Project name: C446S_4D

Status: done

Started: 2026-06-02 01:54:21
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATSLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:22:16)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (14:43:02)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (14:43:55)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (14:44:50)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (14:45:42)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (14:46:32)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (14:47:23)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (14:48:14)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (14:49:06)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (14:49:59)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (14:50:52)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (14:51:45)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (14:52:36)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (14:53:27)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (14:55:42)
[INFO]       Main:     Simulation completed successfully.                                          (14:56:39)
Show buried residues

Minimal score value
-4.3898
Maximal score value
4.5984
Average score
-0.5624
Total score value
-1305.2889

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 1.0429
2 G A -0.0272
3 P A -0.0703
4 G A -0.2494
5 A A -0.2556
6 R A 0.0000
7 G A -1.4432
8 R A -2.1089
9 R A -2.8560
10 R A -1.9565
11 R A -1.3304
12 R A -2.1184
13 R A -1.8889
14 P A -1.1065
15 M A -0.5814
16 S A -0.8282
17 P A -1.3816
18 P A -1.8440
19 P A -1.4308
20 P A -0.5546
21 P A -0.2861
22 P A 0.0000
23 P A -0.5071
24 V A -0.8210
25 R A -1.0878
26 A A 0.0000
27 L A 1.5059
28 P A 1.6965
29 L A 2.2720
30 L A 2.8977
31 L A 2.6188
32 L A 2.1915
33 L A 0.0000
34 A A 1.5639
35 G A 0.6312
36 P A -0.2403
37 G A -0.6449
38 A A -0.8813
39 A A -0.1357
40 A A -0.3943
41 P A 0.0000
42 P A -1.2475
43 C A -0.8399
44 L A 0.0344
45 D A -1.5866
46 G A -0.8603
47 S A -0.4512
48 P A -0.7245
49 C A 0.0000
50 A A -0.8016
51 N A 0.0000
52 G A -0.9742
53 G A -0.9248
54 R A 0.0000
55 C A 0.0000
56 T A -0.6925
57 Q A -1.3911
58 L A -1.0168
59 P A -1.2181
60 S A -1.4907
61 R A -2.4531
62 E A -2.4023
63 A A 0.0000
64 A A 0.0000
65 C A 0.0000
66 L A 0.8132
67 C A 0.2762
68 P A -0.0976
69 P A 0.0000
70 G A -0.6477
71 W A -0.4167
72 V A 0.0000
73 G A -0.9630
74 E A -2.2002
75 R A -2.6295
76 C A -1.1974
77 Q A 0.0000
78 L A 0.0000
79 E A -1.0299
80 D A -1.3413
81 P A 0.0000
82 C A -0.8523
83 H A -1.1576
84 S A -0.8885
85 G A -0.6887
86 P A -0.8190
87 C A 0.0000
88 A A -0.6663
89 G A -0.7199
90 R A -1.8400
91 G A -1.5728
92 V A 0.0000
93 C A -1.5459
94 Q A -1.8729
95 S A -0.9468
96 S A -0.8532
97 V A 0.0000
98 V A -0.8528
99 A A -0.9622
100 G A -0.8933
101 T A -0.7050
102 A A 0.0000
103 R A -1.2838
104 F A 0.0000
105 S A 0.0000
106 C A 0.0000
107 R A -2.9518
108 C A -1.4091
109 P A -0.6307
110 R A -0.7286
111 G A -0.8278
112 F A -1.2259
113 R A -2.0769
114 G A -1.8778
115 P A -1.4723
116 D A -2.2266
117 C A 0.0000
118 S A -1.4047
119 L A -1.1212
120 P A -0.9361
121 D A -1.1069
122 P A -0.4375
123 C A 0.9826
124 L A 1.3734
125 S A 0.4297
126 S A -0.2933
127 P A -0.5854
128 C A 0.0000
129 A A -0.9781
130 H A -1.4299
131 G A -1.2190
132 A A -1.3259
133 R A -1.6904
134 C A 0.1078
135 S A 0.4127
136 V A 0.4433
137 G A -0.3705
138 P A -1.5457
139 D A -2.3263
140 G A -1.5831
141 R A -0.8460
142 F A 1.0551
143 L A 0.8409
144 C A -0.3210
145 S A -1.0067
146 C A 0.0000
147 P A -0.7973
148 P A -0.3621
149 G A -0.6258
150 Y A -1.4071
151 Q A -2.7688
152 G A -2.6254
153 R A -3.2617
154 S A -1.6515
155 C A -1.2950
156 R A -3.1520
157 S A -2.5743
158 D A -2.2524
159 V A -0.9754
160 D A -1.6794
161 E A 0.0000
162 C A 0.0000
163 R A -1.4535
164 V A 0.2073
165 G A -1.1323
166 E A -2.5057
167 P A -1.8660
168 C A -2.1474
169 R A -2.5799
170 H A -2.3103
171 G A -1.6068
172 G A -1.3235
173 T A -1.2853
174 C A -1.3454
175 L A -0.6952
176 N A -0.6183
177 T A -0.8894
178 P A 0.0000
179 G A -0.5681
180 S A -0.8000
181 F A 0.0000
182 R A -1.9790
183 C A 0.0000
184 Q A -1.7929
185 C A -1.7935
186 P A -0.8506
187 A A -0.1080
188 G A -0.7900
189 Y A -1.0073
190 T A -1.2187
191 G A -1.0593
192 P A -1.3483
193 L A -0.8845
194 C A 0.0000
195 E A -2.4704
196 N A -1.7148
197 P A -0.8846
198 A A -0.0388
199 V A 1.3523
200 P A 0.8970
201 C A 0.6486
202 A A 0.1996
203 P A -0.4046
204 S A -1.3678
205 P A -1.3459
206 C A -1.2203
207 R A -1.6203
208 N A 0.0000
209 G A -0.6125
210 G A -0.5658
211 T A -0.5999
212 C A -1.3118
213 R A -2.6816
214 Q A -1.9174
215 S A -1.4400
216 G A -1.4588
217 D A -1.4180
218 L A 0.2087
219 T A -0.8807
220 Y A -1.7287
221 D A -2.5021
222 C A 0.0000
223 A A -1.0681
224 C A 0.0000
225 L A 0.7570
226 P A 0.3982
227 G A 0.2844
228 F A -0.8056
229 E A -2.4046
230 G A -2.1950
231 Q A -2.6720
232 N A -3.2114
233 C A 0.0000
234 E A -3.0583
235 V A -1.3902
236 N A 0.0000
237 V A 1.1989
238 D A 0.0000
239 D A -0.3701
240 C A -0.3272
241 P A -0.7365
242 G A -1.3185
243 H A -1.4944
244 R A -2.3176
245 C A 0.0000
246 L A -0.0101
247 N A -0.6591
248 G A -0.4801
249 G A -0.6161
250 T A -0.4116
251 C A 0.1483
252 V A 0.5914
253 D A -0.1119
254 G A -0.0620
255 V A 0.6843
256 N A -0.7059
257 T A -0.5156
258 Y A 0.0000
259 N A -1.0382
260 C A 0.0000
261 Q A -1.4867
262 C A -1.2881
263 P A 0.0000
264 P A -1.1452
265 E A -1.4930
266 W A -1.2315
267 T A -0.9439
268 G A -1.5043
269 Q A -1.4724
270 F A -0.7656
271 C A -1.0837
272 T A -1.2308
273 E A -1.7565
274 D A 0.0000
275 V A 0.4654
276 D A 0.0000
277 E A -0.2912
278 C A -0.0168
279 Q A -0.7498
280 L A -0.2637
281 Q A -1.0908
282 P A -1.4392
283 N A -1.8406
284 A A -1.3003
285 C A -0.5838
286 H A -0.3429
287 N A -0.2931
288 G A -0.4009
289 G A 0.0585
290 T A 0.4520
291 C A 0.4644
292 F A 0.0000
293 N A 0.0000
294 T A -0.1484
295 L A -0.5014
296 G A -0.5114
297 G A -0.4658
298 H A 0.0000
299 S A 0.0725
300 C A 0.4643
301 V A 0.8585
302 C A 0.6124
303 V A 0.6074
304 N A 0.2274
305 G A 0.2069
306 W A -0.0920
307 T A -0.6261
308 G A -1.3712
309 E A -2.1358
310 S A -1.2261
311 C A -0.6829
312 S A -1.3808
313 Q A -1.2966
314 N A 0.0000
315 I A 0.9357
316 D A 0.2478
317 D A 0.0000
318 C A 0.2489
319 A A 0.7930
320 T A 0.0000
321 A A 0.0000
322 V A 0.0000
323 C A 1.5412
324 F A 1.6191
325 H A 0.1388
326 G A -0.1310
327 A A -0.1169
328 T A -0.0083
329 C A 0.0000
330 H A -0.2406
331 D A 0.0000
332 R A -0.0856
333 V A 0.8673
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 -0.3088
341 P A -0.5528
342 M A -0.6959
343 G A -1.1118
344 K A -1.8582
345 T A 0.0000
346 G A 0.0000
347 L A 0.0000
348 L A 0.0000
349 C A 0.2731
350 H A -0.3724
351 L A -0.0853
352 D A -1.8741
353 D A -1.3690
354 A A -0.9401
355 C A 0.0000
356 V A -0.0618
357 S A -0.4848
358 N A -0.5278
359 P A -0.3503
360 C A 0.0000
361 H A 0.0000
362 E A -2.1838
363 D A -2.4509
364 A A 0.0000
365 I A -0.0355
366 C A 0.0000
367 D A -0.5851
368 T A 0.0000
369 N A -1.0594
370 P A -0.6594
371 V A 0.0000
372 N A -1.2792
373 G A -1.6278
374 R A -2.1812
375 A A -1.1617
376 I A -0.4876
377 C A 0.0000
378 T A -0.0211
379 C A -0.4066
380 P A 0.0000
381 P A -0.9504
382 G A 0.0000
383 F A 0.0000
384 T A -0.3864
385 G A -0.4800
386 G A -0.5181
387 A A -0.4259
388 C A 0.0000
389 D A 0.0000
390 Q A 0.0270
391 D A 0.0000
392 V A -0.2305
393 D A -1.2993
394 E A -1.9574
395 C A -0.9577
396 S A -0.9263
397 I A -1.0891
398 G A -1.4753
399 A A -1.2319
400 N A -1.4188
401 P A -1.1840
402 C A 0.0000
403 E A -1.2856
404 H A 0.0000
405 L A 0.0000
406 G A -0.6499
407 R A -1.3277
408 C A 0.0708
409 V A 0.2264
410 N A -0.2727
411 T A -0.3331
412 Q A -0.2929
413 G A -0.8194
414 S A -0.6601
415 F A 0.0000
416 L A -0.1959
417 C A 0.0000
418 Q A -1.6827
419 C A -1.0585
420 G A -0.9469
421 R A -0.7084
422 G A -0.4329
423 Y A 0.6349
424 T A 0.0554
425 G A -0.6097
426 P A -0.6337
427 R A -0.8738
428 C A 0.0000
429 E A 0.0000
430 T A 0.0000
431 D A 0.0000
432 V A 0.0000
433 N A -0.9658
434 E A -0.9478
435 C A 0.1214
436 L A 1.2124
437 S A 0.3438
438 G A -0.2066
439 P A -0.5044
440 C A -0.3308
441 R A -0.8219
442 N A -1.2344
443 Q A -0.8316
444 A A -0.2345
445 T A 0.0000
446 S A 0.3597
447 L A -0.0640
448 D A 0.0000
449 R A -1.6044
450 I A -1.0394
451 G A -1.0966
452 Q A -0.7977
453 F A 0.5408
454 T A 0.6276
455 C A 0.0000
456 I A 0.9114
457 C A 0.0000
458 M A 0.3743
459 A A 0.0000
460 G A -0.1427
461 F A 0.4041
462 T A 0.2025
463 G A 0.5609
464 T A 0.5739
465 Y A 1.0063
466 C A 0.0000
467 E A -1.2874
468 V A 0.0000
469 D A -1.4543
470 I A -1.4133
471 D A -2.8006
472 E A -3.0647
473 C A -1.9523
474 Q A -1.8545
475 S A -1.1182
476 S A 0.0000
477 P A -0.4405
478 C A -0.2852
479 V A 0.4572
480 N A -0.7312
481 G A -0.5595
482 G A -0.4314
483 V A 0.2667
484 C A -0.4540
485 K A -1.4990
486 D A -2.0736
487 R A -0.7248
488 V A 0.5518
489 N A -1.0626
490 G A 0.0000
491 F A -1.4996
492 S A 0.0000
493 C A 0.0000
494 T A 0.0000
495 C A 0.0000
496 P A -0.0731
497 S A -0.9995
498 G A -1.0752
499 F A -0.5117
500 S A -0.9386
501 G A -0.9014
502 S A -0.7222
503 T A -0.2038
504 C A 0.0000
505 Q A -1.2905
506 L A 0.0000
507 D A -2.4035
508 V A -2.2122
509 D A -2.7618
510 E A -2.1546
511 C A -0.9408
512 A A -0.3644
513 S A -0.1523
514 T A -0.5669
515 P A -0.7812
516 C A -1.1063
517 R A -3.0280
518 N A -2.6209
519 G A -2.3660
520 A A -2.4422
521 K A -2.4935
522 C A -1.3374
523 V A -0.9209
524 D A -1.9114
525 Q A -2.3640
526 P A -2.7246
527 D A -3.1073
528 G A -1.9284
529 Y A -1.5361
530 E A -1.3999
531 C A -1.2815
532 R A -2.2847
533 C A 0.0000
534 A A -1.7249
535 E A -2.1422
536 G A -1.1026
537 F A -0.4761
538 E A -1.9125
539 G A -1.2869
540 T A -0.5415
541 L A 0.3843
542 C A -1.2169
543 D A -2.6790
544 R A -2.9131
545 N A -2.2404
546 V A -0.1456
547 D A -1.3966
548 D A -1.8137
549 C A -2.2415
550 S A -2.0455
551 P A -2.3514
552 D A -2.4968
553 P A -2.1125
554 C A 0.0000
555 H A -2.2958
556 H A -2.0282
557 G A -1.1906
558 R A -1.6371
559 C A -0.2839
560 V A 0.7820
561 D A -0.4901
562 G A 0.1378
563 I A 1.4434
564 A A 0.8210
565 S A 0.1036
566 F A 0.1382
567 S A -0.6083
568 C A 0.0000
569 A A -0.6892
570 C A -0.7063
571 A A -0.2896
572 P A -0.8058
573 G A -1.1236
574 Y A 0.0000
575 T A -0.9489
576 G A -1.2915
577 T A -1.8426
578 R A -2.6404
579 C A 0.0000
580 E A -3.0804
581 S A -1.9222
582 Q A -1.6485
583 V A -0.7460
584 D A -2.0682
585 E A -1.5680
586 C A 0.0000
587 R A -2.9654
588 S A -1.7429
589 Q A -1.6091
590 P A -1.8234
591 C A 0.0000
592 R A -2.1259
593 H A -2.3764
594 G A -1.8210
595 G A -1.4595
596 K A -1.6952
597 C A -0.4358
598 L A 1.1247
599 D A 0.1297
600 L A 1.0574
601 V A 1.2740
602 D A -1.2654
603 K A -1.2577
604 Y A -0.2455
605 L A 0.6453
606 C A -0.9321
607 R A -1.8872
608 C A 0.0000
609 P A -1.0179
610 S A 0.0000
611 G A -0.6304
612 T A -0.1046
613 T A 0.0000
614 G A 0.8756
615 V A 0.1131
616 N A -0.9571
617 C A -0.7490
618 E A 0.0000
619 V A 2.1421
620 N A 0.9535
621 I A 0.9717
622 D A -1.1590
623 D A -1.4844
624 C A -0.8992
625 A A -0.7371
626 S A -0.7030
627 N A -0.9431
628 P A -0.6882
629 C A 0.6494
630 T A 0.9466
631 F A 2.3022
632 G A 1.6677
633 V A 1.7382
634 C A 0.1268
635 R A -2.2812
636 D A -2.2607
637 G A -1.4057
638 I A -0.5564
639 N A -1.3286
640 R A -2.5429
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1971 K A -3.4633
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1974 T A 0.0000
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1983 G A -0.7766
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1991 L A 0.0000
1992 L A -1.4241
1993 D A -2.3478
1994 H A -2.0732
1995 F A -1.5492
1996 A A -1.6698
1997 N A -2.4922
1998 R A 0.0000
1999 E A -3.2972
2000 I A -2.8923
2001 T A 0.0000
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2003 H A -2.8906
2004 L A -2.5027
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2008 P A 0.0000
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2010 D A -2.9415
2011 V A 0.0000
2012 A A 0.0000
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2014 E A -3.1934
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2016 L A -1.2844
2017 H A -1.9957
2018 Q A -2.6132
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2257 S A -0.0211
2258 P A -0.4754
2259 S A -0.6208
2260 P A -0.4155
2261 P A -0.1329
2262 S A 0.3006
2263 L A 1.0028
2264 S A -0.0725
2265 D A -1.2642
2266 W A -0.1289
2267 S A -0.9811
2268 E A -1.6342
2269 S A -0.9586
2270 T A -0.6066
2271 P A -0.4873
2272 S A 0.0000
2273 P A 0.3921
2274 A A 0.7518
2275 T A 0.0000
2276 A A 0.3535
2277 T A -0.4917
2278 G A -0.6470
2279 A A -0.1321
2280 M A -0.0109
2281 A A -0.2891
2282 T A -0.5941
2283 T A -0.5121
2284 T A -0.7789
2285 G A -0.8162
2286 A A -0.5013
2287 L A 0.7505
2288 P A 0.1142
2289 A A -0.4198
2290 Q A -1.1816
2291 P A -0.7546
2292 L A 0.2324
2293 P A 0.7015
2294 L A 1.8446
2295 S A 1.3712
2296 V A 1.8719
2297 P A 0.8820
2298 S A 0.3862
2299 S A 0.2511
2300 L A 0.4895
2301 A A 0.0222
2302 Q A -0.6047
2303 A A -0.5834
2304 Q A -0.7838
2305 T A -0.6372
2306 Q A -0.5697
2307 L A 0.9824
2308 G A 0.3777
2309 P A 0.1771
2310 Q A -0.3307
2311 P A -0.7771
2312 E A 0.0000
2313 V A 0.0000
2314 T A -0.8227
2315 P A -1.1781
2316 K A -2.0940
2317 R A 0.0000
2318 Q A -0.8020
2319 V A 0.0000
2320 L A 1.2715
2321 A A 0.6566
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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, -0.5624 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 -0.5624 View CSV PDB
model_5 -0.57 View CSV PDB
model_2 -0.5747 View CSV PDB
model_0 -0.5766 View CSV PDB
model_1 -0.577 View CSV PDB
model_3 -0.5838 View CSV PDB
model_9 -0.5947 View CSV PDB
CABS_average -0.5953 View CSV PDB
model_6 -0.5977 View CSV PDB
model_8 -0.6092 View CSV PDB
model_4 -0.6102 View CSV PDB
model_10 -0.6295 View CSV PDB
model_11 -0.6575 View CSV PDB
input -0.7471 View CSV PDB