Project name: R169C_4D

Status: done

Started: 2026-05-08 01:42:25
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCCHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:23:20)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (12:15:42)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (12:16:30)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (12:17:17)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (12:18:02)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (12:18:46)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (12:19:29)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (12:20:13)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (12:20:56)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (12:21:40)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (12:22:26)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (12:23:13)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (12:23:59)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (12:24:45)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (12:26:14)
[INFO]       Main:     Simulation completed successfully.                                          (12:27:00)
Show buried residues

Minimal score value
-4.7851
Maximal score value
5.6814
Average score
-0.5492
Total score value
-1274.6204

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 1.0952
2 G A 0.1220
3 P A 0.2644
4 G A -0.6688
5 A A 0.0000
6 R A -2.3875
7 G A -2.0875
8 R A -2.7527
9 R A -3.9556
10 R A -4.5678
11 R A -4.7851
12 R A -4.3259
13 R A -3.6160
14 P A -1.9934
15 M A -1.4309
16 S A -1.3779
17 P A -1.9374
18 P A -1.1702
19 P A -1.1365
20 P A -1.1699
21 P A -0.6796
22 P A -1.3671
23 P A -0.8489
24 V A -0.0835
25 R A -1.5075
26 A A -0.0254
27 L A 0.8721
28 P A 1.0306
29 L A 2.1342
30 L A 2.2062
31 L A 2.5850
32 L A 2.3138
33 L A 2.4791
34 A A 1.1664
35 G A 0.1745
36 P A 0.4040
37 G A 0.0000
38 A A -0.1053
39 A A 0.0014
40 A A 0.0292
41 P A -0.2357
42 P A -0.9364
43 C A 0.0000
44 L A -0.1326
45 D A -1.6095
46 G A -0.9972
47 S A -0.8623
48 P A -0.2896
49 C A 0.0000
50 A A -0.3538
51 N A -1.0092
52 G A -0.8905
53 G A -0.5871
54 R A 0.0836
55 C A 0.4358
56 T A -0.6006
57 Q A -2.0205
58 L A 0.0000
59 P A -1.3667
60 S A -1.4026
61 R A -2.3623
62 E A -2.5734
63 A A -1.2444
64 A A 0.0000
65 C A 0.0000
66 L A 1.4478
67 C A 0.4787
68 P A -0.0902
69 P A -0.9952
70 G A -1.0828
71 W A -0.7005
72 V A -0.5031
73 G A -0.4034
74 E A -0.7934
75 R A -1.8625
76 C A 0.0000
77 Q A -1.1671
78 L A 0.0000
79 E A -2.2794
80 D A -1.9529
81 P A -1.3391
82 C A 0.0000
83 H A -1.1656
84 S A -0.7668
85 G A -0.9432
86 P A -0.9055
87 C A 0.0000
88 A A -0.8050
89 G A -1.0547
90 R A -1.8499
91 G A -0.8105
92 V A 0.0823
93 C A 0.0000
94 Q A -1.2976
95 S A -0.9853
96 S A -0.5978
97 V A -0.3224
98 V A 0.5753
99 A A -0.0215
100 G A -0.5039
101 T A -0.3336
102 A A -0.7643
103 R A -1.3039
104 F A -0.2981
105 S A -0.7912
106 C A -1.2492
107 R A -2.1863
108 C A 0.0000
109 P A -1.3572
110 R A -1.8961
111 G A -0.6092
112 F A 0.1215
113 R A -1.1555
114 G A -1.6940
115 P A -1.5524
116 D A -2.0182
117 C A -1.3663
118 S A -0.6032
119 L A 0.7050
120 P A -0.3359
121 D A -0.4530
122 P A -0.0367
123 C A 0.0000
124 L A 1.4262
125 S A 0.4728
126 S A 0.1999
127 P A -0.3039
128 C A -0.5784
129 A A -1.2009
130 H A -1.7419
131 G A -1.5236
132 A A -1.5093
133 R A -2.0584
134 C A -0.5516
135 S A -0.1474
136 V A -0.3437
137 G A -1.2158
138 P A -1.5902
139 D A -2.5638
140 G A -1.6948
141 R A -1.8132
142 F A 0.2877
143 L A 0.5453
144 C A -0.2170
145 S A -0.6806
146 C A 0.0000
147 P A 0.0000
148 P A -0.7516
149 G A -0.1425
150 Y A -0.4362
151 Q A -1.9075
152 G A -1.7575
153 R A -1.5316
154 S A -0.8511
155 C A 0.0000
156 R A -2.4929
157 S A -1.9007
158 D A -1.5900
159 V A -1.2655
160 D A -2.2512
161 E A -1.6520
162 C A -1.1332
163 R A -1.8755
164 V A -0.0895
165 G A -0.7560
166 E A -1.7514
167 P A -1.1980
168 C A -1.0830
169 C A -0.8601
170 H A -0.8596
171 G A -0.7438
172 G A -0.7475
173 T A -0.7387
174 C A -0.3689
175 L A -0.3419
176 N A -1.1010
177 T A -1.0311
178 P A -1.2362
179 G A -1.0417
180 S A -0.8167
181 F A -0.6147
182 R A -1.0774
183 C A 0.0000
184 Q A -1.2690
185 C A 0.0000
186 P A -0.6168
187 A A -0.5267
188 G A -0.1409
189 Y A -0.2949
190 T A -0.9968
191 G A -0.8058
192 P A -0.4703
193 L A 0.5059
194 C A 0.0000
195 E A -2.2692
196 N A -2.1400
197 P A -0.9944
198 A A -0.4189
199 V A -0.0971
200 P A -0.5870
201 C A -0.4502
202 A A -0.8382
203 P A -0.9035
204 S A -0.7993
205 P A -1.3298
206 C A -1.9515
207 R A -2.3979
208 N A -1.4388
209 G A -1.3023
210 G A -1.6988
211 T A -1.5508
212 C A 0.0000
213 R A -2.2134
214 Q A -1.4282
215 S A -1.3863
216 G A -1.4502
217 D A -1.6333
218 L A -0.5008
219 T A -0.4373
220 Y A -0.3173
221 D A -1.6533
222 C A -1.4341
223 A A -0.7553
224 C A -0.4747
225 L A 0.5293
226 P A 0.1748
227 G A 0.3327
228 F A 0.1603
229 E A -0.8841
230 G A -1.3242
231 Q A -1.8251
232 N A -1.7955
233 C A 0.0000
234 E A -1.3543
235 V A 0.8066
236 N A 0.8314
237 V A 1.5898
238 D A -0.1214
239 D A -1.7280
240 C A -1.1246
241 P A -0.7957
242 G A -1.3546
243 H A -1.5696
244 R A -2.5686
245 C A 0.0000
246 L A -0.2583
247 N A -1.5974
248 G A -1.6175
249 G A -1.1289
250 T A 0.0000
251 C A 0.0000
252 V A 1.1815
253 D A 0.0000
254 G A 1.1524
255 V A 1.7171
256 N A 0.3163
257 T A 0.6210
258 Y A 0.6921
259 N A -0.6944
260 C A -0.7077
261 Q A -1.4376
262 C A 0.0000
263 P A -1.3921
264 P A -1.7209
265 E A -2.2223
266 W A -2.1878
267 T A -1.4520
268 G A -1.4050
269 Q A -1.2017
270 F A 0.6216
271 C A 0.0000
272 T A -1.4829
273 E A -2.3885
274 D A -2.0161
275 V A -1.0393
276 D A -2.1639
277 E A -2.2700
278 C A 0.0000
279 Q A -1.6654
280 L A -0.6109
281 Q A 0.0000
282 P A -1.5657
283 N A -1.4263
284 A A -0.5804
285 C A -0.0005
286 H A 0.0000
287 N A -0.7500
288 G A -0.4191
289 G A 0.2570
290 T A 0.0000
291 C A 0.0000
292 F A 0.7250
293 N A -0.5092
294 T A -0.0236
295 L A 0.7766
296 G A -0.5343
297 G A -0.5123
298 H A -0.8813
299 S A -0.1129
300 C A 0.5244
301 V A 1.1291
302 C A 0.2537
303 V A 0.0000
304 N A 0.0000
305 G A -0.5544
306 W A -0.4609
307 T A -1.3392
308 G A -1.1330
309 E A -2.6513
310 S A -1.4705
311 C A -1.1598
312 S A 0.0000
313 Q A 0.0000
314 N A 0.0000
315 I A -1.0790
316 D A -1.5831
317 D A 0.0000
318 C A 0.3715
319 A A -0.1238
320 T A 0.2787
321 A A 1.2756
322 V A 2.0895
323 C A 1.6063
324 F A 1.7242
325 H A 0.0542
326 G A -0.2305
327 A A 0.4766
328 T A 0.0000
329 C A 0.5904
330 H A -0.5233
331 D A -0.9493
332 R A -1.0814
333 V A 0.0000
334 A A -0.5984
335 S A 0.0000
336 F A 0.0000
337 Y A 0.0457
338 C A 0.0000
339 A A 0.5898
340 C A 0.2987
341 P A -0.0298
342 M A 0.3373
343 G A -0.6262
344 K A -1.3073
345 T A -0.6965
346 G A 0.1148
347 L A 0.7650
348 L A 1.3353
349 C A 1.0366
350 H A -0.4882
351 L A -0.8899
352 D A -2.1380
353 D A -1.1748
354 A A -0.5927
355 C A 0.2392
356 V A 1.2555
357 S A 0.1781
358 N A -0.2823
359 P A -0.6297
360 C A -0.9819
361 H A -2.0856
362 E A -2.8817
363 D A -2.5501
364 A A -1.2464
365 I A 0.2546
366 C A 0.0000
367 D A -0.5216
368 T A -0.4150
369 N A -0.0074
370 P A 0.6885
371 V A 1.4114
372 N A 0.0000
373 G A -0.3742
374 R A -0.7698
375 A A -0.4009
376 I A -0.1586
377 C A 0.2176
378 T A -0.1743
379 C A 0.0000
380 P A -0.9363
381 P A -0.5013
382 G A -0.6555
383 F A 0.0000
384 T A 0.0000
385 G A 0.0000
386 G A 0.0000
387 A A 0.0000
388 C A -0.6466
389 D A -1.7256
390 Q A 0.0000
391 D A -1.4605
392 V A 0.0000
393 D A -0.7789
394 E A 0.0000
395 C A 0.2075
396 S A -0.0550
397 I A -0.0227
398 G A -0.3056
399 A A -0.6288
400 N A -0.6588
401 P A -1.1372
402 C A -1.5435
403 E A -2.4687
404 H A -1.7734
405 L A 0.1210
406 G A 0.0000
407 R A 0.0000
408 C A 0.0000
409 V A -0.2155
410 N A 0.0000
411 T A -0.2799
412 Q A -0.9563
413 G A -1.0301
414 S A -0.1968
415 F A 0.8214
416 L A 1.3068
417 C A 0.0000
418 Q A 0.0000
419 C A -0.2459
420 G A -1.1247
421 R A -1.4247
422 G A -0.5291
423 Y A 0.5121
424 T A -0.5254
425 G A -1.1453
426 P A -1.8834
427 R A -2.3536
428 C A -1.3279
429 E A -1.2476
430 T A -0.8014
431 D A -1.0285
432 V A -0.3051
433 N A -0.5767
434 E A -0.3458
435 C A -0.0801
436 L A 0.4578
437 S A 0.3014
438 G A -0.2755
439 P A -0.8876
440 C A -0.3885
441 R A -1.4172
442 N A -1.9222
443 Q A -1.5434
444 A A -0.1601
445 T A 0.7633
446 C A 0.8183
447 L A 0.8127
448 D A -1.6950
449 R A -2.3704
450 I A -1.2574
451 G A -1.3793
452 Q A -0.9459
453 F A 0.0000
454 T A 0.5778
455 C A 0.0000
456 I A 2.6883
457 C A 1.4229
458 M A 0.8327
459 A A 0.5415
460 G A -0.2109
461 F A 1.6225
462 T A 0.1611
463 G A 0.0387
464 T A 0.7907
465 Y A 1.1286
466 C A 0.0000
467 E A -0.4677
468 V A -0.1868
469 D A -2.1394
470 I A -1.8163
471 D A -3.0816
472 E A -2.6691
473 C A -1.2458
474 Q A -1.2561
475 S A -0.5748
476 S A -0.3258
477 P A -0.2381
478 C A 0.0000
479 V A 0.9977
480 N A -0.0343
481 G A -0.5881
482 G A -0.7036
483 V A -0.1712
484 C A -0.8368
485 K A -2.3136
486 D A -2.7229
487 R A -2.7822
488 V A -0.9284
489 N A -1.4170
490 G A -1.3946
491 F A -1.2008
492 S A -0.9057
493 C A 0.0233
494 T A -0.0880
495 C A 0.0005
496 P A -0.0969
497 S A -0.5355
498 G A -0.7913
499 F A -0.0803
500 S A -0.6917
501 G A -0.8732
502 S A -0.6679
503 T A -0.5210
504 C A -0.6869
505 Q A -1.3297
506 L A -0.6359
507 D A -1.9230
508 V A -0.9463
509 D A -2.4027
510 E A -2.5384
511 C A -0.9352
512 A A -0.4146
513 S A -0.4374
514 T A -0.7313
515 P A -1.0313
516 C A -1.5036
517 R A -2.7949
518 N A -2.4857
519 G A -1.9254
520 A A -1.5371
521 K A -1.7094
522 C A -0.6850
523 V A -0.6780
524 D A -1.6164
525 Q A -2.6850
526 P A -1.7080
527 D A -2.4462
528 G A -1.8772
529 Y A -0.8754
530 E A -1.1952
531 C A -0.8622
532 R A -1.6866
533 C A -0.9548
534 A A -0.8809
535 E A -0.8892
536 G A -0.7830
537 F A 0.8857
538 E A 0.1096
539 G A 0.2432
540 T A 0.7427
541 L A 1.9453
542 C A 1.7696
543 D A 0.0000
544 R A 0.0588
545 N A -0.5513
546 V A -0.9865
547 D A -2.4228
548 D A -1.7582
549 C A 0.0000
550 S A -1.3563
551 P A -1.2963
552 D A -2.1397
553 P A -1.3804
554 C A -1.7057
555 H A -2.4779
556 H A -2.6477
557 G A -2.1168
558 R A -2.0443
559 C A -0.9467
560 V A -0.2891
561 D A 0.1329
562 G A 1.0207
563 I A 2.1693
564 A A 0.9989
565 S A 0.2253
566 F A 0.0000
567 S A -0.5236
568 C A 0.0000
569 A A -1.0941
570 C A -1.3107
571 A A -0.4909
572 P A -0.1819
573 G A -0.2057
574 Y A -0.0672
575 T A -1.0745
576 G A -1.7967
577 T A -1.6799
578 R A -2.3569
579 C A 0.0000
580 E A -2.6782
581 S A -1.6279
582 Q A -0.6170
583 V A -0.3140
584 D A -1.1133
585 E A -1.4277
586 C A 0.0000
587 R A -2.3095
588 S A -1.8755
589 Q A -2.2828
590 P A -1.9080
591 C A -2.1215
592 R A -2.8651
593 H A -2.5295
594 G A -2.1137
595 G A -2.0712
596 K A -2.3094
597 C A -0.9103
598 L A 0.3115
599 D A -0.0858
600 L A 1.4716
601 V A 1.1747
602 D A -1.1632
603 K A -1.0970
604 Y A -0.3739
605 L A -0.3992
606 C A 0.0000
607 R A -2.1837
608 C A -1.7082
609 P A -0.9801
610 S A -0.7433
611 G A -0.6749
612 T A -0.1866
613 T A -0.4440
614 G A -0.8721
615 V A -0.4190
616 N A -1.7128
617 C A 0.0000
618 E A -1.8738
619 V A -0.6002
620 N A 0.0000
621 I A 0.6341
622 D A -1.5200
623 D A -2.8959
624 C A -2.0630
625 A A 0.0000
626 S A -1.1029
627 N A -1.2514
628 P A -0.4309
629 C A 0.8892
630 T A 1.5979
631 F A 2.6879
632 G A 2.4211
633 V A 2.3123
634 C A 0.1749
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2251 S A -1.7880
2252 P A -1.2009
2253 E A -1.1067
2254 H A -0.7589
2255 W A 0.1208
2256 A A -0.3384
2257 S A -0.6945
2258 P A -0.9418
2259 S A -0.9102
2260 P A -0.3701
2261 P A 0.1225
2262 S A 0.4757
2263 L A 1.1009
2264 S A -0.2465
2265 D A -1.5278
2266 W A -0.6930
2267 S A -1.3212
2268 E A -1.1974
2269 S A -0.4624
2270 T A 0.1831
2271 P A 0.2156
2272 S A 0.2192
2273 P A 0.4436
2274 A A 0.5322
2275 T A 0.2136
2276 A A -0.4105
2277 T A -0.8242
2278 G A -0.9443
2279 A A -0.0517
2280 M A 0.7808
2281 A A 0.1248
2282 T A -0.4930
2283 T A -0.8736
2284 T A -1.2598
2285 G A -1.0969
2286 A A -0.6304
2287 L A 0.0955
2288 P A -0.5031
2289 A A -0.2192
2290 Q A -0.5585
2291 P A 0.3992
2292 L A 1.4877
2293 P A 1.0614
2294 L A 2.0355
2295 S A 1.2532
2296 V A 1.5538
2297 P A 0.0733
2298 S A 0.0054
2299 S A 0.3314
2300 L A 0.8047
2301 A A 0.0031
2302 Q A -0.6302
2303 A A -0.8348
2304 Q A -0.9594
2305 T A -0.5575
2306 Q A -0.3323
2307 L A 1.0720
2308 G A 0.0000
2309 P A -0.3442
2310 Q A -0.9187
2311 P A -0.8470
2312 E A -1.4935
2313 V A -0.8298
2314 T A -0.7471
2315 P A 0.0000
2316 K A -2.6020
2317 R A -2.4955
2318 Q A -1.3860
2319 V A 1.9453
2320 L A 2.8485
2321 A A 2.6033
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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, -0.5492 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_8 -0.5492 View CSV PDB
model_4 -0.5534 View CSV PDB
model_2 -0.5628 View CSV PDB
model_0 -0.5672 View CSV PDB
model_6 -0.5684 View CSV PDB
model_7 -0.5718 View CSV PDB
model_3 -0.5722 View CSV PDB
CABS_average -0.5756 View CSV PDB
model_1 -0.5769 View CSV PDB
model_9 -0.5778 View CSV PDB
model_5 -0.578 View CSV PDB
model_10 -0.5932 View CSV PDB
model_11 -0.6364 View CSV PDB
input -0.743 View CSV PDB