Project name: C65Y_5_4D

Status: done

Started: 2026-05-18 02:49:25
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAAYLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
input PDB
Selected Chain(s) A
Distance of aggregation 5 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                                          (00:00:03)
[INFO]       CABS:     Running CABS flex simulation                                                (00:17:46)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (15:32:15)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (15:33:28)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (15:34:46)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (15:36:06)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (15:37:22)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (15:38:39)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (15:39:57)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (15:41:15)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (15:42:32)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (15:43:50)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (15:45:06)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (15:46:22)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (15:47:42)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (15:50:15)
[INFO]       Main:     Simulation completed successfully.                                          (15:51:34)
Show buried residues

Minimal score value
-2.5392
Maximal score value
2.3063
Average score
-0.2173
Total score value
-504.4276

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 0.9642
2 G A -0.3146
3 P A -0.3661
4 G A -0.1416
5 A A -0.2366
6 R A -1.4394
7 G A -0.7152
8 R A -1.1282
9 R A -1.1402
10 R A -1.2888
11 R A -2.2697
12 R A -2.5392
13 R A -2.2248
14 P A -0.2826
15 M A 0.9904
16 S A -0.0126
17 P A -0.1848
18 P A -0.2737
19 P A 0.0000
20 P A -0.1965
21 P A 0.0000
22 P A -0.2460
23 P A 0.0905
24 V A 1.3845
25 R A -1.4968
26 A A 0.0034
27 L A 1.5096
28 P A 0.3325
29 L A 1.7963
30 L A 2.1409
31 L A 2.1368
32 L A 2.0740
33 L A 1.5363
34 A A 0.2327
35 G A -0.2850
36 P A 0.0000
37 G A -0.1698
38 A A 0.0304
39 A A 0.0297
40 A A 0.0232
41 P A 0.0000
42 P A -0.0448
43 C A 0.3606
44 L A 1.1709
45 D A -1.5835
46 G A -0.6367
47 S A -0.1568
48 P A -0.2406
49 C A 0.0531
50 A A -0.0147
51 N A -0.3653
52 G A -0.5312
53 G A -0.6171
54 R A -0.2898
55 C A 0.1190
56 T A -0.2157
57 Q A -1.1019
58 L A 0.2660
59 P A -0.1917
60 S A -0.5085
61 R A -1.7022
62 E A -2.0674
63 A A 0.0000
64 A A 0.0000
65 Y A 0.0000
66 L A 0.1413
67 C A 0.0000
68 P A -0.2967
69 P A -0.2842
70 G A -0.1741
71 W A -0.0535
72 V A 0.0000
73 G A 0.0000
74 E A -0.8820
75 R A -1.8242
76 C A 0.1616
77 Q A -1.0593
78 L A 0.0000
79 E A -1.9679
80 D A -1.2298
81 P A 0.0000
82 C A -0.0156
83 H A -0.9944
84 S A -0.4081
85 G A -0.1537
86 P A -0.1734
87 C A 0.4923
88 A A 0.0662
89 G A -0.8002
90 R A -2.0203
91 G A -0.7798
92 V A 0.1762
93 C A 0.2899
94 Q A -0.2917
95 S A 0.0000
96 S A -0.0279
97 V A 0.0000
98 V A 0.6990
99 A A 0.0967
100 G A -0.4647
101 T A -0.1173
102 A A -0.3482
103 R A -1.6648
104 F A 0.5579
105 S A 0.0913
106 C A 0.0000
107 R A -1.8162
108 C A -0.2703
109 P A -0.5724
110 R A -1.7528
111 G A -0.4545
112 F A 1.4203
113 R A -0.2159
114 G A -0.2460
115 P A -0.5245
116 D A -1.7485
117 C A 0.0465
118 S A 0.2538
119 L A 0.7610
120 P A -0.1037
121 D A -0.8096
122 P A -0.1600
123 C A 0.7235
124 L A 0.9895
125 S A 0.0522
126 S A -0.2776
127 P A -0.2800
128 C A 0.0499
129 A A -0.0094
130 H A -0.3969
131 G A -0.3792
132 A A -0.3834
133 R A -1.7833
134 C A -0.0279
135 S A 0.1991
136 V A 0.9128
137 G A -0.2458
138 P A -0.5541
139 D A -1.8734
140 G A -1.0022
141 R A -1.8466
142 F A 0.3838
143 L A 1.6034
144 C A 0.0000
145 S A -0.2418
146 C A 0.0000
147 P A -0.1943
148 P A -0.1671
149 G A -0.2611
150 Y A 0.8293
151 Q A -0.8118
152 G A -0.7309
153 R A -0.5834
154 S A -0.2842
155 C A -0.2569
156 R A -1.5869
157 S A 0.0000
158 D A -1.1981
159 V A 0.0000
160 D A -1.0593
161 E A -0.6474
162 C A 0.0000
163 R A -1.6435
164 V A 0.5712
165 G A -0.4399
166 E A -1.3205
167 P A -0.4845
168 C A 0.0000
169 R A -1.2758
170 H A -1.2718
171 G A -0.7437
172 G A -0.5548
173 T A 0.0000
174 C A 0.3427
175 L A 0.6622
176 N A -0.4293
177 T A -0.1417
178 P A -0.0691
179 G A -0.1951
180 S A -0.0415
181 F A -0.1468
182 R A -1.7819
183 C A -0.4191
184 Q A -1.1434
185 C A -0.3090
186 P A -0.0452
187 A A 0.0803
188 G A -0.0216
189 Y A 0.5899
190 T A 0.0598
191 G A -0.2920
192 P A 0.2238
193 L A 1.5544
194 C A 0.0277
195 E A -2.0063
196 N A -1.6474
197 P A -0.3511
198 A A 0.0366
199 V A 0.1463
200 P A -0.1058
201 C A 0.5584
202 A A 0.0820
203 P A -0.2753
204 S A -0.3101
205 P A -0.2768
206 C A -0.1987
207 R A -1.5627
208 N A -1.5374
209 G A -0.2447
210 G A -0.2614
211 T A -0.0989
212 C A -0.2702
213 R A -2.1516
214 Q A -1.5325
215 S A -0.5318
216 G A -0.8461
217 D A -1.7060
218 L A 0.5668
219 T A 0.2393
220 Y A 0.1850
221 D A -0.9914
222 C A 0.0000
223 A A 0.0107
224 C A 0.0000
225 L A 1.0276
226 P A 0.2399
227 G A -0.1148
228 F A 1.6248
229 E A -1.4923
230 G A -0.8003
231 Q A -1.4890
232 N A -1.4666
233 C A -0.3816
234 E A -1.6101
235 V A -0.1251
236 N A -1.1460
237 V A -0.3194
238 D A -2.0861
239 D A -2.0990
240 C A -0.2049
241 P A -0.3086
242 G A -0.6039
243 H A -0.9122
244 R A -1.9044
245 C A 0.1042
246 L A 1.3390
247 N A -0.9840
248 G A 0.0000
249 G A -0.4687
250 T A 0.0070
251 C A 0.9708
252 V A 1.0086
253 D A -1.5333
254 G A -0.2790
255 V A 0.7799
256 N A -1.0908
257 T A -0.2854
258 Y A -0.1438
259 N A -0.4420
260 C A 0.0000
261 Q A -0.2550
262 C A 0.0494
263 P A -0.1733
264 P A -0.3884
265 E A -0.9223
266 W A 0.0433
267 T A -0.0699
268 G A -0.6624
269 Q A -0.7312
270 F A 1.7508
271 C A 0.0000
272 T A -0.3657
273 E A -2.0521
274 D A -1.5009
275 V A -0.0950
276 D A -0.5726
277 E A -0.4308
278 C A 0.0000
279 Q A -1.0969
280 L A 0.5320
281 Q A -0.4106
282 P A -0.4666
283 N A -0.4683
284 A A -0.0156
285 C A 0.0000
286 H A -0.2433
287 N A -0.1998
288 G A 0.0000
289 G A 0.0000
290 T A 0.0000
291 C A 0.2677
292 F A 0.7012
293 N A -0.3257
294 T A 0.1310
295 L A 1.5171
296 G A 0.1997
297 G A -0.3821
298 H A -1.0877
299 S A -0.3051
300 C A 0.2068
301 V A 0.4220
302 C A 0.6076
303 V A 0.0000
304 N A -1.2423
305 G A -0.3083
306 W A 0.0000
307 T A -0.0977
308 G A -0.6055
309 E A -1.8830
310 S A -0.4647
311 C A 0.0000
312 S A -0.2878
313 Q A -1.0168
314 N A -0.2908
315 I A 1.5751
316 D A -1.4446
317 D A -0.4491
318 C A 0.4690
319 A A 0.1057
320 T A -0.0552
321 A A 0.1196
322 V A 0.4886
323 C A 0.6659
324 F A 0.5734
325 H A -0.9378
326 G A -0.5636
327 A A 0.0043
328 T A 0.0036
329 C A 0.0973
330 H A -1.0411
331 D A -2.2803
332 R A -2.1275
333 V A -0.0583
334 A A 0.0524
335 S A -0.0463
336 F A 0.4498
337 Y A 0.8349
338 C A 0.0000
339 A A 0.0127
340 C A 0.0000
341 P A 0.0231
342 M A 0.7041
343 G A -0.6456
344 K A -1.8424
345 T A 0.0000
346 G A 0.0000
347 L A 0.7436
348 L A 1.4182
349 C A 0.3607
350 H A 0.0000
351 L A 1.2719
352 D A -0.7533
353 D A -1.8807
354 A A -0.3318
355 C A 0.0000
356 V A 1.3608
357 S A -0.0240
358 N A -0.4131
359 P A -0.3190
360 C A 0.0645
361 H A -0.4674
362 E A -2.1819
363 D A -2.1287
364 A A 0.0000
365 I A 1.5257
366 C A 0.4162
367 D A -0.3678
368 T A 0.0000
369 N A 0.0000
370 P A -0.0379
371 V A 0.4701
372 N A -0.5675
373 G A -0.9370
374 R A -1.9265
375 A A 0.0562
376 I A 2.0499
377 C A 0.5612
378 T A 0.1635
379 C A 0.0126
380 P A -0.2470
381 P A -0.1704
382 G A -0.4726
383 F A 0.0000
384 T A -0.1188
385 G A -0.4639
386 G A -0.5275
387 A A -0.0465
388 C A 0.0000
389 D A -1.8810
390 Q A -0.8543
391 D A 0.0639
392 V A 1.6053
393 D A -0.7237
394 E A -1.9572
395 C A 0.0000
396 S A 0.0000
397 I A 0.4846
398 G A -0.3461
399 A A -0.1607
400 N A -0.7384
401 P A -0.3925
402 C A 0.0000
403 E A -1.9306
404 H A -0.8901
405 L A 0.1143
406 G A -0.3264
407 R A -1.2924
408 C A 0.0000
409 V A 0.0000
410 N A -0.0972
411 T A -0.2665
412 Q A -1.1641
413 G A -0.3216
414 S A -0.0546
415 F A 0.5526
416 L A 1.1178
417 C A 0.3066
418 Q A 0.0000
419 C A 0.0995
420 G A 0.0000
421 R A -0.2641
422 G A -0.1256
423 Y A 0.3041
424 T A 0.0243
425 G A -0.1535
426 P A -0.3696
427 R A -1.6099
428 C A 0.0000
429 E A -0.5797
430 T A -0.0974
431 D A 0.0000
432 V A 0.7647
433 N A -0.0937
434 E A -0.6146
435 C A 0.4637
436 L A 1.6063
437 S A 0.1518
438 G A -0.4765
439 P A 0.0000
440 C A -0.2526
441 R A -2.1912
442 N A -1.8408
443 Q A -1.6301
444 A A -0.4702
445 T A -0.0164
446 C A 0.5622
447 L A 1.4698
448 D A -0.6814
449 R A -1.7828
450 I A 0.6482
451 G A 0.0000
452 Q A 0.0000
453 F A 0.1957
454 T A 0.1885
455 C A 0.5025
456 I A 2.0450
457 C A 0.6695
458 M A 1.0701
459 A A 0.0000
460 G A 0.1212
461 F A 1.9024
462 T A 0.2262
463 G A -0.4172
464 T A -0.0327
465 Y A 0.6346
466 C A -0.1345
467 E A -1.6611
468 V A 0.2970
469 D A -0.3339
470 I A 0.5743
471 D A -0.8447
472 E A -0.6594
473 C A 0.0000
474 Q A -1.2390
475 S A -0.4511
476 S A -0.1384
477 P A -0.2646
478 C A 0.0000
479 V A 1.5313
480 N A -1.0259
481 G A -0.7968
482 G A -0.5095
483 V A 0.2220
484 C A 0.0868
485 K A -1.7435
486 D A -1.2592
487 R A -1.6228
488 V A 1.1745
489 N A -0.9532
490 G A -0.1713
491 F A 1.8982
492 S A 0.2364
493 C A 0.0742
494 T A -0.0074
495 C A 0.2009
496 P A -0.0427
497 S A -0.2330
498 G A 0.0045
499 F A 0.5855
500 S A -0.1984
501 G A -0.3521
502 S A -0.2804
503 T A -0.1109
504 C A 0.0000
505 Q A -1.1537
506 L A -0.1938
507 D A -0.9962
508 V A 1.2494
509 D A -0.6588
510 E A -1.0557
511 C A 0.5455
512 A A 0.1651
513 S A -0.1682
514 T A -0.1511
515 P A -0.2190
516 C A -0.1381
517 R A -2.0293
518 N A -1.7032
519 G A -0.7000
520 A A -0.3823
521 K A -1.6265
522 C A 0.1772
523 V A 0.6468
524 D A -0.7886
525 Q A -0.8561
526 P A -0.6731
527 D A -1.9211
528 G A -0.4701
529 Y A -0.0474
530 E A -0.7123
531 C A 0.0000
532 R A -1.8441
533 C A 0.0000
534 A A -0.2839
535 E A -1.8507
536 G A -0.4855
537 F A 0.6810
538 E A -1.7347
539 G A -0.7591
540 T A 0.1688
541 L A 1.5398
542 C A 0.0000
543 D A -1.0316
544 R A -1.5849
545 N A -1.0626
546 V A 1.2336
547 D A -1.7977
548 D A -2.0498
549 C A 0.0316
550 S A -0.0255
551 P A 0.0000
552 D A -1.8428
553 P A -0.6750
554 C A 0.0723
555 H A -0.6632
556 H A -1.1025
557 G A -0.6746
558 R A -1.7526
559 C A 0.3606
560 V A 0.6344
561 D A -1.6818
562 G A -0.2966
563 I A 1.9625
564 A A 0.3970
565 S A -0.2359
566 F A 0.0000
567 S A 0.0112
568 C A 0.0000
569 A A -0.1428
570 C A 0.1031
571 A A -0.0242
572 P A -0.2801
573 G A -0.0174
574 Y A 1.1407
575 T A 0.0000
576 G A -0.4233
577 T A -0.4872
578 R A -1.8560
579 C A 0.0000
580 E A -1.1668
581 S A -0.5310
582 Q A -0.7540
583 V A 1.2322
584 D A -0.8104
585 E A -0.9826
586 C A 0.2169
587 R A -1.7348
588 S A -0.7020
589 Q A -1.2653
590 P A -0.4426
591 C A 0.0000
592 R A -1.7723
593 H A -1.0396
594 G A -0.4813
595 G A -0.8357
596 K A -1.8033
597 C A 0.5636
598 L A 0.7814
599 D A -0.1684
600 L A 1.5416
601 V A 1.4892
602 D A -1.8207
603 K A -1.7453
604 Y A 0.4734
605 L A 0.6383
606 C A -0.0291
607 R A -1.7861
608 C A 0.0000
609 P A -0.2290
610 S A -0.2824
611 G A -0.3469
612 T A -0.1314
613 T A -0.0852
614 G A 0.0588
615 V A 0.6266
616 N A -1.2342
617 C A -0.0333
618 E A 0.0000
619 V A 1.5053
620 N A 0.0000
621 I A 1.6713
622 D A -1.4687
623 D A -0.5328
624 C A 0.6719
625 A A 0.1187
626 S A -0.3022
627 N A -0.5810
628 P A -0.3179
629 C A 0.3256
630 T A 0.3275
631 F A 1.9259
632 G A 0.4133
633 V A 0.8289
634 C A -0.0144
635 R A -1.9255
636 D A -0.7085
637 G A -0.2960
638 I A 0.4200
639 N A -0.8748
640 R A -1.1626
641 Y A 0.1663
642 D A -0.7014
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1954 A A 0.0000
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1968 Q A 0.0000
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1971 K A -1.7194
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1974 T A 0.0000
1975 P A 0.0000
1976 L A 0.0000
1977 F A 0.0000
1978 L A -0.0309
1979 A A 0.0000
1980 A A 0.0000
1981 R A -1.9482
1982 E A -1.0583
1983 G A -0.4954
1984 S A 0.0419
1985 Y A 0.4272
1986 E A -1.5886
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1989 K A -1.6486
1990 L A 0.1762
1991 L A 0.0000
1992 L A 0.0000
1993 D A -1.6617
1994 H A -0.8218
1995 F A 0.0000
1996 A A 0.0000
1997 N A 0.0000
1998 R A -0.2100
1999 E A 0.0000
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2001 T A 0.0000
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2004 L A -0.0373
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2006 R A -0.9953
2007 L A 0.0000
2008 P A 0.0000
2009 R A -1.0299
2010 D A -1.1890
2011 V A 0.0000
2012 A A 0.0000
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2014 E A -2.2486
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2017 H A -0.7093
2018 Q A -1.6823
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2272 S A 0.0000
2273 P A -0.1711
2274 A A -0.0343
2275 T A -0.0327
2276 A A 0.0208
2277 T A -0.0777
2278 G A -0.0829
2279 A A 0.1360
2280 M A 0.5831
2281 A A 0.1557
2282 T A -0.0404
2283 T A -0.0446
2284 T A -0.1291
2285 G A -0.2925
2286 A A 0.1193
2287 L A 0.5645
2288 P A -0.0940
2289 A A -0.2602
2290 Q A -1.1770
2291 P A -0.3760
2292 L A 0.3383
2293 P A 0.0157
2294 L A 0.7789
2295 S A 0.0342
2296 V A 0.3636
2297 P A -0.0814
2298 S A -0.2409
2299 S A -0.0168
2300 L A 0.2417
2301 A A 0.0441
2302 Q A -0.0811
2303 A A -0.0751
2304 Q A -0.4429
2305 T A -0.1930
2306 Q A -0.1058
2307 L A 1.1356
2308 G A -0.2346
2309 P A -0.3872
2310 Q A -1.2269
2311 P A -0.3079
2312 E A 0.0000
2313 V A 1.7712
2314 T A 0.0957
2315 P A -0.5829
2316 K A -2.0969
2317 R A -2.2698
2318 Q A -0.5620
2319 V A 1.9239
2320 L A 1.6758
2321 A A 0.3100
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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, -0.2173 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 -0.2173 View CSV PDB
model_0 -0.2267 View CSV PDB
model_1 -0.2301 View CSV PDB
model_4 -0.2337 View CSV PDB
model_3 -0.2401 View CSV PDB
model_5 -0.2412 View CSV PDB
model_8 -0.2417 View CSV PDB
CABS_average -0.2422 View CSV PDB
model_9 -0.2526 View CSV PDB
model_6 -0.2528 View CSV PDB
model_11 -0.2533 View CSV PDB
model_10 -0.2568 View CSV PDB
model_7 -0.2596 View CSV PDB
input -0.2793 View CSV PDB