
303 V A 0.0000
304 N A -0.1218
305 G A 0.0000
306 W A 0.0000
307 T A -0.6247
308 G A -0.1697
309 E A 0.0000
310 S A 0.1591
311 C A -0.3656
312 S A -0.5376
313 Q A -0.8297
314 N A -0.7667
315 I A 0.0732
316 D A -0.1292
317 D A 0.0000
318 C A 0.0000
319 A A 0.7096
320 T A -0.0437
321 A A 0.4850
322 V A 1.4651
323 C A 0.0000
324 F A 2.0710
325 H A 0.0000
326 G A 0.0000
327 A A 0.0000
328 T A -0.9833
329 C A 0.0000
330 H A 0.1845
331 D A 0.0000
332 R A 0.2278
333 V A 1.4921
334 A A 0.8749
335 S A 0.9224
336 F A 1.6839
337 Y A 1.4000
338 C A 0.0000
339 A A 0.0000
340 C A 0.0000
341 P A -0.6466
342 M A -0.7364
343 G A 0.0000
344 K A 0.0000
345 T A 0.0000
346 G A 0.0838
347 L A 0.9656
348 L A 0.0000
349 C A 1.5437
350 H A 0.0000
351 L A 0.3518
352 D A -0.5405
353 D A 0.0000
354 A A 0.0000
355 C A 0.0000
356 V A -0.0766
357 S A -1.1230
358 N A -2.2354
359 P A -1.7656
360 C A -1.1820
361 H A -2.2380
362 E A -2.8304
363 D A -2.4779
364 A A -0.9217
365 I A 0.4641
366 C A 0.5114
367 D A 0.0000
368 T A 0.1098
369 N A 0.0000
370 P A -0.2256
371 V A -0.6697
372 N A -1.5447
373 G A -0.8982
374 R A 0.0000
375 A A 0.0000
376 I A 0.0000
377 C A -0.8274
378 T A 0.0000
379 C A 0.0000
380 P A -0.8695
381 P A -0.7782
382 G A -0.2992
383 F A 0.0000
384 T A 0.0000
385 G A 0.0000
386 G A 0.0290
387 A A -0.3085
388 C A 0.0000
389 D A -0.4957
390 Q A -0.4255
391 D A -0.7261
392 V A 0.4753
393 D A -1.3779
394 E A -1.7573
395 C A -1.1867
396 S A -1.1624
397 I A -0.9312
398 G A -0.8803
399 A A -0.7280
400 N A -1.3711
401 P A -1.1510
402 C A 0.0000
403 E A -1.5980
404 H A -0.6532
405 L A -0.2987
406 G A -1.0421
407 R A -1.6497
408 C A -1.0868
409 V A -1.5188
410 N A -2.0825
411 T A -1.7857
412 Q A -1.7300
413 G A -1.3350
414 S A -0.9509
415 F A 0.0000
416 L A 0.0000
417 C A 0.0000
418 Q A 0.0000
419 C A 0.0000
420 G A -0.6145
421 R A -0.4188
422 G A 0.0000
423 Y A 0.0000
424 T A -0.7399
425 G A -1.1749
426 P A -1.2330
427 R A -1.4901
428 C A 0.0000
429 E A -2.2253
430 T A -1.2165
431 D A 0.0000
432 V A -0.0348
433 N A -0.5331
434 E A 0.0000
435 C A 0.1729
436 L A 0.5991
437 S A 0.0000
438 G A 0.0000
439 P A 0.0000
440 C A 0.0000
441 R A -0.8487
442 N A -1.4400
443 Q A -0.5493
444 A A 0.5235
445 T A 0.8555
446 C A 0.7930
447 L A 0.8276
448 D A -1.5934
449 R A -1.8153
450 I A -0.0348
451 G A -0.8810
452 Q A -1.4140
453 F A 0.0000
454 T A 0.0558
455 C A 1.1471
456 I A 2.2853
457 C A 0.9130
458 M A 0.3859
459 A A -0.5553
460 G A -0.8354
461 F A 0.0000
462 T A 0.0000
463 G A -0.2213
464 T A -0.3525
465 Y A -0.8357
466 S A -1.1156
467 E A -2.2486
468 V A -1.7429
469 D A -2.6048
470 I A 0.0000
471 D A -3.2555
472 E A -3.0121
473 C A -1.6618
474 Q A -1.6321
475 S A -0.3257
476 S A 0.2746
477 P A 0.2329
478 C A 0.9722
479 V A 1.3827
480 N A -0.3042
481 G A -0.3440
482 G A 0.7933
483 V A 1.5373
484 C A 0.1630
485 K A -2.0549
486 D A -2.9906
487 R A -2.8860
488 V A -1.4228
489 N A 0.0000
490 G A -1.1323
491 F A -1.1294
492 S A -0.5454
493 C A 0.6870
494 T A 0.5278
495 C A 0.0000
496 P A 0.3591
497 S A 0.0020
498 G A 0.1582
499 F A 1.4069
500 S A 0.3678
501 G A -0.4514
502 S A -0.3358
503 T A 0.1049
504 C A 0.0365
505 Q A -0.4826
506 L A 0.3492
507 D A -0.8469
508 V A 0.0905
509 D A -1.5293
510 E A -1.6160
511 C A -0.4709
512 A A -0.3242
513 S A -0.8518
514 T A -0.9715
515 P A -0.8302
516 C A -0.9853
517 R A -2.1445
518 N A -2.1714
519 G A -1.7097
520 A A -1.8705
521 K A -2.2866
522 C A -1.3384
523 V A -0.9788
524 D A -1.8668
525 Q A -2.2184
526 P A -1.8602
527 D A -2.3404
528 G A -1.4739
529 Y A -0.9762
530 E A -1.9125
531 C A -1.4365
532 R A -2.4153
533 C A -1.8111
534 A A -0.9555
535 E A -1.1254
536 G A -0.7073
537 F A 0.1831
538 E A -1.3427
539 G A -0.7345
540 T A 0.1113
541 L A 1.3902
542 C A 0.5365
543 D A -0.0714
544 R A -0.5366
545 N A -1.2818
546 V A -0.7778
547 D A -1.7738
548 D A -0.9808
549 C A -0.4170
550 S A -0.6801
551 P A -1.4974
552 D A -2.3629
553 P A -1.6133
554 C A -1.8802
555 H A -2.0791
556 H A -2.0533
557 G A -1.7850
558 R A -1.8730
559 C A -0.1771
560 V A 1.2106
561 D A 0.0000
562 G A 0.9312
563 I A 0.7154
564 A A 0.0888
565 S A 0.4015
566 F A 0.9595
567 S A 0.6154
568 C A -0.3222
569 A A -0.6380
570 C A 0.0000
571 A A -1.1303
572 P A -0.7229
573 G A -0.7770
574 Y A -0.6957
575 T A -0.8108
576 G A -0.9027
577 T A -1.1305
578 R A -2.3015
579 C A 0.0000
580 E A -1.7554
581 S A -1.0868
582 Q A -0.5599
583 V A -0.7338
584 D A -2.0352
585 E A -1.2983
586 C A 0.0000
587 R A -1.9023
588 S A -1.9133
589 Q A -2.3379
590 P A -1.8567
591 C A -2.0750
592 R A -2.1610
593 H A -1.7138
594 G A -2.3061
595 G A -2.1612
596 K A -2.1956
597 C A -0.9901
598 L A 0.5464
599 D A -0.0911
600 L A 1.2887
601 V A 1.1336
602 D A -0.7366
603 K A -0.5467
604 Y A 0.5585
605 L A 1.1877
606 C A -0.4955
607 R A -2.0031
608 C A 0.0000
609 P A -1.3167
610 S A -0.6827
611 G A -0.5151
612 T A -0.2066
613 T A -0.0684
614 G A -0.1475
615 V A 0.7981
616 N A -0.7711
617 C A -0.8938
618 E A -1.0213
619 V A -0.5968
620 N A 0.0000
621 I A 0.2362
622 D A -1.7103
623 D A -1.4118
624 C A 0.0000
625 A A -0.7102
626 S A -0.7488
627 N A -0.8423
628 P A -0.8080
629 C A 0.3927
630 T A 0.7050
631 F A 2.4946
632 G A 2.1279
633 V A 2.2203
634 C A 0.5668
635 R A -1.4826
636 D A -1.6704
637 G A -1.4152
638 I A -0.8019
639 N A -1.6206
640 R A -2.2786
641 Y A -1.0350
642 D A -0.4891
643 C A 0.0000
644 V A 2.3316
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2263 L A 0.3280
2264 S A -0.4236
2265 D A -0.7059
2266 W A 0.0000
2267 S A -0.1499
2268 E A 0.0000
2269 S A -0.4783
2270 T A 0.0000
2271 P A -0.5016
2272 S A -0.4458
2273 P A -0.4306
2274 A A -0.1699
2275 T A -0.3550
2276 A A -0.2808
2277 T A -0.5032
2278 G A -0.6727
2279 A A -0.4217
2280 M A 0.0000
2281 A A -0.1660
2282 T A 0.0000
2283 T A -0.0942
2284 T A -0.0327
2285 G A -0.0186
2286 A A 0.1547
2287 L A 0.0939
2288 P A -0.4363
2289 A A -0.9065
2290 Q A -1.3643
2291 P A -0.8027
2292 L A -0.7002
2293 P A -0.4311
2294 L A 0.0000
2295 S A -0.3923
2296 V A 0.0102
2297 P A -0.2655
2298 S A -0.0074
2299 S A 0.1859
2300 L A 1.0640
2301 A A 0.0190
2302 Q A -1.0851
2303 A A -1.0846
2304 Q A -1.5773
2305 T A -1.0547
2306 Q A -0.6749
2307 L A 1.2574
2308 G A 0.7331
2309 P A 0.4152
2310 Q A -0.2354
2311 P A -0.5064
2312 E A 0.0000
2313 V A 1.0222
2314 T A 0.0000
2315 P A -1.4776
2316 K A -2.5707
2317 R A -2.4370
2318 Q A 0.0000
2319 V A 1.2563
2320 L A 1.1366
2321 A A 1.3583
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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, -0.5823 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_10 -0.5823 View CSV PDB
model_8 -0.5865 View CSV PDB
model_9 -0.5869 View CSV PDB
model_3 -0.6034 View CSV PDB
model_0 -0.6069 View CSV PDB
model_6 -0.6193 View CSV PDB
CABS_average -0.6281 View CSV PDB
model_1 -0.6315 View CSV PDB
model_2 -0.6484 View CSV PDB
model_5 -0.6541 View CSV PDB
model_11 -0.6574 View CSV PDB
model_7 -0.6615 View CSV PDB
model_4 -0.6992 View CSV PDB
input -0.7637 View CSV PDB