Project name: R54C

Status: done

Started: 2026-05-06 05:34:04
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGCCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:18:00)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (11:15:54)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (11:16:33)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (11:17:12)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (11:17:51)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (11:18:30)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (11:19:10)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (11:19:49)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (11:20:28)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (11:21:08)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (11:21:48)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (11:22:28)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (11:23:07)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (11:23:46)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (11:25:09)
[INFO]       Main:     Simulation completed successfully.                                          (11:25:47)
Show buried residues

Minimal score value
-3.8472
Maximal score value
4.298
Average score
-0.5972
Total score value
-1386.1344

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 -0.5225
2 G A 0.0000
3 P A -0.5567
4 G A -0.9424
5 A A -1.7574
6 R A -2.8544
7 G A -2.6098
8 R A 0.0000
9 R A -3.2180
10 R A -2.7480
11 R A 0.0000
12 R A -2.5534
13 R A -1.6740
14 P A -1.0327
15 M A 0.0315
16 S A -0.1654
17 P A -0.4381
18 P A -0.3113
19 P A -0.7908
20 P A -0.4699
21 P A -0.9839
22 P A -1.2430
23 P A -1.9460
24 V A 0.0000
25 R A -2.9605
26 A A 0.0000
27 L A 0.0000
28 P A -0.6238
29 L A 0.0000
30 L A 0.7382
31 L A 0.6409
32 L A 1.1572
33 L A 0.8891
34 A A 0.4788
35 G A 0.0733
36 P A -0.3106
37 G A -0.5275
38 A A -0.3692
39 A A -0.3311
40 A A -0.9099
41 P A -0.8281
42 P A -0.9842
43 C A 0.0000
44 L A -0.3693
45 D A -1.5906
46 G A -1.0311
47 S A -0.6271
48 P A -0.5267
49 C A -0.2454
50 A A -0.5310
51 N A -1.0125
52 G A -1.0265
53 G A -0.5739
54 C A 0.0000
55 C A -0.2908
56 T A -0.4687
57 Q A -1.8049
58 L A 0.0000
59 P A -1.1077
60 S A -0.9928
61 R A -1.5848
62 E A -2.1752
63 A A -1.4252
64 A A 0.0000
65 C A 0.0000
66 L A -0.1676
67 C A 0.0000
68 P A -0.9818
69 P A -0.6510
70 G A -1.1795
71 W A -1.3837
72 V A 0.0000
73 G A -1.5322
74 E A -2.1127
75 R A -1.5240
76 C A 0.0000
77 Q A -1.6504
78 L A 0.0000
79 E A -3.1491
80 D A -3.0735
81 P A -2.1036
82 C A -1.5589
83 H A -1.3711
84 S A -1.5877
85 G A -1.2096
86 P A -1.0472
87 C A -0.7927
88 A A -0.6855
89 G A -1.0563
90 R A -1.4852
91 G A -0.9739
92 V A -0.7629
93 C A -0.8316
94 Q A -1.6220
95 S A -0.9960
96 S A -0.2184
97 V A 0.1640
98 V A 1.3009
99 A A 0.4382
100 G A -0.6423
101 T A -0.6643
102 A A -1.1654
103 R A -1.8926
104 F A -1.5202
105 S A -1.4504
106 C A 0.0000
107 R A -2.6655
108 C A 0.0000
109 P A -1.7093
110 R A -2.1621
111 G A -1.2637
112 F A -1.4764
113 R A -1.9425
114 G A -1.6676
115 P A -1.7153
116 D A -1.9956
117 C A -1.0637
118 S A -0.2942
119 L A 0.1723
120 P A -0.6856
121 D A -1.2032
122 P A -0.1086
123 C A 0.7479
124 L A 1.4305
125 S A 0.5167
126 S A 0.6844
127 P A 0.2924
128 C A -0.3390
129 A A -1.0743
130 H A -1.7953
131 G A -1.6491
132 A A 0.0000
133 R A -1.2230
134 C A 0.6336
135 S A 0.7390
136 V A 0.9419
137 G A -0.4992
138 P A -1.1982
139 D A -2.6044
140 G A -1.6778
141 R A -1.5408
142 F A 0.3601
143 L A 1.4453
144 C A 1.1311
145 S A 0.3773
146 C A 0.3359
147 P A -0.3418
148 P A -0.4788
149 G A -1.0050
150 Y A -0.8526
151 Q A -2.2026
152 G A -1.9652
153 R A -2.5959
154 S A -1.4487
155 C A -1.0511
156 R A -2.2203
157 S A 0.0000
158 D A -2.4177
159 V A -1.0854
160 D A -1.6649
161 E A -1.7261
162 C A -0.4492
163 R A -1.0204
164 V A 0.4186
165 G A -0.1080
166 E A -0.6400
167 P A -0.8854
168 C A -1.2764
169 R A -1.8836
170 H A -1.9740
171 G A -1.5959
172 G A -1.4975
173 T A -0.8532
174 C A -0.2311
175 L A 0.3105
176 N A -1.0360
177 T A -1.0156
178 P A -1.5203
179 G A -1.3874
180 S A -1.0208
181 F A 0.0000
182 R A -1.9265
183 C A 0.0000
184 Q A -1.7789
185 C A -1.5622
186 P A -1.1091
187 A A -0.3628
188 G A -0.8271
189 Y A -1.0444
190 T A 0.0000
191 G A 0.0000
192 P A -0.4832
193 L A 0.6479
194 C A -0.2854
195 E A -1.4997
196 N A -1.3780
197 P A -0.7807
198 A A 0.0782
199 V A 1.1091
200 P A 0.0555
201 C A -0.4366
202 A A -0.0836
203 P A -0.5211
204 S A 0.0000
205 P A -0.7640
206 C A -1.5835
207 R A -2.5837
208 N A -2.4904
209 G A -1.6098
210 G A -1.0139
211 T A -1.2592
212 C A -1.6854
213 R A -2.5820
214 Q A -2.4042
215 S A -1.8673
216 G A -1.5887
217 D A -2.0177
218 L A -1.2606
219 T A -1.1448
220 Y A -1.3593
221 D A -1.9311
222 C A 0.0000
223 A A -1.7031
224 C A 0.0000
225 L A -0.5276
226 P A -0.6036
227 G A 0.4897
228 F A 0.7378
229 E A -1.6696
230 G A -2.2844
231 Q A -2.5259
232 N A -2.8799
233 C A 0.0000
234 E A -2.5078
235 V A 0.0000
236 N A 0.0000
237 V A 1.0375
238 D A -0.1034
239 D A -0.8647
240 C A 0.0000
241 P A -1.0532
242 G A -1.3804
243 H A -1.5634
244 R A -2.0867
245 C A -1.0378
246 L A -0.3161
247 N A -1.1209
248 G A -1.0616
249 G A -1.1668
250 T A -0.5043
251 C A 0.2156
252 V A 1.0641
253 D A 0.2101
254 G A -0.1812
255 V A -0.1448
256 N A 0.0000
257 T A -0.1650
258 Y A 0.0960
259 N A -0.6154
260 C A 0.0000
261 Q A -0.9469
262 C A -1.1440
263 P A -1.0213
264 P A -1.1863
265 E A -2.0777
266 W A -0.8848
267 T A -0.8190
268 G A -0.9288
269 Q A -1.1761
270 F A -0.1681
271 C A 0.0000
272 T A -1.3237
273 E A -2.1108
274 D A -1.7991
275 V A -1.4612
276 D A -2.3362
277 E A -1.5464
278 C A 0.0000
279 Q A -1.3048
280 L A -0.4682
281 Q A -1.1162
282 P A -0.9715
283 N A -1.8527
284 A A -0.8500
285 C A 0.0000
286 H A -0.6403
287 N A -1.0438
288 G A 0.0000
289 G A 0.0000
290 T A 0.0452
291 C A 0.5371
292 F A 1.3328
293 N A -0.3668
294 T A 0.2051
295 L A 0.5063
296 G A -1.0513
297 G A -1.0926
298 H A -0.6967
299 S A -0.3073
300 C A 0.0000
301 V A 1.0658
302 C A 0.3406
303 V A 1.3305
304 N A 0.0147
305 G A -0.5855
306 W A 0.0000
307 T A -0.3031
308 G A 0.0000
309 E A -1.6274
310 S A -1.2094
311 C A -0.6514
312 S A -0.8688
313 Q A 0.0000
314 N A -1.7189
315 I A 0.0000
316 D A -1.5090
317 D A -1.0825
318 C A -0.6343
319 A A -0.1383
320 T A -0.3879
321 A A -0.4670
322 V A -0.1435
323 C A 0.0000
324 F A 0.0000
325 H A -1.7015
326 G A -1.3625
327 A A 0.0000
328 T A -0.7727
329 C A 0.0000
330 H A -0.9146
331 D A 0.0000
332 R A 0.0000
333 V A -0.3581
334 A A 0.0000
335 S A 0.0000
336 F A 0.0000
337 Y A 0.1603
338 C A 0.0000
339 A A -0.4202
340 C A 0.0000
341 P A -0.8122
342 M A -0.6344
343 G A -0.8119
344 K A -1.5865
345 T A 0.0000
346 G A 0.0000
347 L A 0.0000
348 L A 0.0000
349 C A 0.0000
350 H A -1.6996
351 L A -0.9250
352 D A -1.0483
353 D A -1.3087
354 A A -0.6374
355 C A 0.0000
356 V A 0.8394
357 S A 0.0620
358 N A -0.4827
359 P A -1.0240
360 C A -0.8456
361 H A -1.7814
362 E A -2.6079
363 D A -2.2717
364 A A -0.5431
365 I A 1.4015
366 C A 0.4272
367 D A -0.8820
368 T A 0.0000
369 N A -1.1638
370 P A 0.0000
371 V A 0.0000
372 N A -2.1764
373 G A -1.2551
374 R A 0.0000
375 A A -0.6469
376 I A 0.0000
377 C A 0.0000
378 T A 0.0000
379 C A 0.1010
380 P A -0.3941
381 P A -0.7766
382 G A 0.0000
383 F A 0.0000
384 T A -1.7413
385 G A 0.0000
386 G A -1.2789
387 A A -1.8332
388 C A 0.0000
389 D A -2.8817
390 Q A 0.0000
391 D A -2.7306
392 V A -2.1506
393 D A -2.2665
394 E A -1.7345
395 C A -0.2230
396 S A -0.4148
397 I A 0.0000
398 G A -0.2160
399 A A -0.7895
400 N A -1.3770
401 P A -1.1396
402 C A 0.0000
403 E A -1.8657
404 H A -1.0378
405 L A 0.0000
406 G A -1.2255
407 R A -1.5684
408 C A 0.0000
409 V A 0.0000
410 N A -0.3218
411 T A -0.3956
412 Q A -1.1069
413 G A -0.7680
414 S A -0.3927
415 F A -0.3973
416 L A -0.5668
417 C A 0.0000
418 Q A 0.0000
419 C A 0.0000
420 G A 0.0000
421 R A -0.4436
422 G A -0.7076
423 Y A 0.0662
424 T A 0.0000
425 G A 0.0000
426 P A -0.9663
427 R A -2.1893
428 C A 0.0000
429 E A -1.3326
430 T A 0.0000
431 D A 0.0000
432 V A 0.0000
433 N A -0.5753
434 E A -0.4615
435 C A 0.0000
436 L A -0.0423
437 S A -0.2958
438 G A 0.2304
439 P A 0.0000
440 C A 0.7877
441 R A 0.0709
442 N A -0.4250
443 Q A -0.9827
444 A A 0.2034
445 T A 0.6150
446 C A 0.9389
447 L A 1.0927
448 D A 0.0000
449 R A -1.2804
450 I A -0.5034
451 G A 0.0000
452 Q A -0.8698
453 F A 0.6171
454 T A 0.8976
455 C A 1.7998
456 I A 2.5138
457 C A 0.0000
458 M A 1.7897
459 A A 0.0000
460 G A 0.8913
461 F A 1.8817
462 T A 0.7100
463 G A 0.1298
464 T A 0.5671
465 Y A 0.8650
466 C A 1.4342
467 E A 0.0000
468 V A 0.4801
469 D A 0.0000
470 I A 0.0000
471 D A -1.2356
472 E A 0.0000
473 C A -1.3591
474 Q A -1.5167
475 S A -0.8257
476 S A -0.4993
477 P A -0.2728
478 C A 0.0000
479 V A 1.1375
480 N A 0.3227
481 G A -0.1907
482 G A -0.3823
483 V A 0.1472
484 C A -0.4228
485 K A -1.8474
486 D A -2.2227
487 R A -1.6820
488 V A 0.4193
489 N A 0.0000
490 G A 0.0000
491 F A 0.0000
492 S A 0.0000
493 C A 0.0000
494 T A -0.1734
495 C A 0.0000
496 P A -0.9803
497 S A -1.3849
498 G A 0.0000
499 F A 0.0000
500 S A -0.8144
501 G A -0.6665
502 S A -0.4722
503 T A -0.1526
504 C A 0.0000
505 Q A -0.8800
506 L A -0.3284
507 D A -1.5981
508 V A -1.3097
509 D A -2.6614
510 E A -3.2146
511 C A 0.0000
512 A A -1.0139
513 S A -0.9495
514 T A -0.5237
515 P A -0.2072
516 C A -0.3696
517 R A -1.5708
518 N A -2.3956
519 G A -2.3476
520 A A -1.5766
521 K A -1.9823
522 C A -0.9266
523 V A -0.9623
524 D A -2.3685
525 Q A -2.1059
526 P A -1.8844
527 D A -2.6691
528 G A -1.9204
529 Y A -1.3217
530 E A -1.7283
531 C A -0.9135
532 R A -2.0088
533 C A -1.8145
534 A A -1.4217
535 E A -2.4558
536 G A -2.2999
537 F A -2.0628
538 E A -1.8517
539 G A -0.9249
540 T A -0.1265
541 L A 0.7838
542 C A 0.3274
543 D A -1.7049
544 R A -1.5148
545 N A -1.7219
546 V A -0.3767
547 D A -1.5916
548 D A -2.2159
549 C A -1.8467
550 S A -1.9864
551 P A -1.8445
552 D A -2.6759
553 P A -2.0585
554 C A -2.1451
555 H A -2.9458
556 H A -2.5328
557 G A -2.0497
558 R A -2.4484
559 C A 0.0000
560 V A -0.5286
561 D A -0.4056
562 G A 0.0037
563 I A 1.5391
564 A A 1.1654
565 S A 0.2754
566 F A 0.1190
567 S A -0.1976
568 C A -1.1163
569 A A -0.9657
570 C A -0.7026
571 A A -0.0797
572 P A -0.3259
573 G A -0.8368
574 Y A -0.4241
575 T A -1.0734
576 G A -1.1422
577 T A -1.2807
578 R A -1.9647
579 C A -1.2447
580 E A -2.2841
581 S A -1.7380
582 Q A -1.4364
583 V A -1.0063
584 D A -1.4404
585 E A -1.8167
586 C A -1.6709
587 R A -2.5577
588 S A -1.9318
589 Q A -2.2499
590 P A -1.8325
591 C A 0.0000
592 R A -2.5952
593 H A -2.7383
594 G A -2.1624
595 G A -1.9103
596 K A -2.2188
597 C A -1.2100
598 L A -0.0786
599 D A -0.0383
600 L A 1.2836
601 V A 0.9565
602 D A -0.9039
603 K A -1.4005
604 Y A -0.1899
605 L A -0.2021
606 C A 0.0000
607 R A -2.5348
608 C A 0.0000
609 P A -1.4500
610 S A -1.4370
611 G A -1.2354
612 T A 0.0000
613 T A 0.0000
614 G A -0.1431
615 V A -0.7725
616 N A -1.2822
617 C A -1.0043
618 E A -0.5454
619 V A 1.5589
620 N A 0.1630
621 I A 0.6915
622 D A -1.5362
623 D A -1.8674
624 C A -0.7250
625 A A -0.2218
626 S A 0.0326
627 N A -0.1167
628 P A -0.0993
629 C A 0.6099
630 T A 0.6230
631 F A 1.9392
632 G A 1.3537
633 V A 1.4552
634 C A -0.1658
635 R A -2.3821
636 D A -2.5237
637 G A -2.4064
638 I A 0.0000
639 N A -2.7408
640 R A -3.1063
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2264 S A 0.1669
2265 D A -1.1163
2266 W A -0.2596
2267 S A -0.8437
2268 E A -1.9167
2269 S A -2.0781
2270 T A 0.0000
2271 P A 0.0000
2272 S A -0.5539
2273 P A -0.6862
2274 A A 0.0000
2275 T A 0.1871
2276 A A 0.1718
2277 T A -0.4487
2278 G A -0.7927
2279 A A -0.9506
2280 M A -0.5898
2281 A A 0.0000
2282 T A -0.1898
2283 T A 0.0058
2284 T A 0.0162
2285 G A 0.1300
2286 A A 0.6083
2287 L A 1.3772
2288 P A 0.5086
2289 A A -0.0231
2290 Q A -0.6239
2291 P A -0.5181
2292 L A 0.0000
2293 P A -0.6620
2294 L A -0.3545
2295 S A -0.8640
2296 V A -1.3372
2297 P A -1.1419
2298 S A -1.2443
2299 S A -0.5968
2300 L A -0.2790
2301 A A -0.4549
2302 Q A -1.1590
2303 A A -0.9666
2304 Q A -1.4614
2305 T A -1.0084
2306 Q A -0.8654
2307 L A 0.0000
2308 G A 0.0000
2309 P A -0.3432
2310 Q A -0.5983
2311 P A -0.7722
2312 E A 0.0000
2313 V A 0.0000
2314 T A -0.5823
2315 P A -1.5421
2316 K A -2.7207
2317 R A -2.9918
2318 Q A -2.2952
2319 V A 0.0000
2320 L A -0.7244
2321 A A -0.4027
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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, -0.5972 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_7 -0.5972 View CSV PDB
model_2 -0.5992 View CSV PDB
model_1 -0.6031 View CSV PDB
model_6 -0.6058 View CSV PDB
model_8 -0.6068 View CSV PDB
model_4 -0.6151 View CSV PDB
CABS_average -0.6234 View CSV PDB
model_0 -0.627 View CSV PDB
model_3 -0.6311 View CSV PDB
model_11 -0.638 View CSV PDB
model_9 -0.6488 View CSV PDB
model_5 -0.6488 View CSV PDB
model_10 -0.6598 View CSV PDB
input -0.7612 View CSV PDB