Project name: R1220Q_5_4D

Status: done

Started: 2026-06-12 14:00:26
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTQDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
input PDB
Selected Chain(s) A
Distance of aggregation 5 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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimization                                          (00:00:02)
[INFO]       CABS:     Running CABS flex simulation                                                (00:46:40)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (12:49:08)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (12:49:52)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (12:50:35)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (12:51:19)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (12:52:02)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (12:52:47)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (12:53:30)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (12:54:15)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (12:54:58)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (12:55:42)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (12:56:27)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (12:57:11)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (12:57:54)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (12:59:18)
[INFO]       Main:     Simulation completed successfully.                                          (13:00:01)
Show buried residues

Minimal score value
-2.3887
Maximal score value
2.2928
Average score
-0.2172
Total score value
-504.1714

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 0.9121
2 G A -0.2854
3 P A -0.1470
4 G A -0.0985
5 A A -0.0492
6 R A -0.2038
7 G A 0.0000
8 R A -2.0559
9 R A -2.2656
10 R A -1.4902
11 R A -2.3033
12 R A -2.3887
13 R A -1.4276
14 P A -0.1443
15 M A 1.0167
16 S A 0.0976
17 P A -0.3146
18 P A -0.3044
19 P A 0.0000
20 P A -0.3033
21 P A -0.3170
22 P A -0.1682
23 P A -0.1903
24 V A 0.0308
25 R A -1.7583
26 A A -0.3151
27 L A 0.0000
28 P A -0.0279
29 L A 0.3177
30 L A 0.0000
31 L A 0.2002
32 L A 0.4420
33 L A 1.0807
34 A A 0.1566
35 G A -0.2635
36 P A -0.3376
37 G A -0.1748
38 A A 0.0356
39 A A 0.0399
40 A A 0.0515
41 P A -0.0601
42 P A -0.1848
43 C A 0.0796
44 L A -0.1153
45 D A -1.8378
46 G A -0.8227
47 S A -0.1954
48 P A -0.1737
49 C A 0.0000
50 A A -0.1162
51 N A -0.8536
52 G A -0.6920
53 G A -0.9822
54 R A -1.8745
55 C A -0.0299
56 T A -0.1797
57 Q A -1.3913
58 L A 0.0000
59 P A 0.0000
60 S A -0.5576
61 R A -2.2241
62 E A -2.2980
63 A A 0.0000
64 A A 0.0000
65 C A 0.0000
66 L A 0.0000
67 C A 0.0000
68 P A -0.1068
69 P A -0.1839
70 G A -0.4228
71 W A 0.0453
72 V A 0.0000
73 G A 0.0000
74 E A -1.0271
75 R A -0.8548
76 C A 0.0000
77 Q A -0.5035
78 L A -0.1516
79 E A -1.8312
80 D A -0.9179
81 P A -0.2245
82 C A 0.0352
83 H A -0.1941
84 S A -0.1534
85 G A -0.5336
86 P A -0.3240
87 C A 0.0590
88 A A 0.0475
89 G A -0.3670
90 R A -1.2255
91 G A 0.0000
92 V A 0.5109
93 C A 0.0000
94 Q A -0.3437
95 S A 0.0000
96 S A -0.0603
97 V A 0.0000
98 V A 0.3975
99 A A 0.0290
100 G A -0.4749
101 T A -0.1027
102 A A -0.3507
103 R A -1.7209
104 F A 0.2526
105 S A 0.0417
106 C A 0.0000
107 R A -1.8402
108 C A -0.3047
109 P A -0.5149
110 R A -1.9158
111 G A -0.3657
112 F A 0.6886
113 R A -0.8015
114 G A -0.5608
115 P A -0.6167
116 D A -1.8373
117 C A 0.0000
118 S A -0.1295
119 L A 0.2823
120 P A 0.1524
121 D A 0.0000
122 P A 0.0000
123 C A 0.0000
124 L A 0.8361
125 S A -0.0528
126 S A -0.0074
127 P A -0.2201
128 C A 0.1859
129 A A -0.0853
130 H A -1.0668
131 G A -0.6501
132 A A -0.2738
133 R A -1.1450
134 C A -0.1498
135 S A -0.0890
136 V A 0.4593
137 G A -0.0996
138 P A -0.6785
139 D A -2.0328
140 G A -0.9566
141 R A -0.9257
142 F A 1.1395
143 L A 0.6826
144 C A 0.0000
145 S A 0.0000
146 C A 0.0000
147 P A -0.1879
148 P A -0.2325
149 G A 0.0179
150 Y A 0.2834
151 Q A -1.1693
152 G A -0.7398
153 R A -0.2655
154 S A -0.0525
155 C A 0.5730
156 R A -0.3695
157 S A -0.3400
158 D A -0.4788
159 V A 0.2894
160 D A -1.5196
161 E A -0.4555
162 C A -0.2668
163 R A -1.6323
164 V A 0.5173
165 G A -0.4136
166 E A -0.8015
167 P A -0.2722
168 C A 0.0000
169 R A -2.0320
170 H A -1.4871
171 G A -0.7421
172 G A -0.6786
173 T A 0.0000
174 C A 0.3890
175 L A 1.4549
176 N A -0.0273
177 T A -0.1879
178 P A -0.2765
179 G A -0.1693
180 S A 0.0636
181 F A 1.0471
182 R A -1.5223
183 C A -0.4236
184 Q A -1.1301
185 C A 0.0013
186 P A 0.0000
187 A A 0.0320
188 G A -0.0560
189 Y A 0.1291
190 T A 0.0530
191 G A -0.0770
192 P A 0.1482
193 L A 1.5218
194 C A 0.0000
195 E A -1.8601
196 N A -0.8533
197 P A -0.3415
198 A A 0.2160
199 V A 1.2508
200 P A 0.1146
201 C A 0.0000
202 A A -0.0397
203 P A -0.2592
204 S A -0.1626
205 P A -0.2457
206 C A -0.3339
207 R A -2.0930
208 N A -1.6706
209 G A -0.7736
210 G A -0.5161
211 T A 0.0000
212 C A -0.0673
213 R A -2.1152
214 Q A -1.5725
215 S A -0.5066
216 G A -0.7849
217 D A -1.5942
218 L A 0.0000
219 T A 0.0000
220 Y A 1.1510
221 D A -0.7212
222 C A 0.2779
223 A A 0.1054
224 C A 0.0000
225 L A 1.3540
226 P A 0.1772
227 G A -0.2732
228 F A 0.4308
229 E A -1.6698
230 G A -1.0262
231 Q A -1.5354
232 N A -1.5066
233 C A 0.0000
234 E A -0.5267
235 V A 0.0000
236 N A -0.6850
237 V A 0.2305
238 D A -1.8669
239 D A -2.1038
240 C A -0.2891
241 P A -0.5053
242 G A -0.5835
243 H A -0.5122
244 R A -0.2619
245 C A 0.0000
246 L A 0.0000
247 N A -1.3440
248 G A -0.7060
249 G A -0.5387
250 T A 0.0000
251 C A 0.7691
252 V A 1.5577
253 D A -0.4184
254 G A -0.3314
255 V A 0.4923
256 N A -1.1626
257 T A -0.2764
258 Y A -0.0559
259 N A -1.1899
260 C A 0.0000
261 Q A -0.7771
262 C A -0.0685
263 P A 0.0000
264 P A -0.0566
265 E A 0.0000
266 W A 0.3838
267 T A -0.0212
268 G A -0.6919
269 Q A -0.9099
270 F A 1.7091
271 C A 0.0000
272 T A -0.0531
273 E A -0.0754
274 D A 0.0000
275 V A 0.0000
276 D A 0.0000
277 E A 0.0000
278 C A 0.0000
279 Q A 0.0000
280 L A 0.5264
281 Q A 0.0000
282 P A 0.0000
283 N A 0.0000
284 A A 0.0175
285 C A 0.0000
286 H A 0.0000
287 N A -0.1496
288 G A 0.0000
289 G A 0.0000
290 T A 0.0000
291 C A 0.0000
292 F A 1.5515
293 N A 0.0000
294 T A 0.0476
295 L A 0.3473
296 G A 0.0000
297 G A -0.2008
298 H A 0.0000
299 S A -0.0524
300 C A 0.0000
301 V A 0.7311
302 C A 0.0000
303 V A 0.0683
304 N A -1.3048
305 G A -0.5634
306 W A 0.6563
307 T A -0.2068
308 G A -0.8182
309 E A -1.9186
310 S A -0.3852
311 C A 0.0000
312 S A -0.2129
313 Q A 0.0000
314 N A -0.7214
315 I A 0.0000
316 D A -0.7326
317 D A -0.2909
318 C A 0.2085
319 A A 0.0430
320 T A -0.0599
321 A A -0.0064
322 V A 0.0000
323 C A 0.0000
324 F A 0.6158
325 H A -0.9116
326 G A -0.5616
327 A A 0.0000
328 T A -0.0495
329 C A -0.0348
330 H A -0.4548
331 D A 0.0000
332 R A -0.3865
333 V A 0.3428
334 A A 0.0928
335 S A 0.0000
336 F A 0.0000
337 Y A 0.7677
338 C A 0.0000
339 A A 0.0360
340 C A 0.0884
341 P A -0.0513
342 M A 0.8040
343 G A -0.1821
344 K A -0.6512
345 T A 0.0000
346 G A 0.0432
347 L A 0.4584
348 L A 0.0000
349 C A 0.0000
350 H A -0.2502
351 L A 0.0000
352 D A -1.9321
353 D A -0.7459
354 A A -0.0336
355 C A 0.0000
356 V A 1.5398
357 S A 0.0419
358 N A -0.3543
359 P A -0.2900
360 C A -0.0107
361 H A -0.5433
362 E A -2.1994
363 D A -2.1329
364 A A 0.0390
365 I A 2.0500
366 C A 0.5722
367 D A 0.0000
368 T A 0.0000
369 N A 0.0000
370 P A -0.0278
371 V A 0.0000
372 N A 0.0000
373 G A -0.1482
374 R A -0.2610
375 A A -0.0345
376 I A 0.0000
377 C A 0.0000
378 T A -0.0139
379 C A 0.0000
380 P A -0.0961
381 P A -0.3119
382 G A -0.0542
383 F A 0.2739
384 T A 0.0000
385 G A -0.1195
386 G A -0.2701
387 A A 0.0316
388 C A -0.2285
389 D A -1.8729
390 Q A -1.0453
391 D A -0.7154
392 V A 0.1360
393 D A -0.4017
394 E A -0.5859
395 C A 0.0000
396 S A -0.0610
397 I A 0.0000
398 G A -0.4554
399 A A -0.0287
400 N A 0.0000
401 P A 0.0000
402 C A 0.0000
403 E A -0.6387
404 H A -0.7100
405 L A 1.2839
406 G A -0.4688
407 R A -1.6971
408 C A 0.0000
409 V A 1.6768
410 N A 0.1098
411 T A -0.1388
412 Q A -0.2853
413 G A 0.0000
414 S A -0.0865
415 F A 0.6928
416 L A 1.6355
417 C A 0.0000
418 Q A -1.1747
419 C A -0.1935
420 G A -0.5911
421 R A -0.9130
422 G A -0.0658
423 Y A 1.2417
424 T A 0.1434
425 G A -0.7260
426 P A -0.5984
427 R A -1.9314
428 C A 0.0000
429 E A 0.0000
430 T A 0.0000
431 D A 0.0000
432 V A 0.0207
433 N A 0.0000
434 E A -1.7273
435 C A 0.0605
436 L A 0.3682
437 S A -0.2437
438 G A -0.4990
439 P A -0.1903
440 C A -0.1349
441 R A -1.9103
442 N A -1.2027
443 Q A -1.3123
444 A A -0.2042
445 T A 0.0108
446 C A 0.4987
447 L A 1.5437
448 D A -0.1840
449 R A -1.8331
450 I A 0.8766
451 G A -0.1245
452 Q A -1.2321
453 F A 0.7081
454 T A 0.1530
455 C A 0.0000
456 I A 2.0284
457 C A 0.5705
458 M A 0.5596
459 A A 0.1091
460 G A -0.2518
461 F A 0.0000
462 T A -0.1656
463 G A -0.4931
464 T A 0.0899
465 Y A 1.3261
466 C A 0.0278
467 E A -1.5871
468 V A 0.7007
469 D A 0.2197
470 I A 0.6855
471 D A -1.6689
472 E A -0.7370
473 C A 0.0000
474 Q A -1.2319
475 S A -0.4302
476 S A -0.2196
477 P A -0.2552
478 C A 0.4231
479 V A 1.5645
480 N A -1.0362
481 G A -0.6948
482 G A 0.0414
483 V A 1.7498
484 C A 0.1519
485 K A -1.8409
486 D A -1.5093
487 R A -1.6787
488 V A 1.3768
489 N A -0.1136
490 G A 0.0411
491 F A 1.8534
492 S A 0.2636
493 C A 0.3047
494 T A 0.1079
495 C A 0.2721
496 P A -0.2180
497 S A -0.2759
498 G A 0.1958
499 F A 2.1431
500 S A 0.0000
501 G A -0.4647
502 S A -0.2987
503 T A 0.0716
504 C A 0.6825
505 Q A 0.2201
506 L A 1.6924
507 D A 0.1379
508 V A 1.1337
509 D A -1.6877
510 E A -1.3258
511 C A -0.0946
512 A A 0.0339
513 S A -0.2077
514 T A -0.1203
515 P A -0.2446
516 C A -0.2236
517 R A -1.6122
518 N A -1.5838
519 G A -0.5107
520 A A -0.3425
521 K A -1.6384
522 C A 0.1159
523 V A 0.0080
524 D A -1.8332
525 Q A -1.0463
526 P A -0.4786
527 D A -0.6752
528 G A 0.0000
529 Y A 1.1261
530 E A -0.3291
531 C A -0.0838
532 R A -1.7536
533 C A -0.1749
534 A A -0.1435
535 E A -1.3034
536 G A -0.6376
537 F A 0.0177
538 E A -1.3682
539 G A -0.6662
540 T A 0.1600
541 L A 1.6041
542 C A 0.5476
543 D A -0.4859
544 R A -1.5240
545 N A 0.0000
546 V A 1.4339
547 D A -1.6319
548 D A -1.2487
549 C A 0.0000
550 S A -0.2617
551 P A -0.6345
552 D A -1.8878
553 P A -0.5714
554 C A -0.0477
555 H A -1.1131
556 H A -1.1153
557 G A -0.9805
558 R A -1.7942
559 C A 0.5895
560 V A 0.8504
561 D A -1.6110
562 G A -0.2012
563 I A 1.9644
564 A A 0.0000
565 S A -0.0069
566 F A 0.0440
567 S A -0.0924
568 C A 0.1721
569 A A 0.0234
570 C A 0.0000
571 A A -0.0651
572 P A -0.3381
573 G A -0.4037
574 Y A 0.5438
575 T A 0.0024
576 G A -0.4916
577 T A -0.2933
578 R A -0.8687
579 C A 0.0000
580 E A -0.3171
581 S A -0.1373
582 Q A 0.0516
583 V A 0.9967
584 D A -0.7228
585 E A -1.8519
586 C A -0.6623
587 R A -1.8374
588 S A -0.6571
589 Q A -0.6857
590 P A -0.2441
591 C A 0.1113
592 R A 0.0000
593 H A -1.0025
594 G A -0.2804
595 G A -0.4325
596 K A -1.6208
597 C A 0.2188
598 L A 1.0268
599 D A -0.9810
600 L A 1.4659
601 V A 1.7323
602 D A -1.7335
603 K A -1.3630
604 Y A 0.1704
605 L A 0.6195
606 C A -0.0424
607 R A -1.7457
608 C A -0.0732
609 P A -0.1950
610 S A -0.1036
611 G A -0.1343
612 T A -0.0551
613 T A -0.1628
614 G A -0.2242
615 V A 1.0180
616 N A -0.8763
617 C A 0.4958
618 E A 0.0000
619 V A 1.2504
620 N A 0.0000
621 I A 1.6788
622 D A -1.4618
623 D A -0.5912
624 C A 0.0000
625 A A 0.0413
626 S A -0.3205
627 N A -1.3388
628 P A -0.4808
629 C A 0.0410
630 T A 0.3558
631 F A 1.9160
632 G A 0.6344
633 V A 1.7800
634 C A 0.1679
635 R A -1.8743
636 D A -0.6424
637 G A 0.0000
638 I A -0.0288
639 N A -1.4961
640 R A -1.4868
641 Y A 0.9159
642 D A -0.2481
643 C A 0.3492
644 V A 1.2456
645 C A 0.3082
646 Q A -0.1806
647 P A -0.2173
648 G A -0.4842
649 F A 0.0000
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1974 T A 0.0000
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1978 L A 0.0000
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2000 I A 0.0000
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2011 V A -0.2115
2012 A A 0.0000
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2014 E A -2.3609
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2276 A A 0.0000
2277 T A 0.0000
2278 G A 0.0000
2279 A A 0.1312
2280 M A 0.3903
2281 A A -0.0768
2282 T A 0.0000
2283 T A -0.0709
2284 T A 0.0000
2285 G A -0.4598
2286 A A 0.2337
2287 L A 1.4656
2288 P A 0.0406
2289 A A -0.1808
2290 Q A -0.9392
2291 P A -0.3882
2292 L A 0.1096
2293 P A 0.1229
2294 L A 1.0590
2295 S A 0.0871
2296 V A 0.5147
2297 P A 0.0000
2298 S A 0.0260
2299 S A 0.0000
2300 L A 1.2230
2301 A A 0.0303
2302 Q A -1.1824
2303 A A -0.3940
2304 Q A -1.2008
2305 T A -0.3204
2306 Q A 0.1692
2307 L A 1.4373
2308 G A -0.3042
2309 P A -0.2669
2310 Q A -0.4371
2311 P A -0.4097
2312 E A -0.0407
2313 V A 1.7029
2314 T A 0.2926
2315 P A -0.3698
2316 K A -2.0186
2317 R A -1.9667
2318 Q A 0.0000
2319 V A 1.1026
2320 L A 1.1114
2321 A A 0.2371
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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, -0.2172 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 -0.2172 View CSV PDB
model_9 -0.2209 View CSV PDB
model_7 -0.2243 View CSV PDB
model_3 -0.2257 View CSV PDB
model_6 -0.2279 View CSV PDB
model_2 -0.2292 View CSV PDB
model_8 -0.2318 View CSV PDB
CABS_average -0.232 View CSV PDB
model_5 -0.2362 View CSV PDB
model_0 -0.2372 View CSV PDB
model_4 -0.2409 View CSV PDB
model_10 -0.2427 View CSV PDB
model_11 -0.25 View CSV PDB
input -0.2839 View CSV PDB