Project name: R558C_4D

Status: done

Started: 2026-05-09 14:23:40
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGCCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:28:23)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (12:34:10)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (12:34:56)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (12:35:42)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (12:36:27)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (12:37:13)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (12:37:58)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (12:38:44)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (12:39:29)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (12:40:14)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (12:41:00)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (12:41:45)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (12:42:30)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (12:43:15)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (12:44:45)
[INFO]       Main:     Simulation completed successfully.                                          (12:45:30)
Show buried residues

Minimal score value
-4.3694
Maximal score value
5.4219
Average score
-0.5018
Total score value
-1164.7903

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 0.4911
2 G A -0.2131
3 P A -0.6652
4 G A -0.4776
5 A A -0.3873
6 R A 0.0000
7 G A -1.3581
8 R A -2.2120
9 R A -3.2725
10 R A -3.9588
11 R A -4.3694
12 R A -3.9207
13 R A -3.2803
14 P A -1.3698
15 M A 0.0546
16 S A -0.2267
17 P A -0.3984
18 P A -0.6279
19 P A -0.8111
20 P A -1.1288
21 P A -0.3115
22 P A -0.1044
23 P A 0.2978
24 V A 1.3957
25 R A 0.0879
26 A A 0.8808
27 L A 1.9570
28 P A 1.3144
29 L A 1.4335
30 L A 0.9677
31 L A 1.7989
32 L A 2.1056
33 L A 1.8431
34 A A 0.6652
35 G A -0.2326
36 P A -0.7636
37 G A -0.7177
38 A A -0.5317
39 A A -0.2143
40 A A 0.0979
41 P A 0.0000
42 P A 0.1884
43 C A -0.8306
44 L A -1.6594
45 D A -2.3087
46 G A -1.4379
47 S A -0.7672
48 P A -1.1905
49 C A 0.0000
50 A A -0.8778
51 N A -1.4225
52 G A -1.4547
53 G A -1.4603
54 R A -1.9750
55 C A -1.2387
56 T A 0.0000
57 Q A -2.1015
58 L A 0.0000
59 P A -1.2491
60 S A -1.2331
61 R A -2.1252
62 E A -2.8473
63 A A -1.9121
64 A A 0.0000
65 C A 0.0000
66 L A 0.0000
67 C A 0.0000
68 P A -0.1279
69 P A -0.5203
70 G A -0.9653
71 W A 0.0000
72 V A 0.0000
73 G A 0.0000
74 E A 0.1972
75 R A 0.0000
76 C A -0.5890
77 Q A -1.1970
78 L A -1.1210
79 E A -2.3549
80 D A -1.7210
81 P A -1.0841
82 C A -0.7222
83 H A -1.4224
84 S A -0.9224
85 G A -0.6938
86 P A -0.6468
87 C A 0.1253
88 A A -0.1480
89 G A -1.4013
90 R A -2.2395
91 G A -1.2206
92 V A 0.4529
93 C A 0.6911
94 Q A 0.0000
95 S A 0.0000
96 S A 0.0000
97 V A 0.9050
98 V A 1.0347
99 A A 0.3919
100 G A -0.4514
101 T A -0.3151
102 A A 0.0000
103 R A -0.7845
104 F A -0.2212
105 S A 0.0000
106 C A 0.0000
107 R A -0.4433
108 C A 0.0000
109 P A -1.6940
110 R A -2.4545
111 G A -1.1001
112 F A -0.8118
113 R A -0.8797
114 G A 0.0000
115 P A -1.1220
116 D A -1.9599
117 C A -0.8592
118 S A -0.5500
119 L A 0.1842
120 P A -0.9084
121 D A -1.5271
122 P A -0.5953
123 C A 0.5744
124 L A 1.0555
125 S A 0.4104
126 S A -0.0428
127 P A -1.0652
128 C A -0.4965
129 A A 0.0000
130 H A -1.6930
131 G A -1.4068
132 A A -1.5002
133 R A -1.7116
134 C A 0.0000
135 S A 0.4149
136 V A 0.4782
137 G A -0.4585
138 P A -1.3493
139 D A -2.3029
140 G A -1.3741
141 R A -1.3837
142 F A 0.6268
143 L A 0.8453
144 C A -0.1395
145 S A -0.8217
146 C A 0.0000
147 P A -1.0124
148 P A -0.8371
149 G A -1.2315
150 Y A -0.7964
151 Q A -1.7044
152 G A -1.8047
153 R A -2.1323
154 S A -0.8990
155 C A -0.9993
156 R A -2.2334
157 S A -2.1343
158 D A -2.6328
159 V A -1.5410
160 D A -2.2671
161 E A 0.0000
162 C A 0.0000
163 R A -2.4832
164 V A -0.5594
165 G A -1.7054
166 E A -2.7891
167 P A -2.3571
168 C A -2.2904
169 R A -3.2401
170 H A -2.5807
171 G A -1.6668
172 G A -1.6210
173 T A -1.6106
174 C A -1.3245
175 L A -0.1963
176 N A -0.5176
177 T A -0.4357
178 P A -0.9604
179 G A -1.0587
180 S A -0.3137
181 F A -0.2786
182 R A -0.5036
183 C A 0.0000
184 Q A -0.9455
185 C A -0.8213
186 P A -0.3606
187 A A 0.4312
188 G A 1.0453
189 Y A 0.8134
190 T A 0.3163
191 G A -0.2199
192 P A 0.0303
193 L A 0.7939
194 C A -0.7012
195 E A -1.4360
196 N A -0.5156
197 P A 0.0536
198 A A 0.7823
199 V A 1.6836
200 P A 0.8508
201 C A 0.1974
202 A A 0.3710
203 P A -0.4392
204 S A -0.6484
205 P A -0.8523
206 C A -0.9019
207 R A -2.3681
208 N A -2.1937
209 G A -1.1436
210 G A -0.6698
211 T A -0.7701
212 C A -0.9573
213 R A -2.2893
214 Q A -1.7203
215 S A -1.2515
216 G A -1.1877
217 D A -1.5353
218 L A 0.4222
219 T A 0.0494
220 Y A -0.1716
221 D A -1.3440
222 C A -0.1921
223 A A 0.0410
224 C A 0.4081
225 L A 0.6766
226 P A -0.8672
227 G A -0.5463
228 F A -1.0351
229 E A -2.0575
230 G A -1.6794
231 Q A -2.0528
232 N A -1.8132
233 C A -0.9123
234 E A -1.4224
235 V A 0.0000
236 N A 0.0000
237 V A -1.1267
238 D A -2.4792
239 D A -3.2385
240 C A 0.0000
241 P A -1.3735
242 G A -1.8748
243 H A -1.8051
244 R A -2.6365
245 C A 0.0000
246 L A 0.5276
247 N A -0.7104
248 G A -0.5324
249 G A -0.5764
250 T A -0.9291
251 C A -1.0908
252 V A -0.3339
253 D A -1.0035
254 G A -0.4000
255 V A 0.3942
256 N A -1.0577
257 T A -1.1192
258 Y A -0.9672
259 N A -1.2996
260 C A -1.2545
261 Q A -0.7643
262 C A 0.0000
263 P A -0.8273
264 P A -1.3784
265 E A -2.2348
266 W A -1.0589
267 T A -0.6241
268 G A -0.5623
269 Q A -0.1299
270 F A 1.3615
271 C A 0.4973
272 T A 0.4550
273 E A 0.0000
274 D A 0.0000
275 V A 0.0000
276 D A -0.8112
277 E A -0.2105
278 C A 0.0000
279 Q A -0.4264
280 L A 0.1488
281 Q A 0.0000
282 P A -0.6392
283 N A 0.0000
284 A A 0.2314
285 C A 0.4556
286 H A -0.4224
287 N A -0.9928
288 G A 0.0000
289 G A 0.0000
290 T A 0.0000
291 C A 0.0000
292 F A 0.0000
293 N A 0.0000
294 T A -0.2568
295 L A 0.7482
296 G A -0.1750
297 G A -0.7325
298 H A -0.6977
299 S A -0.5520
300 C A -0.3227
301 V A 0.0000
302 C A 0.0000
303 V A 0.0000
304 N A -0.6656
305 G A -0.0944
306 W A 0.5884
307 T A -0.2520
308 G A -0.8779
309 E A -1.3311
310 S A -0.8472
311 C A -0.5082
312 S A -0.1578
313 Q A 0.0037
314 N A -0.4217
315 I A 0.3508
316 D A -0.8017
317 D A 0.0000
318 C A 0.1943
319 A A 0.2771
320 T A 0.3323
321 A A 1.1509
322 V A 2.5802
323 C A 2.3250
324 F A 1.7548
325 H A -0.3228
326 G A -0.2516
327 A A 0.3538
328 T A 0.1932
329 C A 0.2377
330 H A -1.6066
331 D A -2.3567
332 R A -1.8320
333 V A 0.3360
334 A A -0.1022
335 S A -0.1162
336 F A 0.0000
337 Y A 0.8038
338 C A 0.0000
339 A A 0.4125
340 C A 0.3151
341 P A 0.0406
342 M A 0.9471
343 G A 0.1372
344 K A -0.9555
345 T A -0.0364
346 G A 0.0000
347 L A 1.6511
348 L A 2.5822
349 C A 2.4371
350 H A 1.4922
351 L A 0.5316
352 D A -1.3610
353 D A -1.4685
354 A A 0.0000
355 C A 0.0000
356 V A 1.1273
357 S A -0.2119
358 N A -0.6671
359 P A -0.5387
360 C A -0.4724
361 H A -1.6774
362 E A -2.4533
363 D A -2.4926
364 A A -0.6802
365 I A 1.5072
366 C A 0.9873
367 D A 0.3643
368 T A 0.0000
369 N A 0.1495
370 P A 0.0000
371 V A 1.4062
372 N A 0.0000
373 G A -0.0895
374 R A 0.0000
375 A A 0.0000
376 I A 0.0000
377 C A 0.0000
378 T A 0.4060
379 C A 0.0000
380 P A -0.7760
381 P A -0.8153
382 G A -0.6626
383 F A 0.0000
384 T A 0.0000
385 G A 0.0000
386 G A -0.6841
387 A A -0.8472
388 C A -1.4339
389 D A -2.3610
390 Q A -2.0286
391 D A -1.5228
392 V A -0.4115
393 D A 0.0000
394 E A -0.3054
395 C A 0.3716
396 S A 1.0561
397 I A 1.9228
398 G A 0.6192
399 A A -0.5177
400 N A -1.6149
401 P A -0.9143
402 C A 0.0000
403 E A -1.8730
404 H A -1.3317
405 L A -0.7311
406 G A 0.0000
407 R A -1.8507
408 C A 0.0000
409 V A -0.9036
410 N A -0.2619
411 T A -0.3093
412 Q A -0.7192
413 G A -0.7254
414 S A -0.2511
415 F A 0.4229
416 L A -0.1506
417 C A 0.0000
418 Q A 0.0000
419 C A 0.0000
420 G A 0.0000
421 R A 0.0000
422 G A 0.0000
423 Y A -0.6635
424 T A -1.1797
425 G A -1.2057
426 P A -1.6626
427 R A -2.2315
428 C A -1.8630
429 E A -2.6566
430 T A -1.9246
431 D A -1.5223
432 V A -0.7956
433 N A -0.7136
434 E A 0.0000
435 C A 0.2030
436 L A 0.0000
437 S A 0.3325
438 G A 0.0000
439 P A -0.3153
440 C A -0.1264
441 R A 0.0000
442 N A -1.6114
443 Q A -1.1661
444 A A 0.0000
445 T A 0.0000
446 C A 0.0000
447 L A 0.0000
448 D A -0.5320
449 R A -0.3379
450 I A 0.8117
451 G A -0.0165
452 Q A -0.0285
453 F A 0.0000
454 T A 0.0000
455 C A 0.0000
456 I A 0.4739
457 C A 0.0000
458 M A 0.2421
459 A A -0.0190
460 G A -0.0502
461 F A 0.2418
462 T A 0.1869
463 G A -0.1508
464 T A 0.0733
465 Y A 0.0000
466 C A 0.0000
467 E A 0.0000
468 V A 0.0000
469 D A 0.0000
470 I A -0.2968
471 D A -1.9023
472 E A -2.2156
473 C A 0.0000
474 Q A -2.2067
475 S A -1.1937
476 S A -0.9654
477 P A -0.9429
478 C A 0.0000
479 V A -0.7793
480 N A -1.4456
481 G A -1.2132
482 G A -1.1935
483 V A 0.0000
484 C A -1.3545
485 K A -2.1446
486 D A -3.1675
487 R A -2.7887
488 V A -1.1298
489 N A -1.1029
490 G A -1.2744
491 F A -1.2648
492 S A -0.9073
493 C A -0.2164
494 T A -0.1263
495 C A -0.2217
496 P A -0.6059
497 S A -0.6841
498 G A -0.9047
499 F A 0.0877
500 S A -0.5348
501 G A -0.3872
502 S A -0.4508
503 T A -0.6121
504 C A 0.0000
505 Q A -1.1362
506 L A -0.9191
507 D A -2.1654
508 V A -2.1619
509 D A -3.0581
510 E A -2.3183
511 C A -1.0988
512 A A -0.2982
513 S A -0.1168
514 T A -0.4609
515 P A 0.0000
516 C A -1.5845
517 R A -2.8698
518 N A -2.6977
519 G A -1.9380
520 A A -1.9629
521 K A -1.9249
522 C A -0.8981
523 V A -1.4006
524 D A -2.8426
525 Q A -2.4603
526 P A -1.9259
527 D A -2.1446
528 G A -1.5524
529 Y A -1.0256
530 E A -1.1283
531 C A 0.0000
532 R A -2.0739
533 C A 0.0000
534 A A -2.3996
535 E A -2.5556
536 G A -1.8812
537 F A 0.0000
538 E A -3.2229
539 G A -2.0356
540 T A -0.8649
541 L A -0.0975
542 C A -1.6622
543 D A -2.8948
544 R A -3.2502
545 N A -2.0933
546 V A 0.0326
547 D A -1.1931
548 D A -1.6174
549 C A 0.0000
550 S A -1.0246
551 P A -1.5011
552 D A -2.2805
553 P A -1.4239
554 C A -0.5032
555 H A -0.8625
556 H A -1.0106
557 G A -0.1984
558 C A 0.9727
559 C A 1.0871
560 V A 1.8449
561 D A 0.6095
562 G A 0.8920
563 I A 2.0554
564 A A 0.9610
565 S A 0.4697
566 F A 0.5812
567 S A 0.0082
568 C A 0.0000
569 A A 0.2226
570 C A -0.2921
571 A A -0.5665
572 P A -0.8416
573 G A -0.9799
574 Y A -0.8895
575 T A -0.9287
576 G A -1.0518
577 T A 0.0000
578 R A -2.0993
579 C A -0.9469
580 E A -1.4253
581 S A -1.2039
582 Q A -1.3685
583 V A -1.1544
584 D A -1.6418
585 E A -1.5741
586 C A -1.3786
587 R A -2.2907
588 S A -1.7207
589 Q A -1.8153
590 P A -1.5608
591 C A -1.8116
592 R A -2.1401
593 H A -1.4061
594 G A -1.7901
595 G A -1.8829
596 K A -1.8350
597 C A -0.3521
598 L A 0.5365
599 D A -0.5803
600 L A 0.4118
601 V A -0.2687
602 D A -1.3030
603 K A -1.2887
604 Y A -0.3098
605 L A 0.9320
606 C A 0.0000
607 R A -2.0071
608 C A 0.0000
609 P A -1.1259
610 S A -0.2000
611 G A 0.2013
612 T A -0.0104
613 T A -0.0536
614 G A -0.2554
615 V A 0.2660
616 N A -0.9600
617 C A 0.0000
618 E A -0.8586
619 V A 0.6978
620 N A 0.2064
621 I A 1.0176
622 D A -0.6601
623 D A -1.7922
624 C A 0.0000
625 A A -0.3110
626 S A 0.1019
627 N A 0.2834
628 P A 0.1733
629 C A 0.6783
630 T A 1.2623
631 F A 2.5843
632 G A 1.5672
633 V A 1.7864
634 C A 0.4869
635 R A -1.5030
636 D A -1.2833
637 G A -1.5623
638 I A -0.8449
639 N A -1.7675
640 R A -2.2829
641 Y A -1.5958
642 D A -0.8035
643 C A 0.0000
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1971 K A -2.5946
1972 E A -2.6810
1973 E A -1.7999
1974 T A 0.0000
1975 P A 0.0000
1976 L A 0.0000
1977 F A 0.0000
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1981 R A -2.6068
1982 E A -2.4380
1983 G A -1.5939
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1991 L A 0.0000
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1994 H A -0.9363
1995 F A -0.4412
1996 A A 0.0000
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1998 R A 0.0000
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2000 I A 0.0000
2001 T A -0.7781
2002 D A -1.4330
2003 H A -1.9684
2004 L A 0.0000
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2006 R A -2.7396
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2008 P A 0.0000
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2010 D A -1.3349
2011 V A 0.0000
2012 A A 0.0000
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2014 E A -2.0177
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2016 L A 0.0272
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2018 Q A -1.1845
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2269 S A -0.7546
2270 T A -0.2533
2271 P A -0.2283
2272 S A 0.0754
2273 P A -0.2597
2274 A A -0.3221
2275 T A -0.5316
2276 A A -0.4167
2277 T A -0.2097
2278 G A -0.3325
2279 A A 0.4647
2280 M A 0.8353
2281 A A 0.4374
2282 T A -0.6004
2283 T A 0.0000
2284 T A -0.9333
2285 G A -0.5277
2286 A A 0.1341
2287 L A 0.6212
2288 P A 0.0373
2289 A A 0.0032
2290 Q A -0.2979
2291 P A 0.4741
2292 L A 1.4069
2293 P A 0.0000
2294 L A 0.0000
2295 S A -0.6230
2296 V A -0.5876
2297 P A -0.5667
2298 S A 0.0000
2299 S A -0.7078
2300 L A 0.0000
2301 A A -0.6859
2302 Q A -1.7971
2303 A A -1.5383
2304 Q A -2.1715
2305 T A -1.5344
2306 Q A -1.8124
2307 L A -0.9156
2308 G A -0.9854
2309 P A -1.1644
2310 Q A -1.5114
2311 P A -1.1884
2312 E A -1.2656
2313 V A 0.0079
2314 T A -1.3274
2315 P A -1.3027
2316 K A -2.7429
2317 R A -2.7524
2318 Q A -1.4525
2319 V A 0.4067
2320 L A 0.6644
2321 A A 0.5957
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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, -0.5018 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 -0.5018 View CSV PDB
model_6 -0.5319 View CSV PDB
model_4 -0.5422 View CSV PDB
model_0 -0.5491 View CSV PDB
model_2 -0.5528 View CSV PDB
model_10 -0.5638 View CSV PDB
model_3 -0.5671 View CSV PDB
CABS_average -0.5706 View CSV PDB
model_1 -0.5781 View CSV PDB
model_9 -0.6036 View CSV PDB
model_11 -0.6101 View CSV PDB
model_5 -0.6229 View CSV PDB
model_8 -0.6241 View CSV PDB
input -0.7703 View CSV PDB