Project name: G1347R_10_4D

Status: done

Started: 2026-06-12 06:59:55
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                                                (00:24:16)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (13:54:59)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (13:55:44)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (13:56:28)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (13:57:12)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (13:57:56)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (13:58:40)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (13:59:24)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (14:00:08)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (14:00:51)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (14:01:35)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (14:02:18)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (14:03:02)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (14:03:46)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (14:05:13)
[INFO]       Main:     Simulation completed successfully.                                          (14:05:55)
Show buried residues

Minimal score value
-4.6456
Maximal score value
4.8825
Average score
-0.543
Total score value
-1260.2335

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 -0.2152
2 G A -0.9121
3 P A -1.1094
4 G A -1.4467
5 A A -1.2201
6 R A -2.1989
7 G A -1.9304
8 R A -2.0844
9 R A -2.1670
10 R A -1.7583
11 R A -1.1209
12 R A 0.0000
13 R A 0.0000
14 P A -0.1991
15 M A -0.2678
16 S A 0.0000
17 P A 0.0000
18 P A -0.1259
19 P A -0.1062
20 P A 0.0000
21 P A -0.2346
22 P A 0.0000
23 P A -0.4487
24 V A -0.3859
25 R A -1.2431
26 A A -0.0182
27 L A 0.6286
28 P A 0.5901
29 L A 1.3958
30 L A 3.0310
31 L A 3.4423
32 L A 3.2952
33 L A 2.5193
34 A A 0.7902
35 G A -0.1625
36 P A -0.4756
37 G A -0.4605
38 A A -0.2586
39 A A -0.0371
40 A A -0.4523
41 P A -0.2264
42 P A -0.3450
43 C A -0.5878
44 L A -1.2398
45 D A -2.3311
46 G A -1.1095
47 S A -0.7251
48 P A -0.5017
49 C A 0.0000
50 A A -0.9503
51 N A -1.8191
52 G A -1.5470
53 G A 0.0000
54 R A -0.6591
55 C A -0.0446
56 T A -0.6149
57 Q A -1.1691
58 L A -1.0435
59 P A -1.0055
60 S A -1.0997
61 R A -1.5355
62 E A -0.9550
63 A A 0.0000
64 A A 0.0000
65 C A 0.0000
66 L A 0.5645
67 C A -0.0996
68 P A -0.2432
69 P A 0.0000
70 G A -1.6277
71 W A 0.0000
72 V A 0.0000
73 G A -1.5688
74 E A -2.6097
75 R A -3.0222
76 C A 0.0000
77 Q A -2.6052
78 L A 0.0000
79 E A -2.7465
80 D A -1.9991
81 P A -1.5409
82 C A 0.0000
83 H A -1.3619
84 S A -1.1200
85 G A -0.8401
86 P A -1.0568
87 C A 0.0000
88 A A -0.6762
89 G A -1.5152
90 R A -2.3102
91 G A -1.4907
92 V A 0.0000
93 C A 0.0000
94 Q A -0.9856
95 S A -1.3185
96 S A -1.0165
97 V A 0.0000
98 V A -0.4971
99 A A -1.0993
100 G A -0.7364
101 T A -0.6072
102 A A -1.4017
103 R A -1.7626
104 F A -1.0123
105 S A -0.4756
106 C A 0.0000
107 R A -0.9694
108 C A -0.7261
109 P A -0.9914
110 R A -1.5964
111 G A -0.6378
112 F A 0.3536
113 R A -1.0730
114 G A -0.8161
115 P A -0.6418
116 D A -1.0117
117 C A -0.0160
118 S A 0.0663
119 L A 0.7746
120 P A 0.0000
121 D A -0.6722
122 P A -0.5209
123 C A -0.2017
124 L A 1.1610
125 S A 0.2670
126 S A 0.0776
127 P A -0.2334
128 C A -0.7140
129 A A -0.5492
130 H A -1.2479
131 G A -1.3535
132 A A -1.3493
133 R A -1.8372
134 C A 0.0000
135 S A 0.2973
136 V A 0.1625
137 G A -0.8241
138 P A -1.1726
139 D A -1.9263
140 G A -1.6849
141 R A -1.2642
142 F A 0.6621
143 L A 1.1645
144 C A 0.1623
145 S A -0.5842
146 C A 0.0000
147 P A -1.0285
148 P A -1.0804
149 G A -1.0366
150 Y A -0.9486
151 Q A -1.6364
152 G A -1.9780
153 R A -2.4332
154 S A -1.0656
155 C A -0.9017
156 R A 0.0000
157 S A -0.7789
158 D A -0.8079
159 V A -0.2436
160 D A -1.0914
161 E A -1.6164
162 C A -1.4455
163 R A -1.7123
164 V A -0.2644
165 G A -1.0264
166 E A -2.3396
167 P A -1.8118
168 C A -1.9363
169 R A -2.0271
170 H A -1.6699
171 G A -1.2821
172 G A -1.0780
173 T A -0.6931
174 C A -0.8509
175 L A -0.5123
176 N A -1.1183
177 T A -0.6110
178 P A -0.7528
179 G A -1.0137
180 S A -0.6457
181 F A 0.0000
182 R A -1.2109
183 C A 0.0000
184 Q A -1.2050
185 C A -0.9392
186 P A -0.4774
187 A A -0.1790
188 G A 0.0481
189 Y A -0.3775
190 T A 0.0000
191 G A 0.0000
192 P A -0.4498
193 L A 0.1304
194 C A -1.2902
195 E A -2.3706
196 N A -1.9512
197 P A -0.9400
198 A A -0.4801
199 V A 0.0000
200 P A -0.5080
201 C A -0.8180
202 A A -0.1719
203 P A -0.4134
204 S A 0.0000
205 P A -1.4168
206 C A -1.5295
207 R A -3.0699
208 N A -2.0385
209 G A -1.4591
210 G A -1.2569
211 T A -1.1157
212 C A -1.2205
213 R A -2.6358
214 Q A -1.9821
215 S A -1.4377
216 G A -1.2228
217 D A -1.3258
218 L A 0.2410
219 T A -0.6738
220 Y A -1.3303
221 D A -2.3775
222 C A 0.0000
223 A A -1.3833
224 C A -0.9827
225 L A -0.9602
226 P A 0.0000
227 G A -0.9787
228 F A 0.5173
229 E A -1.3855
230 G A -1.3608
231 Q A -2.1378
232 N A -2.1134
233 C A 0.0000
234 E A -2.0588
235 V A 0.0000
236 N A -2.2276
237 V A -1.8113
238 D A -2.9759
239 D A -2.4272
240 C A -1.0242
241 P A -1.3705
242 G A -1.6383
243 H A -2.0138
244 R A -2.2755
245 C A -0.3257
246 L A 0.6938
247 N A -0.3818
248 G A -1.1121
249 G A -1.5984
250 T A -0.9779
251 C A -0.9629
252 V A -0.2898
253 D A -1.5231
254 G A -0.4733
255 V A 0.5566
256 N A -1.3738
257 T A -0.5035
258 Y A -0.2074
259 N A -0.6575
260 C A -0.7569
261 Q A -0.7644
262 C A 0.0000
263 P A -0.6417
264 P A -0.8212
265 E A -1.1727
266 W A 0.0000
267 T A -0.3346
268 G A -0.3516
269 Q A 0.0143
270 F A 0.6351
271 C A 0.8178
272 T A 0.6063
273 E A 0.0000
274 D A 0.0000
275 V A 0.0000
276 D A 0.0000
277 E A 0.0000
278 C A -0.7642
279 Q A -0.7556
280 L A 0.1028
281 Q A -0.9180
282 P A -0.6681
283 N A -0.8407
284 A A -0.3003
285 C A -0.1988
286 H A -0.4913
287 N A -0.5691
288 G A -0.6953
289 G A -0.2201
290 T A 0.0000
291 C A 0.3508
292 F A 0.3741
293 N A 0.0000
294 T A 0.0000
295 L A -0.1145
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 -0.3458
304 N A -0.5340
305 G A -0.6318
306 W A 0.0000
307 T A -0.6143
308 G A -0.6824
309 E A -0.4383
310 S A -0.0147
311 C A -0.2751
312 S A -0.7036
313 Q A -1.1516
314 N A -1.3180
315 I A -0.5078
316 D A -1.0429
317 D A 0.0000
318 C A 0.0000
319 A A -0.6620
320 T A -0.8239
321 A A 0.0000
322 V A 0.0000
323 C A 0.0000
324 F A 0.0000
325 H A -0.4121
326 G A -0.3509
327 A A 0.0000
328 T A -0.1728
329 C A 0.0000
330 H A -0.0115
331 D A 0.0000
332 R A 0.3907
333 V A 2.0058
334 A A 0.7098
335 S A 0.1363
336 F A 0.0000
337 Y A 1.1395
338 C A 0.0000
339 A A 0.0792
340 C A 0.0007
341 P A -0.1537
342 M A 0.2070
343 G A -0.2836
344 K A -0.1452
345 T A 0.0000
346 G A -0.0298
347 L A 0.0000
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 -0.0527
354 A A 0.0000
355 C A 0.0000
356 V A 0.0000
357 S A -0.3079
358 N A -0.5862
359 P A 0.3041
360 C A 0.0000
361 H A 0.0000
362 E A 0.0000
363 D A -0.2251
364 A A 0.9073
365 I A 1.9232
366 C A 0.9510
367 D A 0.1165
368 T A 0.0000
369 N A 0.0000
370 P A 0.0000
371 V A 0.0000
372 N A 0.0194
373 G A -0.5300
374 R A 0.0000
375 A A 0.0000
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 0.1147
382 G A 0.0000
383 F A 0.0000
384 T A 0.0000
385 G A 0.0000
386 G A -0.7376
387 A A -0.8252
388 C A -0.8648
389 D A -1.8266
390 Q A -1.4886
391 D A -1.6638
392 V A 0.0000
393 D A 0.0000
394 E A 0.0000
395 C A 0.0000
396 S A 0.0000
397 I A 0.0000
398 G A -0.2054
399 A A 0.0000
400 N A 0.0000
401 P A -0.6708
402 C A 0.0000
403 E A -2.1828
404 H A -1.6623
405 L A -1.2087
406 G A -1.2771
407 R A -1.9540
408 C A -0.4371
409 V A -0.0669
410 N A -0.7865
411 T A -1.0178
412 Q A -2.0240
413 G A 0.0000
414 S A 0.0000
415 F A 0.0000
416 L A 0.0000
417 C A 0.0000
418 Q A -1.2129
419 C A 0.0000
420 G A -1.9988
421 R A -2.4343
422 G A -1.9265
423 Y A -1.5289
424 T A -1.0943
425 G A -1.2812
426 P A -1.3110
427 R A -1.2855
428 C A -1.2685
429 E A -1.5823
430 T A -1.1364
431 D A -1.8217
432 V A 0.0000
433 N A -1.9010
434 E A -1.5612
435 C A 0.0000
436 L A 1.0062
437 S A 0.0538
438 G A -0.1144
439 P A 0.0606
440 C A 0.0000
441 R A 0.0000
442 N A -0.6602
443 Q A -1.6358
444 A A -0.5288
445 T A 0.0000
446 C A 0.0000
447 L A 0.6386
448 D A -0.0930
449 R A -0.1383
450 I A 0.8092
451 G A -0.6365
452 Q A -0.5599
453 F A 1.0014
454 T A 0.6328
455 C A 1.1482
456 I A 0.9386
457 C A 0.5526
458 M A 0.8220
459 A A 0.5568
460 G A 0.6804
461 F A 1.4798
462 T A 0.6880
463 G A 0.1123
464 T A 0.4027
465 Y A 1.0368
466 C A 0.6306
467 E A 0.0015
468 V A 0.5148
469 D A 0.0000
470 I A 0.9697
471 D A -0.2275
472 E A -1.2282
473 C A -1.1327
474 Q A -1.5926
475 S A -1.0957
476 S A -0.6711
477 P A -0.5945
478 C A 0.2314
479 V A -0.1048
480 N A -0.3388
481 G A -0.8331
482 G A -0.8777
483 V A -0.0516
484 C A 0.0000
485 K A -2.1884
486 D A -1.8807
487 R A -1.4800
488 V A 0.6231
489 N A 0.2166
490 G A -0.0958
491 F A 0.4770
492 S A -0.3091
493 C A -0.1776
494 T A 0.3535
495 C A 0.3143
496 P A -0.0797
497 S A -0.5140
498 G A 0.0129
499 F A 1.2572
500 S A 0.3298
501 G A -0.1437
502 S A -0.2713
503 T A 0.1759
504 C A 0.0000
505 Q A -0.0758
506 L A -0.1170
507 D A -1.2251
508 V A -1.4488
509 D A -2.4948
510 E A 0.0000
511 C A 0.0000
512 A A -0.3202
513 S A -0.9371
514 T A -0.3309
515 P A -0.4327
516 C A -1.2139
517 R A -3.0778
518 N A -2.8375
519 G A -2.0169
520 A A -2.0471
521 K A -2.3363
522 C A -0.7340
523 V A -0.4878
524 D A -1.9441
525 Q A -2.3795
526 P A -1.9914
527 D A -2.4719
528 G A -1.7531
529 Y A -0.9436
530 E A -1.7384
531 C A -1.2588
532 R A -2.4506
533 C A -2.2909
534 A A -2.1770
535 E A -2.6739
536 G A -1.3537
537 F A -0.5536
538 E A -2.0270
539 G A -0.9950
540 T A -0.4594
541 L A -0.7663
542 C A -0.7862
543 D A -2.5531
544 R A -3.1783
545 N A -2.7403
546 V A -1.5799
547 D A -2.5965
548 D A -2.7331
549 C A -2.0339
550 S A -1.8186
551 P A -1.9711
552 D A -2.3013
553 P A -1.9023
554 C A -2.4383
555 H A -2.4250
556 H A -2.5978
557 G A -1.8110
558 R A -2.0259
559 C A -0.6820
560 V A 0.4661
561 D A 0.2699
562 G A 0.4788
563 I A 1.7557
564 A A 0.6230
565 S A 0.2653
566 F A -0.1524
567 S A -0.7600
568 C A 0.0000
569 A A -1.1974
570 C A -1.2321
571 A A -0.1375
572 P A 0.0235
573 G A -0.0619
574 Y A 0.6226
575 T A -0.6964
576 G A -0.7408
577 T A -0.8785
578 R A -2.3754
579 C A 0.0000
580 E A -1.6894
581 S A -1.0405
582 Q A -1.0914
583 V A 0.1994
584 D A -1.7482
585 E A -2.5285
586 C A -1.6690
587 R A -2.5647
588 S A -1.5577
589 Q A -0.5394
590 P A 0.0000
591 C A 0.4472
592 R A -0.4508
593 H A -1.5050
594 G A -1.2517
595 G A -1.3274
596 K A -1.4488
597 C A -0.8167
598 L A -0.7365
599 D A -1.3550
600 L A 0.5029
601 V A 0.7526
602 D A -1.1211
603 K A -1.4064
604 Y A 0.0000
605 L A -0.5226
606 C A 0.0000
607 R A -1.9469
608 C A -1.1437
609 P A -0.9268
610 S A 0.0000
611 G A -0.4693
612 T A 0.0255
613 T A 0.4029
614 G A 0.6085
615 V A 1.0740
616 N A -0.6374
617 C A 0.0000
618 E A 0.1728
619 V A 0.8985
620 N A 0.0000
621 I A 1.2709
622 D A -0.6971
623 D A -1.3474
624 C A -0.4688
625 A A -0.2688
626 S A -0.7894
627 N A -0.8264
628 P A -0.0131
629 C A 1.0195
630 T A 1.3350
631 F A 2.1698
632 G A 1.5887
633 V A 1.7717
634 C A -0.0780
635 R A -1.5230
636 D A -1.4009
637 G A 0.0000
638 I A 0.2924
639 N A -1.5107
640 R A -2.1026
641 Y A -1.2675
642 D A -0.6799
643 C A 0.0000
644 V A 1.6524
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1997 N A 0.0000
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2011 V A -2.6512
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2267 S A -0.9604
2268 E A -2.3088
2269 S A -1.6182
2270 T A -1.2569
2271 P A -0.6769
2272 S A -0.6359
2273 P A -0.3990
2274 A A -0.2346
2275 T A -0.4047
2276 A A -0.1524
2277 T A -0.1694
2278 G A -0.0287
2279 A A 0.1049
2280 M A 0.5107
2281 A A 0.0950
2282 T A 0.0516
2283 T A 0.1545
2284 T A -0.0253
2285 G A -0.0093
2286 A A 0.6071
2287 L A 1.5351
2288 P A 0.6231
2289 A A 0.1439
2290 Q A 0.0000
2291 P A 0.0125
2292 L A 0.0000
2293 P A 0.6180
2294 L A 0.8831
2295 S A 0.4633
2296 V A 0.5077
2297 P A -0.1177
2298 S A -0.2184
2299 S A -0.8817
2300 L A 0.0000
2301 A A -1.1300
2302 Q A 0.0000
2303 A A -0.0587
2304 Q A -0.2033
2305 T A -0.0151
2306 Q A -0.1678
2307 L A -0.0088
2308 G A -0.7929
2309 P A -1.3681
2310 Q A -1.2242
2311 P A -0.9846
2312 E A -0.4024
2313 V A 1.0473
2314 T A -0.1786
2315 P A -1.0773
2316 K A -2.1981
2317 R A -2.2896
2318 Q A -1.7443
2319 V A -0.8715
2320 L A -0.2032
2321 A A -0.3933
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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, -0.543 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_9 -0.543 View CSV PDB
model_7 -0.5492 View CSV PDB
model_0 -0.5713 View CSV PDB
model_4 -0.5817 View CSV PDB
model_8 -0.5821 View CSV PDB
model_3 -0.5831 View CSV PDB
model_5 -0.588 View CSV PDB
model_1 -0.5889 View CSV PDB
CABS_average -0.5891 View CSV PDB
model_6 -0.5952 View CSV PDB
model_2 -0.6184 View CSV PDB
model_10 -0.6215 View CSV PDB
model_11 -0.6472 View CSV PDB
input -0.7374 View CSV PDB