Project name: R1220Q_10_4D

Status: done

Started: 2026-06-12 14:01:43
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTQDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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]                                                (00:00:01)
[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                                                (00:48:41)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (12:55:05)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (12:55:48)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (12:56:31)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (12:57:14)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (12:57:56)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (12:58:41)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (12:59:24)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (13:00:07)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (13:00:50)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (13:01:34)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (13:02:17)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (13:03:01)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (13:03:45)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (13:05:08)
[INFO]       Main:     Simulation completed successfully.                                          (13:05:49)
Show buried residues

Minimal score value
-4.8479
Maximal score value
4.4307
Average score
-0.5544
Total score value
-1286.8349

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 0.7249
2 G A -0.0858
3 P A -0.7660
4 G A -0.9121
5 A A -1.0140
6 R A -2.3972
7 G A -2.6076
8 R A 0.0000
9 R A -3.0898
10 R A -4.0874
11 R A -4.7485
12 R A -4.2392
13 R A -3.1828
14 P A -1.4004
15 M A -0.0340
16 S A -0.1327
17 P A -0.3919
18 P A -0.4796
19 P A -0.6997
20 P A -0.7004
21 P A -0.7164
22 P A -0.8214
23 P A -1.0883
24 V A -0.9176
25 R A -1.8105
26 A A -0.3627
27 L A 0.7348
28 P A 1.0918
29 L A 2.3351
30 L A 1.6961
31 L A 2.3358
32 L A 2.1691
33 L A 1.8505
34 A A 0.5294
35 G A -1.0430
36 P A -1.0692
37 G A -0.9522
38 A A -0.6026
39 A A -0.5252
40 A A -0.0978
41 P A -0.0296
42 P A -0.1755
43 C A -0.0955
44 L A 0.0182
45 D A -1.5252
46 G A -1.0989
47 S A -0.6385
48 P A -0.4959
49 C A -0.2867
50 A A -0.8358
51 N A -1.6308
52 G A -1.3044
53 G A -0.9444
54 R A -1.0707
55 C A 0.0211
56 T A 0.0000
57 Q A 0.0000
58 L A -1.1444
59 P A -1.3714
60 S A -2.0370
61 R A -3.2940
62 E A -2.5703
63 A A -0.5855
64 A A 0.0000
65 C A -0.2350
66 L A -0.4160
67 C A 0.0000
68 P A -0.8594
69 P A -0.8497
70 G A -1.0723
71 W A -1.0610
72 V A -1.2543
73 G A -1.6897
74 E A -2.3707
75 R A -2.3377
76 C A 0.0000
77 Q A -1.4587
78 L A -1.5120
79 E A -2.2110
80 D A -1.5535
81 P A -0.9295
82 C A 0.0000
83 H A -1.2023
84 S A -1.1147
85 G A -0.4230
86 P A -0.0832
87 C A -0.3068
88 A A -0.6281
89 G A -1.5311
90 R A -1.9739
91 G A -1.3849
92 V A -0.5850
93 C A -0.5824
94 Q A -0.8716
95 S A 0.0000
96 S A -1.2777
97 V A 0.0000
98 V A -0.6945
99 A A -0.5236
100 G A -0.4346
101 T A -0.4331
102 A A -0.9104
103 R A -0.8694
104 F A 0.1750
105 S A -0.4772
106 C A 0.0000
107 R A -1.6008
108 C A 0.0000
109 P A -1.5254
110 R A -1.8931
111 G A -0.6048
112 F A -0.0793
113 R A -0.8256
114 G A 0.0000
115 P A -1.0344
116 D A -1.7492
117 C A -0.4225
118 S A -0.1643
119 L A 0.9926
120 P A 0.1606
121 D A -0.1258
122 P A 0.6227
123 C A 0.0000
124 L A 1.2043
125 S A -0.1580
126 S A 0.1936
127 P A -0.1674
128 C A 0.0000
129 A A -0.2082
130 H A -0.8323
131 G A -0.7966
132 A A -0.5146
133 R A 0.0687
134 C A 1.4336
135 S A 1.6398
136 V A 2.4561
137 G A 1.0274
138 P A -0.6259
139 D A -1.1645
140 G A -0.4063
141 R A 0.5911
142 F A 2.9560
143 L A 3.0297
144 C A 1.9110
145 S A 0.6986
146 C A 0.5473
147 P A -0.0351
148 P A -0.0556
149 G A 0.0596
150 Y A 0.0056
151 Q A -1.1595
152 G A -1.5940
153 R A -1.9662
154 S A -1.0212
155 C A -0.2069
156 R A -0.9945
157 S A 0.0000
158 D A 0.0000
159 V A 0.7931
160 D A -0.2941
161 E A -0.4555
162 C A -0.4032
163 R A -1.3381
164 V A -0.3336
165 G A -0.9234
166 E A -1.5042
167 P A -1.2687
168 C A -1.8747
169 R A -3.1000
170 H A -2.5189
171 G A -1.7048
172 G A -1.7750
173 T A -0.9767
174 C A -0.5771
175 L A 0.0196
176 N A 0.0000
177 T A -0.3488
178 P A -0.5801
179 G A -0.6435
180 S A -0.4134
181 F A 0.0577
182 R A -0.6212
183 C A 0.0000
184 Q A -1.4795
185 C A 0.0000
186 P A -1.0706
187 A A -0.6428
188 G A -0.9247
189 Y A -0.7559
190 T A 0.0000
191 G A -0.0814
192 P A 0.2665
193 L A 0.9708
194 C A -0.3125
195 E A -1.8752
196 N A 0.0000
197 P A -0.6491
198 A A -1.0415
199 V A -0.0972
200 P A -0.4778
201 C A 0.0000
202 A A -1.0216
203 P A -1.9593
204 S A -1.4555
205 P A -1.0769
206 C A -1.3484
207 R A -2.1646
208 N A -1.5338
209 G A -1.2645
210 G A -1.4589
211 T A -1.3957
212 C A -1.7495
213 R A -2.8885
214 Q A -2.9108
215 S A -2.0152
216 G A -1.6038
217 D A -3.4998
218 L A -1.6105
219 T A -1.3181
220 Y A 0.0000
221 D A -1.9086
222 C A -0.7586
223 A A -0.2816
224 C A 0.0000
225 L A 1.2342
226 P A 0.3982
227 G A 0.5742
228 F A 1.0223
229 E A -0.5849
230 G A -1.4546
231 Q A -1.8507
232 N A -1.5025
233 C A -1.2698
234 E A -1.0442
235 V A -0.0019
236 N A -0.0500
237 V A -0.4959
238 D A -2.4681
239 D A -2.6910
240 C A -1.4991
241 P A -1.1174
242 G A -1.4601
243 H A -1.3748
244 R A -2.1842
245 C A 0.0000
246 L A -0.3569
247 N A 0.0000
248 G A -0.4848
249 G A -1.0883
250 T A 0.0000
251 C A -0.5109
252 V A -0.5060
253 D A -1.6418
254 G A -0.8149
255 V A -0.0507
256 N A -1.1359
257 T A -0.8774
258 Y A -0.4745
259 N A -0.3974
260 C A 0.0000
261 Q A -0.4983
262 C A 0.0000
263 P A -0.4934
264 P A -0.3886
265 E A 0.0000
266 W A 0.0000
267 T A 0.0000
268 G A 0.2251
269 Q A -0.0983
270 F A 1.3149
271 C A 0.0000
272 T A 0.0000
273 E A -0.8410
274 D A -0.6554
275 V A 0.0000
276 D A 0.0000
277 E A -0.0251
278 C A 0.1716
279 Q A 0.0000
280 L A 0.9360
281 Q A 0.1355
282 P A -0.3885
283 N A -0.4918
284 A A -0.6538
285 C A -0.2443
286 H A -0.8576
287 N A -0.6966
288 G A 0.0000
289 G A 0.0000
290 T A 0.0000
291 C A 0.0000
292 F A 0.6321
293 N A 0.0000
294 T A 0.2962
295 L A 0.6163
296 G A -0.2170
297 G A -0.1951
298 H A -0.3442
299 S A -0.4238
300 C A 0.0000
301 V A -0.5035
302 C A 0.0000
303 V A 0.0000
304 N A -1.7261
305 G A -1.2627
306 W A -1.3971
307 T A 0.0000
308 G A -1.4626
309 E A -1.9127
310 S A -1.2812
311 C A -1.3203
312 S A -1.3232
313 Q A -1.9405
314 N A -2.0865
315 I A -1.1606
316 D A -1.0966
317 D A -0.4820
318 C A 0.4737
319 A A 0.4959
320 T A 0.0247
321 A A 0.0000
322 V A 1.0575
323 C A 0.5617
324 F A 0.0467
325 H A -0.9624
326 G A -0.7854
327 A A -0.3310
328 T A -0.4063
329 C A 0.2126
330 H A -0.7979
331 D A -0.8836
332 R A -1.1077
333 V A 0.0000
334 A A 0.0000
335 S A 0.0000
336 F A 0.0000
337 Y A 0.0000
338 C A 0.0000
339 A A 0.0000
340 C A 0.0000
341 P A -0.1152
342 M A 0.0540
343 G A 0.0872
344 K A 0.0000
345 T A -0.4137
346 G A -0.4525
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 -0.9054
353 D A 0.0000
354 A A -0.8245
355 C A 0.0000
356 V A -0.1314
357 S A -0.7960
358 N A -1.3906
359 P A -1.2679
360 C A -0.8630
361 H A -1.8151
362 E A -2.7013
363 D A -2.2836
364 A A -0.7259
365 I A 0.9711
366 C A 0.5369
367 D A -0.2614
368 T A 0.0000
369 N A 0.0000
370 P A 0.0000
371 V A 0.0000
372 N A 0.0000
373 G A -1.2132
374 R A -2.0363
375 A A -0.9938
376 I A 0.0000
377 C A 0.0590
378 T A 0.0000
379 C A 0.0000
380 P A -0.4007
381 P A 0.0000
382 G A -1.1368
383 F A -0.9110
384 T A 0.0000
385 G A -1.6452
386 G A -0.8831
387 A A -0.5779
388 C A -0.9971
389 D A -2.5008
390 Q A -2.5611
391 D A -2.4208
392 V A -1.1112
393 D A -1.3100
394 E A 0.0000
395 C A -0.1262
396 S A 0.4498
397 I A 1.3878
398 G A 0.2430
399 A A -0.4329
400 N A -1.3146
401 P A -1.3125
402 C A 0.0000
403 E A -1.4808
404 H A -1.4724
405 L A -1.0032
406 G A -1.5273
407 R A -2.0308
408 C A 0.0000
409 V A 0.1669
410 N A -0.3654
411 T A -0.1101
412 Q A -0.6697
413 G A -0.9773
414 S A -0.5990
415 F A 0.0000
416 L A -0.0522
417 C A -0.9934
418 Q A -1.3708
419 C A -1.0988
420 G A -0.9315
421 R A -1.0082
422 G A -0.7431
423 Y A -0.7290
424 T A -0.8182
425 G A -1.1572
426 P A -0.8823
427 R A -1.5830
428 C A 0.0000
429 E A -1.6740
430 T A 0.0000
431 D A -1.3906
432 V A 0.0000
433 N A 0.0000
434 E A -1.1449
435 C A 0.0000
436 L A -0.5233
437 S A -0.4680
438 G A 0.0000
439 P A 0.0000
440 C A 0.0000
441 R A -2.5431
442 N A -2.3895
443 Q A -1.7008
444 A A -0.9593
445 T A -0.3002
446 C A 0.0000
447 L A 0.0000
448 D A 0.0000
449 R A -1.5395
450 I A 0.0000
451 G A -1.2860
452 Q A -1.4069
453 F A 0.0000
454 T A -0.2707
455 C A 0.0000
456 I A 0.9306
457 C A 0.0000
458 M A 1.7640
459 A A 0.6597
460 G A -0.2626
461 F A 0.0000
462 T A 0.0000
463 G A 0.8152
464 T A 0.3084
465 Y A 0.0000
466 C A 0.0000
467 E A -1.4301
468 V A 0.0000
469 D A 0.0000
470 I A -0.5845
471 D A 0.0000
472 E A -1.9352
473 C A 0.0000
474 Q A -1.7615
475 S A -1.2709
476 S A -0.7692
477 P A -0.5812
478 C A 0.2470
479 V A 0.5563
480 N A -0.3132
481 G A -0.3178
482 G A 0.0538
483 V A 0.7302
484 C A -0.5752
485 K A -2.2551
486 D A -2.1090
487 R A -1.8651
488 V A 0.3756
489 N A -0.6680
490 G A -0.7272
491 F A -0.6473
492 S A -0.4601
493 C A 0.0000
494 T A -0.1195
495 C A 0.0000
496 P A -0.5299
497 S A -1.0773
498 G A -0.7400
499 F A 1.1722
500 S A 0.5087
501 G A 0.1905
502 S A -0.1483
503 T A -0.1345
504 C A 0.1828
505 Q A -0.2872
506 L A 0.7085
507 D A -0.3278
508 V A 0.2046
509 D A -1.5953
510 E A -0.7330
511 C A -0.7666
512 A A -0.5318
513 S A -0.4017
514 T A -0.2479
515 P A -0.7159
516 C A -1.5573
517 R A -2.8268
518 N A -2.2587
519 G A -1.7349
520 A A -1.9025
521 K A -2.1472
522 C A -1.0240
523 V A -1.1016
524 D A -1.6664
525 Q A -2.1315
526 P A -1.9888
527 D A -2.2093
528 G A -1.1949
529 Y A -0.0851
530 E A -0.4648
531 C A 0.0000
532 R A -1.5231
533 C A 0.0000
534 A A -1.2621
535 E A -1.0481
536 G A 0.0268
537 F A 0.3673
538 E A -1.6945
539 G A -1.2075
540 T A -0.6633
541 L A -0.1020
542 C A -0.9916
543 D A -1.1402
544 R A -1.4315
545 N A 0.0000
546 V A 1.2466
547 D A -0.0105
548 D A 0.5289
549 C A 0.1781
550 S A -1.0422
551 P A -1.6929
552 D A -2.4121
553 P A -1.5282
554 C A -1.8789
555 H A -2.4573
556 H A -2.3659
557 G A -1.5296
558 R A -1.8011
559 C A -0.0529
560 V A 0.8444
561 D A 0.4563
562 G A 0.9142
563 I A 1.7528
564 A A 1.1930
565 S A 1.2082
566 F A 2.0466
567 S A 0.8521
568 C A -0.0000
569 A A -0.1710
570 C A -0.8814
571 A A -0.8762
572 P A -0.4472
573 G A -1.0131
574 Y A -1.1117
575 T A -1.8106
576 G A -1.8130
577 T A -1.8003
578 R A -2.1963
579 C A -1.5614
580 E A -2.3625
581 S A -1.6819
582 Q A -1.5211
583 V A -0.5540
584 D A -2.6127
585 E A -2.5837
586 C A 0.0000
587 R A -2.8352
588 S A -2.1089
589 Q A -2.2248
590 P A -1.9326
591 C A 0.0000
592 R A -2.0123
593 H A -2.0573
594 G A -1.9099
595 G A -2.3873
596 K A -2.5944
597 C A 0.0000
598 L A 0.0142
599 D A 0.0916
600 L A 1.4766
601 V A 1.4981
602 D A -0.8778
603 K A -0.9683
604 Y A 0.5537
605 L A 0.7310
606 C A -0.8029
607 R A -2.3373
608 C A -2.0640
609 P A -1.5456
610 S A -1.2416
611 G A -1.4067
612 T A -0.9747
613 T A -0.7530
614 G A -0.4250
615 V A 0.5019
616 N A -1.1274
617 C A -1.3964
618 E A -1.4898
619 V A -1.3530
620 N A -1.9957
621 I A -2.0008
622 D A -2.6595
623 D A -2.3568
624 C A -1.3949
625 A A -0.7643
626 S A -0.8739
627 N A -0.3030
628 P A -0.1921
629 C A 0.7071
630 T A 0.8226
631 F A 1.6274
632 G A 1.4847
633 V A 1.5797
634 C A 0.0000
635 R A -2.2595
636 D A -2.4471
637 G A -1.7667
638 I A -0.6971
639 N A -2.2080
640 R A -2.6272
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2262 S A -0.3440
2263 L A -0.2234
2264 S A -0.4942
2265 D A -1.3352
2266 W A 0.0656
2267 S A -0.4837
2268 E A -0.9971
2269 S A -0.6458
2270 T A -0.6261
2271 P A -0.5555
2272 S A -0.4473
2273 P A -0.5624
2274 A A -0.4646
2275 T A 0.0000
2276 A A -0.1083
2277 T A 0.0000
2278 G A -0.2831
2279 A A 0.0015
2280 M A 0.5396
2281 A A 0.0000
2282 T A 0.0000
2283 T A -0.4170
2284 T A -0.2391
2285 G A 0.0600
2286 A A 0.4311
2287 L A 0.7456
2288 P A -0.3694
2289 A A 0.0000
2290 Q A -1.5565
2291 P A -0.7714
2292 L A -0.0621
2293 P A 0.4600
2294 L A 1.8794
2295 S A 1.5333
2296 V A 2.1935
2297 P A 1.2416
2298 S A 0.4891
2299 S A 0.8374
2300 L A 1.3547
2301 A A 0.3622
2302 Q A -0.4395
2303 A A -0.5775
2304 Q A -1.2137
2305 T A -1.2509
2306 Q A -1.6756
2307 L A -0.9391
2308 G A -0.6658
2309 P A -0.6125
2310 Q A -0.2050
2311 P A -0.1807
2312 E A -0.3885
2313 V A 0.7280
2314 T A -0.2299
2315 P A -1.1079
2316 K A -1.9104
2317 R A -2.1281
2318 Q A -0.9478
2319 V A 0.2101
2320 L A 0.2679
2321 A A 0.4953
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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, -0.5544 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_2 -0.5544 View CSV PDB
model_1 -0.5752 View CSV PDB
model_4 -0.579 View CSV PDB
model_7 -0.5805 View CSV PDB
model_3 -0.594 View CSV PDB
model_8 -0.5944 View CSV PDB
model_6 -0.5963 View CSV PDB
model_5 -0.5974 View CSV PDB
CABS_average -0.5987 View CSV PDB
model_9 -0.6012 View CSV PDB
model_0 -0.6065 View CSV PDB
model_10 -0.6135 View CSV PDB
model_11 -0.6923 View CSV PDB
input -0.7753 View CSV PDB