Project name: R1220G_4D

Status: done

Started: 2026-05-15 06:36:28
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLVSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:17:26)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (16:18:01)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (16:19:07)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (16:20:12)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (16:21:18)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (16:22:19)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (16:23:25)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (16:24:26)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (16:25:30)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (16:26:33)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (16:27:35)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (16:28:40)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (16:29:42)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (16:30:44)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (16:32:50)
[INFO]       Main:     Simulation completed successfully.                                          (16:33:51)
Show buried residues

Minimal score value
-4.1805
Maximal score value
4.3891
Average score
-0.5583
Total score value
-1295.7778

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 0.0203
2 G A -0.7685
3 P A -0.6715
4 G A -0.6291
5 A A -0.5613
6 R A -1.1525
7 G A -1.3774
8 R A -2.0993
9 R A -3.1183
10 R A -2.8996
11 R A -3.0431
12 R A -2.4666
13 R A 0.0000
14 P A -0.9369
15 M A 0.5744
16 S A 0.0000
17 P A -0.2367
18 P A -0.4047
19 P A -0.6024
20 P A -0.3016
21 P A 0.0000
22 P A 0.0000
23 P A -0.1633
24 V A 0.0000
25 R A -1.3569
26 A A -0.2080
27 L A 0.7271
28 P A 1.3727
29 L A 2.9004
30 L A 2.6804
31 L A 0.0000
32 L A 0.0000
33 L A 1.7748
34 A A 0.0000
35 G A -1.3829
36 P A 0.0000
37 G A 0.0000
38 A A 0.0000
39 A A 0.0000
40 A A 0.0000
41 P A 0.0000
42 P A 0.0000
43 C A -0.6803
44 L A -0.6773
45 D A -1.9412
46 G A -1.3050
47 S A -0.9712
48 P A -0.6471
49 C A -0.6245
50 A A -1.1349
51 N A -2.0854
52 G A -1.7216
53 G A -1.7827
54 R A -2.0699
55 C A -0.4695
56 T A -0.4824
57 Q A -0.4642
58 L A 0.8369
59 P A 0.0202
60 S A -0.2723
61 R A 0.0000
62 E A -0.8273
63 A A 0.0000
64 A A 0.0000
65 C A 0.0000
66 L A -0.6414
67 C A 0.0000
68 P A -1.1156
69 P A -0.7378
70 G A -0.7116
71 W A -0.5749
72 V A 0.0000
73 G A -0.1669
74 E A 0.0000
75 R A 0.0000
76 C A 0.0000
77 Q A 0.0000
78 L A 0.0000
79 E A -1.5261
80 D A 0.0000
81 P A -0.3879
82 C A -0.2297
83 H A -1.1791
84 S A -1.0811
85 G A -1.3371
86 P A -0.7398
87 C A -0.6798
88 A A -0.3664
89 G A -1.3441
90 R A -2.3605
91 G A -1.4735
92 V A -0.4161
93 C A -0.7355
94 Q A -1.2783
95 S A -0.6371
96 S A 0.0000
97 V A 0.0000
98 V A 0.0000
99 A A 0.0000
100 G A -1.5685
101 T A -1.0374
102 A A 0.0000
103 R A -1.1049
104 F A -0.5762
105 S A -0.7302
106 C A 0.0000
107 R A -2.0724
108 C A -1.4558
109 P A -1.3371
110 R A -1.5717
111 G A -1.4188
112 F A 0.0000
113 R A 0.0000
114 G A -1.0089
115 P A -0.9326
116 D A 0.0000
117 C A 0.4867
118 S A 0.6112
119 L A 1.0505
120 P A -0.9236
121 D A -2.0052
122 P A -1.6549
123 C A 0.0000
124 L A -0.4690
125 S A -0.4712
126 S A -0.7606
127 P A -0.7021
128 C A -0.9619
129 A A -0.5829
130 H A -1.4445
131 G A -1.4573
132 A A 0.0000
133 R A -2.2834
134 C A 0.0000
135 S A -0.3490
136 V A -0.6690
137 G A -1.2145
138 P A -1.4688
139 D A -2.7486
140 G A -2.3617
141 R A -2.0466
142 F A -0.4150
143 L A 0.8664
144 C A 0.0000
145 S A -0.9302
146 C A 0.0000
147 P A -1.0482
148 P A -0.5178
149 G A -0.4643
150 Y A -0.6434
151 Q A -1.7952
152 G A -1.6814
153 R A -2.6906
154 S A -1.8739
155 C A 0.0000
156 R A -2.5112
157 S A 0.0000
158 D A -1.6108
159 V A -0.2490
160 D A -1.7963
161 E A -1.1668
162 C A 0.0000
163 R A -2.0266
164 V A -1.6001
165 G A -1.6835
166 E A -2.6019
167 P A -2.2991
168 C A -2.0726
169 R A -2.5316
170 H A -2.2138
171 G A -1.3618
172 G A -1.1479
173 T A -1.3442
174 C A -0.5758
175 L A 0.2388
176 N A -0.8201
177 T A -0.8173
178 P A -0.4367
179 G A -0.8532
180 S A -0.5667
181 F A -0.3380
182 R A -1.4585
183 C A -0.9773
184 Q A -1.7254
185 C A 0.0000
186 P A -1.0878
187 A A -0.4367
188 G A -0.3305
189 Y A -0.6493
190 T A -0.7166
191 G A -0.4950
192 P A -0.2890
193 L A -0.1334
194 C A 0.0000
195 E A -2.2894
196 N A -1.6063
197 P A -0.8696
198 A A -0.5662
199 V A -0.0486
200 P A -0.6760
201 C A -1.1788
202 A A -0.3473
203 P A -0.6445
204 S A -0.7854
205 P A -0.9903
206 C A 0.0000
207 R A -2.1480
208 N A -2.2585
209 G A -1.4120
210 G A -1.2031
211 T A -1.2379
212 C A -1.6153
213 R A -2.7261
214 Q A -2.3034
215 S A -1.5536
216 G A -1.3793
217 D A -2.2476
218 L A -1.4100
219 T A -1.6540
220 Y A 0.0000
221 D A -2.7071
222 C A 0.0000
223 A A -0.8057
224 C A 0.0000
225 L A 0.9154
226 P A 0.5014
227 G A 0.0846
228 F A -0.2171
229 E A -2.1792
230 G A -2.1987
231 Q A -2.9791
232 N A -2.4919
233 C A 0.0000
234 E A -2.5170
235 V A -0.8133
236 N A 0.0000
237 V A 1.2572
238 D A -0.2717
239 D A -1.7660
240 C A 0.0000
241 P A -0.9410
242 G A -1.0701
243 H A -1.4038
244 R A 0.0000
245 C A 0.0000
246 L A 0.5561
247 N A -0.3810
248 G A -0.6209
249 G A -0.5607
250 T A -0.6641
251 C A -0.2480
252 V A -0.0144
253 D A -0.7343
254 G A -0.8627
255 V A -0.9500
256 N A -1.9725
257 T A -0.8822
258 Y A -0.6473
259 N A -0.9326
260 C A 0.0000
261 Q A -0.7768
262 C A 0.0000
263 P A -0.5516
264 P A -0.1532
265 E A -0.7585
266 W A -0.8268
267 T A 0.0000
268 G A -1.0382
269 Q A -0.9035
270 F A 0.0887
271 C A 0.1426
272 T A -0.7768
273 E A -2.2167
274 D A -2.2803
275 V A -1.1105
276 D A -1.5128
277 E A -0.9872
278 C A -0.7833
279 Q A -1.2514
280 L A -0.0442
281 Q A -0.6885
282 P A -0.5355
283 N A -0.8804
284 A A -0.7831
285 C A -0.8323
286 H A -1.1622
287 N A -1.2583
288 G A 0.0000
289 G A -0.1651
290 T A 0.4949
291 C A 1.1264
292 F A 1.9444
293 N A 0.2007
294 T A 0.3570
295 L A 0.6743
296 G A -0.4411
297 G A -0.3314
298 H A -0.6099
299 S A 0.3033
300 C A 0.5415
301 V A 1.2966
302 C A 0.0000
303 V A 0.0000
304 N A 0.0000
305 G A 0.0000
306 W A 0.0000
307 T A 0.0000
308 G A -0.5470
309 E A -1.8074
310 S A -1.3777
311 C A 0.0000
312 S A -1.1934
313 Q A -1.5229
314 N A -0.5275
315 I A 1.0914
316 D A 0.1561
317 D A 0.0000
318 C A -0.0169
319 A A 0.5992
320 T A 0.5233
321 A A 0.2737
322 V A 1.2732
323 C A 1.4737
324 F A 2.2373
325 H A 0.3972
326 G A -0.3603
327 A A -0.6436
328 T A -0.3383
329 C A 0.0664
330 H A -1.2213
331 D A -2.5192
332 R A -2.8442
333 V A 0.0000
334 A A 0.0000
335 S A 0.0000
336 F A 0.0000
337 Y A -0.3307
338 C A 0.0000
339 A A 0.6954
340 C A 0.4504
341 P A -0.0810
342 M A -0.2534
343 G A -1.1455
344 K A -1.4444
345 T A -0.7405
346 G A 0.0000
347 L A 0.7425
348 L A 1.8432
349 C A 0.0000
350 H A -0.6953
351 L A -0.4756
352 D A -2.3390
353 D A -1.9643
354 A A -0.7705
355 C A -0.1072
356 V A 0.9561
357 S A -0.3619
358 N A -1.4936
359 P A -1.2219
360 C A -1.6712
361 H A -2.3201
362 E A -2.9383
363 D A -2.6218
364 A A -1.1955
365 I A 0.2855
366 C A 0.0000
367 D A -0.5879
368 T A 0.0000
369 N A 0.0000
370 P A -0.3346
371 V A -0.3394
372 N A -1.5493
373 G A -1.4988
374 R A -1.6465
375 A A -0.6123
376 I A 0.0000
377 C A 0.0000
378 T A -0.3512
379 C A -1.2229
380 P A -1.1084
381 P A -0.3849
382 G A 0.3316
383 F A -0.2037
384 T A -0.7979
385 G A -1.2026
386 G A -1.1026
387 A A -0.7667
388 C A 0.0000
389 D A -2.0893
390 Q A -1.6245
391 D A 0.0000
392 V A 0.7189
393 D A -0.0256
394 E A 0.0024
395 C A 0.0000
396 S A 0.0000
397 I A 0.4145
398 G A 0.1095
399 A A 0.7787
400 N A -0.6976
401 P A -1.4005
402 C A 0.0000
403 E A -1.0135
404 H A 0.0000
405 L A 0.9062
406 G A -0.2636
407 R A -0.6042
408 C A 0.0000
409 V A 0.0000
410 N A 0.0000
411 T A -0.4634
412 Q A -0.9319
413 G A -0.4642
414 S A -0.5206
415 F A 0.0000
416 L A 0.0424
417 C A 0.0000
418 Q A 0.0000
419 C A 0.0000
420 G A 0.0000
421 R A -2.0072
422 G A -0.7993
423 Y A -0.6380
424 T A -0.7527
425 G A -1.0176
426 P A -1.2633
427 R A -1.9763
428 C A 0.0000
429 E A -2.2117
430 T A -1.0282
431 D A 0.0000
432 V A -0.0957
433 N A -0.8770
434 E A -0.7890
435 C A 0.4587
436 L A 0.6147
437 S A 0.1125
438 G A 0.2546
439 P A -0.7001
440 C A -1.4856
441 R A -2.7323
442 N A -1.8482
443 Q A -1.3707
444 A A 0.0000
445 T A 0.8007
446 C A 0.9874
447 L A 1.0536
448 D A -0.2286
449 R A -0.0861
450 I A 0.2721
451 G A 0.1618
452 Q A 0.0528
453 F A 0.5165
454 T A 0.9847
455 C A 1.5193
456 I A 2.3114
457 C A 1.2025
458 M A 0.9324
459 A A -0.3019
460 G A -0.7186
461 F A 0.3691
462 T A -0.2747
463 G A 0.2239
464 T A 0.3194
465 Y A 1.2732
466 C A 0.0000
467 E A -0.9570
468 V A 0.0000
469 D A -2.5341
470 I A -1.9106
471 D A -2.3278
472 E A -3.1127
473 C A 0.0000
474 Q A -2.6779
475 S A -1.7825
476 S A -1.0670
477 P A -0.7608
478 C A 0.0000
479 V A -0.3954
480 N A -1.2050
481 G A -1.0563
482 G A -1.1344
483 V A 0.0000
484 C A -1.7163
485 K A -3.0854
486 D A -3.8240
487 R A -2.8538
488 V A -0.5789
489 N A -1.4991
490 G A -1.4144
491 F A -1.4926
492 S A -1.0632
493 C A -0.2745
494 T A -0.2534
495 C A -0.0506
496 P A -0.0473
497 S A -0.1953
498 G A -0.3264
499 F A 1.1087
500 S A 0.0607
501 G A -0.3406
502 S A -0.4159
503 T A -0.4685
504 C A 0.0000
505 Q A -0.5649
506 L A -0.3644
507 D A -1.4085
508 V A -1.6731
509 D A -3.3780
510 E A -2.8806
511 C A -1.1059
512 A A -0.5513
513 S A -0.8863
514 T A -0.4904
515 P A -0.8383
516 C A -1.7547
517 R A -3.0138
518 N A -2.4229
519 G A -2.0008
520 A A -1.9947
521 K A -2.0828
522 C A -0.9716
523 V A -1.0146
524 D A -2.2244
525 Q A -2.7514
526 P A -2.4858
527 D A -3.3534
528 G A -1.9529
529 Y A -1.3326
530 E A -2.1387
531 C A -1.6838
532 R A -2.4959
533 C A -2.0713
534 A A -0.8235
535 E A -1.2046
536 G A 0.0913
537 F A 0.9212
538 E A -0.1553
539 G A -0.4788
540 T A -0.1071
541 L A 0.2022
542 C A 0.0540
543 D A -0.9519
544 R A 0.0000
545 N A 0.5540
546 V A 0.1067
547 D A -1.2154
548 D A -2.1378
549 C A 0.0000
550 S A -1.7094
551 P A -2.0605
552 D A -2.7726
553 P A 0.0000
554 C A 0.0000
555 H A -2.7175
556 H A -2.2084
557 G A -2.1305
558 R A -2.1682
559 C A 0.0000
560 V A 0.0335
561 D A 0.0000
562 G A 0.7848
563 I A 1.5862
564 A A 0.3657
565 S A 0.3179
566 F A 0.1607
567 S A -0.0658
568 C A -0.8952
569 A A -1.0329
570 C A 0.0000
571 A A -1.3975
572 P A -1.3235
573 G A -0.9261
574 Y A -0.2548
575 T A 0.0000
576 G A -1.2978
577 T A -1.5755
578 R A -2.5217
579 C A -1.1551
580 E A -2.2524
581 S A -1.2709
582 Q A -1.1998
583 V A -0.1526
584 D A -2.5042
585 E A -2.1018
586 C A 0.0000
587 R A -2.2387
588 S A -2.1524
589 Q A -1.5741
590 P A -1.2892
591 C A -1.5800
592 R A -2.8192
593 H A -2.2816
594 G A -1.6730
595 G A -1.5749
596 K A -1.3193
597 C A -0.8256
598 L A 0.8867
599 D A 0.0334
600 L A 1.4400
601 V A 0.8825
602 D A -1.3690
603 K A -0.6151
604 Y A 0.8040
605 L A 1.3895
606 C A -0.2860
607 R A -1.6451
608 C A -1.3684
609 P A -0.9968
610 S A -0.3013
611 G A -0.6468
612 T A -0.0198
613 T A 0.5645
614 G A 0.9953
615 V A 1.2152
616 N A -0.2941
617 C A 0.0000
618 E A 0.0000
619 V A 1.5588
620 N A 0.8042
621 I A 1.1685
622 D A -1.0737
623 D A -1.5156
624 C A -0.9183
625 A A -0.6409
626 S A -0.7821
627 N A -0.3384
628 P A 0.1536
629 C A 0.6903
630 T A 0.7975
631 F A 1.6311
632 G A 0.3411
633 V A -0.2006
634 C A -1.4167
635 R A -2.9661
636 D A -3.0118
637 G A -1.7975
638 I A 0.2170
639 N A -1.6993
640 R A -2.8868
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2262 S A 0.0000
2263 L A -0.2749
2264 S A -0.7355
2265 D A -1.0918
2266 W A -0.0374
2267 S A -0.7762
2268 E A -1.9411
2269 S A -1.3212
2270 T A -1.3997
2271 P A -0.8794
2272 S A -0.7462
2273 P A -0.6772
2274 A A -0.3521
2275 T A -0.5688
2276 A A -0.5788
2277 T A -0.5945
2278 G A -0.1629
2279 A A 0.4445
2280 M A 0.7350
2281 A A 0.3169
2282 T A 0.0000
2283 T A -0.4135
2284 T A 0.0000
2285 G A -0.3674
2286 A A -0.4314
2287 L A -0.4760
2288 P A -0.6440
2289 A A -0.4833
2290 Q A -1.2372
2291 P A -0.5122
2292 L A 0.6263
2293 P A 0.8479
2294 L A 2.1240
2295 S A 1.1229
2296 V A 1.4749
2297 P A 0.4780
2298 S A 0.2127
2299 S A -0.8735
2300 L A -0.7285
2301 A A 0.0000
2302 Q A 0.0000
2303 A A -0.0576
2304 Q A -0.4012
2305 T A -0.3035
2306 Q A -0.6965
2307 L A 0.0000
2308 G A 0.0000
2309 P A 0.0000
2310 Q A -1.7368
2311 P A -1.3621
2312 E A -1.6884
2313 V A -0.5784
2314 T A -0.9388
2315 P A -1.6039
2316 K A -3.0232
2317 R A -2.9032
2318 Q A -1.9345
2319 V A -0.0022
2320 L A 0.3519
2321 A A 0.3116
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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, -0.5583 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 -0.5583 View CSV PDB
model_0 -0.5654 View CSV PDB
model_4 -0.5666 View CSV PDB
model_7 -0.568 View CSV PDB
model_10 -0.5704 View CSV PDB
model_2 -0.5706 View CSV PDB
model_3 -0.5765 View CSV PDB
model_6 -0.5775 View CSV PDB
model_9 -0.5803 View CSV PDB
CABS_average -0.5811 View CSV PDB
model_5 -0.5918 View CSV PDB
model_1 -0.5941 View CSV PDB
model_11 -0.6533 View CSV PDB
input -0.7568 View CSV PDB