Project name: C185Y_5_4D

Status: done

Started: 2026-05-18 05:15:04
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQYPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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]                                                (00:00:00)
[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                                                (00:17:48)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (18:16:24)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (18:17:41)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (18:18:59)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (18:20:17)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (18:21:32)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (18:22:48)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (18:24:02)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (18:25:17)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (18:26:33)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (18:27:50)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (18:29:05)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (18:30:21)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (18:31:36)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (18:34:03)
[INFO]       Main:     Simulation completed successfully.                                          (18:35:17)
Show buried residues

Minimal score value
-2.4796
Maximal score value
2.2253
Average score
-0.1845
Total score value
-428.1752

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 1.0261
2 G A 0.0455
3 P A -0.1627
4 G A -0.4611
5 A A -0.3502
6 R A -1.7081
7 G A -0.7820
8 R A -1.6833
9 R A -2.1574
10 R A -1.0751
11 R A -2.0315
12 R A -1.3028
13 R A -1.8364
14 P A -0.2733
15 M A 0.4879
16 S A -0.1187
17 P A -0.0988
18 P A -0.1337
19 P A -0.3025
20 P A -0.2781
21 P A -0.2935
22 P A -0.1450
23 P A -0.0523
24 V A 0.0000
25 R A -0.9174
26 A A 0.0000
27 L A 0.4671
28 P A 0.0923
29 L A 1.1931
30 L A 1.8807
31 L A 1.4091
32 L A 1.8496
33 L A 1.3907
34 A A 0.0000
35 G A -0.0624
36 P A -0.1500
37 G A -0.4728
38 A A -0.0680
39 A A 0.0713
40 A A 0.0198
41 P A -0.3154
42 P A -0.3268
43 C A 0.0000
44 L A 0.6831
45 D A -0.8930
46 G A -0.6551
47 S A -0.2859
48 P A -0.1946
49 C A 0.3023
50 A A -0.1219
51 N A -1.2774
52 G A -0.3449
53 G A -0.2061
54 R A -0.0759
55 C A 0.6294
56 T A -0.1161
57 Q A -1.2001
58 L A 0.0000
59 P A -0.2948
60 S A -0.6108
61 R A -2.2353
62 E A -2.1734
63 A A -0.5207
64 A A -0.0517
65 C A 0.0000
66 L A 0.2121
67 C A 0.0000
68 P A -0.2643
69 P A -0.1428
70 G A -0.2463
71 W A 0.0000
72 V A 0.0000
73 G A 0.0000
74 E A -2.1686
75 R A -2.1882
76 C A 0.0000
77 Q A 0.0000
78 L A 0.0000
79 E A 0.0000
80 D A -0.6346
81 P A -0.2147
82 C A 0.3714
83 H A -0.8927
84 S A -0.3870
85 G A -0.5690
86 P A -0.3681
87 C A 0.1409
88 A A 0.0027
89 G A -0.5216
90 R A -0.4722
91 G A -0.2765
92 V A 0.0000
93 C A 0.2719
94 Q A 0.0000
95 S A 0.0171
96 S A -0.0264
97 V A 0.0000
98 V A 0.0000
99 A A -0.0244
100 G A -0.4122
101 T A -0.0769
102 A A -0.0547
103 R A -0.2439
104 F A 0.2542
105 S A 0.0351
106 C A 0.0000
107 R A 0.0000
108 C A 0.0000
109 P A 0.0000
110 R A 0.0000
111 G A 0.0181
112 F A 0.6833
113 R A -0.0485
114 G A 0.0000
115 P A -0.3754
116 D A -1.7819
117 C A -0.2877
118 S A -0.0435
119 L A 0.4319
120 P A 0.0361
121 D A 0.0000
122 P A -0.0196
123 C A 0.3683
124 L A 1.1196
125 S A 0.1382
126 S A -0.0881
127 P A -0.1414
128 C A 0.0000
129 A A 0.0000
130 H A 0.0000
131 G A 0.0000
132 A A 0.0000
133 R A 0.0000
134 C A 0.0000
135 S A 0.0000
136 V A 0.2468
137 G A -0.3171
138 P A -0.5063
139 D A -1.9064
140 G A -1.1526
141 R A -1.7714
142 F A 0.7863
143 L A 1.4620
144 C A 0.3516
145 S A 0.0228
146 C A 0.1060
147 P A -0.0915
148 P A -0.3336
149 G A 0.0000
150 Y A -0.0890
151 Q A -0.6346
152 G A 0.0000
153 R A -1.8622
154 S A -0.4452
155 C A 0.0000
156 R A -0.9382
157 S A -0.6547
158 D A -1.7260
159 V A -0.1717
160 D A -0.5590
161 E A -0.4793
162 C A -0.1347
163 R A -1.0306
164 V A -0.1037
165 G A -0.4436
166 E A -1.8453
167 P A 0.0000
168 C A 0.0000
169 R A -0.9506
170 H A -0.3909
171 G A -0.5774
172 G A -0.5546
173 T A 0.0000
174 C A 0.3179
175 L A 0.7442
176 N A -0.1559
177 T A -0.2655
178 P A -0.3638
179 G A -0.5411
180 S A -0.1198
181 F A 0.2820
182 R A -1.3395
183 C A -0.1683
184 Q A -1.0773
185 Y A 0.0190
186 P A -0.1867
187 A A -0.0477
188 G A 0.0000
189 Y A 0.2027
190 T A -0.0175
191 G A -0.1662
192 P A 0.0008
193 L A 1.5016
194 C A 0.0000
195 E A -1.8554
196 N A -0.5556
197 P A -0.1397
198 A A 0.1410
199 V A 0.5923
200 P A -0.0694
201 C A 0.0317
202 A A -0.0197
203 P A -0.2566
204 S A -0.1128
205 P A -0.1622
206 C A -0.1194
207 R A -1.8394
208 N A -0.6931
209 G A -0.6005
210 G A -0.5492
211 T A -0.0606
212 C A 0.1599
213 R A -1.9325
214 Q A -1.1064
215 S A -0.4298
216 G A -0.6010
217 D A -0.5475
218 L A 0.0672
219 T A -0.0357
220 Y A 0.0000
221 D A -0.8304
222 C A 0.0000
223 A A 0.0463
224 C A 0.0000
225 L A 1.4663
226 P A 0.1268
227 G A -0.0007
228 F A 0.0000
229 E A -1.5996
230 G A -0.9850
231 Q A -1.4821
232 N A -1.3310
233 C A 0.0000
234 E A -1.0124
235 V A 0.0861
236 N A 0.2529
237 V A 1.4429
238 D A -1.1215
239 D A -1.3225
240 C A 0.0000
241 P A 0.0123
242 G A -0.4726
243 H A 0.0000
244 R A -1.9302
245 C A 0.0000
246 L A 0.1726
247 N A 0.0000
248 G A -0.1416
249 G A -0.4798
250 T A -0.0776
251 C A 0.3302
252 V A 0.8875
253 D A -0.2805
254 G A 0.1277
255 V A 1.6792
256 N A 0.1824
257 T A 0.0155
258 Y A 0.2102
259 N A -0.1559
260 C A 0.0000
261 Q A -1.0143
262 C A 0.0000
263 P A -0.3319
264 P A -0.3898
265 E A -0.3572
266 W A 0.0000
267 T A -0.0195
268 G A 0.0000
269 Q A -0.8725
270 F A 1.4449
271 C A 0.0000
272 T A -0.2355
273 E A -1.0240
274 D A 0.0000
275 V A 1.7193
276 D A -0.1888
277 E A -1.3368
278 C A -0.4074
279 Q A -0.8935
280 L A 1.2976
281 Q A 0.0000
282 P A -0.0998
283 N A 0.0000
284 A A 0.0000
285 C A -0.0353
286 H A -1.1195
287 N A -1.5072
288 G A -0.7864
289 G A -0.5321
290 T A -0.1155
291 C A 0.6016
292 F A 1.7374
293 N A -0.8928
294 T A 0.0000
295 L A 1.5477
296 G A 0.0000
297 G A 0.0000
298 H A 0.0000
299 S A 0.0000
300 C A 0.0000
301 V A 0.2258
302 C A 0.3913
303 V A 1.7147
304 N A -0.0238
305 G A 0.0000
306 W A -0.0794
307 T A 0.0000
308 G A 0.0000
309 E A -0.2500
310 S A -0.2248
311 C A 0.0891
312 S A -0.0529
313 Q A 0.0000
314 N A -1.2460
315 I A 0.0000
316 D A -0.6808
317 D A -0.4716
318 C A 0.0000
319 A A 0.0000
320 T A 0.0000
321 A A 0.0000
322 V A 0.0000
323 C A 0.0000
324 F A 0.0000
325 H A -0.4747
326 G A -0.5390
327 A A -0.0916
328 T A -0.0069
329 C A 0.1309
330 H A -1.0494
331 D A -1.1920
332 R A -1.6296
333 V A 1.4382
334 A A 0.3939
335 S A 0.0000
336 F A 0.0000
337 Y A 0.6647
338 C A 0.0000
339 A A 0.0000
340 C A 0.1674
341 P A 0.0246
342 M A 0.0000
343 G A -0.3854
344 K A -1.7071
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 0.0000
351 L A 0.0000
352 D A -1.0411
353 D A 0.0000
354 A A 0.0000
355 C A 0.0000
356 V A 1.7320
357 S A 0.0889
358 N A -0.2860
359 P A -0.2749
360 C A -0.0216
361 H A -0.3938
362 E A -0.6316
363 D A -1.8313
364 A A 0.0000
365 I A 0.5978
366 C A 0.0000
367 D A -0.5556
368 T A 0.0000
369 N A -0.1651
370 P A 0.0000
371 V A 0.0000
372 N A 0.0000
373 G A 0.0000
374 R A -0.5493
375 A A 0.0000
376 I A 1.2379
377 C A 0.0000
378 T A 0.0072
379 C A 0.1001
380 P A -0.1214
381 P A -0.2893
382 G A -0.2992
383 F A 0.2219
384 T A -0.0730
385 G A -0.5594
386 G A -0.5528
387 A A -0.0783
388 C A 0.0000
389 D A -2.0273
390 Q A -1.8958
391 D A -1.9578
392 V A -0.3615
393 D A -1.6877
394 E A 0.0000
395 C A 0.0585
396 S A 0.1449
397 I A 1.6960
398 G A -0.1145
399 A A -0.0617
400 N A -0.2028
401 P A -0.1500
402 C A -0.0809
403 E A -1.3001
404 H A -0.2639
405 L A 0.3517
406 G A -0.4148
407 R A -1.8057
408 C A 0.0549
409 V A 0.2580
410 N A -0.3102
411 T A 0.0000
412 Q A 0.0000
413 G A -0.0430
414 S A 0.0000
415 F A 0.0000
416 L A 0.0000
417 C A 0.0000
418 Q A 0.0000
419 C A 0.0000
420 G A 0.0000
421 R A -1.8553
422 G A -0.4154
423 Y A 0.0000
424 T A 0.0000
425 G A 0.0000
426 P A 0.0000
427 R A -0.5659
428 C A -0.3891
429 E A -1.9230
430 T A -0.3457
431 D A 0.0000
432 V A 0.4385
433 N A -0.1468
434 E A -0.3870
435 C A 0.3192
436 L A 0.8280
437 S A -0.0684
438 G A -0.1537
439 P A -0.2229
440 C A -0.3032
441 R A -1.9051
442 N A -0.9731
443 Q A -1.2708
444 A A -0.2182
445 T A -0.0039
446 C A 0.0000
447 L A 0.3259
448 D A 0.0000
449 R A -1.3991
450 I A 0.0000
451 G A -0.1686
452 Q A -0.4588
453 F A 0.2375
454 T A 0.0000
455 C A 0.0000
456 I A 0.8805
457 C A 0.3385
458 M A 0.4759
459 A A 0.2597
460 G A -0.2049
461 F A 1.5492
462 T A 0.2108
463 G A -0.3697
464 T A 0.1505
465 Y A 1.3085
466 C A 0.0000
467 E A -0.8287
468 V A 0.0000
469 D A -1.0152
470 I A -0.1268
471 D A -1.8624
472 E A -1.1158
473 C A -0.3732
474 Q A -1.2124
475 S A -0.4414
476 S A 0.0000
477 P A -0.2345
478 C A 0.2007
479 V A 0.6690
480 N A -0.3433
481 G A -0.5549
482 G A 0.1234
483 V A 1.3689
484 C A 0.1244
485 K A -1.9245
486 D A -1.9257
487 R A -1.7046
488 V A 1.1851
489 N A -0.9616
490 G A -0.2806
491 F A 0.0524
492 S A -0.0421
493 C A 0.1393
494 T A 0.0116
495 C A 0.1750
496 P A -0.0543
497 S A -0.1353
498 G A -0.1815
499 F A 0.8426
500 S A -0.0521
501 G A -0.1579
502 S A -0.2407
503 T A -0.1089
504 C A 0.0000
505 Q A -1.1610
506 L A -0.2208
507 D A -1.3740
508 V A -0.2389
509 D A -0.8317
510 E A -1.2419
511 C A -0.0842
512 A A 0.0098
513 S A -0.2098
514 T A -0.0967
515 P A -0.2326
516 C A -0.2176
517 R A -1.8999
518 N A -1.6335
519 G A -0.4674
520 A A -0.3042
521 K A -1.5788
522 C A 0.4517
523 V A 0.8562
524 D A -1.0764
525 Q A -1.4326
526 P A -0.7635
527 D A -1.8731
528 G A -0.4844
529 Y A 0.1100
530 E A -1.6999
531 C A -0.5096
532 R A -1.8033
533 C A -0.2994
534 A A -0.0897
535 E A -0.6172
536 G A 0.0838
537 F A 1.5928
538 E A -1.1212
539 G A -0.7426
540 T A 0.1241
541 L A 1.5348
542 C A 0.0000
543 D A -0.5046
544 R A -0.1969
545 N A -0.3410
546 V A 1.4201
547 D A -1.2408
548 D A -1.9698
549 C A -0.0945
550 S A -0.1719
551 P A -0.3988
552 D A -1.6472
553 P A -0.5443
554 C A -0.1577
555 H A -1.1611
556 H A -1.2462
557 G A -0.8966
558 R A -1.8877
559 C A 0.1379
560 V A 1.4439
561 D A -1.2998
562 G A -0.2126
563 I A 1.9752
564 A A 0.4203
565 S A 0.3045
566 F A 1.7329
567 S A 0.0000
568 C A 0.1834
569 A A 0.0467
570 C A 0.0444
571 A A -0.0193
572 P A -0.3329
573 G A -0.3503
574 Y A 0.6309
575 T A -0.0072
576 G A -0.4927
577 T A -0.2892
578 R A -0.7188
579 C A 0.0276
580 E A -0.6514
581 S A -0.2534
582 Q A -0.4773
583 V A 0.7312
584 D A -0.7637
585 E A -1.6798
586 C A 0.0000
587 R A -1.8846
588 S A -0.5638
589 Q A 0.0000
590 P A -0.2549
591 C A 0.0000
592 R A -2.0344
593 H A -1.4488
594 G A -0.6817
595 G A -0.6625
596 K A -1.6766
597 C A 0.1456
598 L A 0.8709
599 D A -0.6031
600 L A 1.4914
601 V A 1.9946
602 D A -0.3629
603 K A -1.4588
604 Y A 0.6273
605 L A 1.0707
606 C A -0.0649
607 R A -1.8285
608 C A 0.0000
609 P A -0.1936
610 S A -0.1704
611 G A -0.5081
612 T A -0.0845
613 T A -0.1205
614 G A -0.1951
615 V A 1.2357
616 N A -0.4517
617 C A 0.0000
618 E A -1.1321
619 V A -0.2231
620 N A -1.1154
621 I A 0.2185
622 D A -1.8029
623 D A -0.7227
624 C A 0.5772
625 A A 0.1019
626 S A -0.2833
627 N A -0.4793
628 P A -0.2945
629 C A 0.1254
630 T A 0.3347
631 F A 1.9086
632 G A 0.5007
633 V A 1.1578
634 C A 0.2674
635 R A -1.6502
636 D A -1.1737
637 G A 0.1710
638 I A 1.7438
639 N A -1.2268
640 R A -2.0864
641 Y A 0.0000
642 D A -0.7675
643 C A 0.1056
644 V A 0.7343
645 C A 0.1499
646 Q A -0.3974
647 P A -0.3535
648 G A 0.0239
649 F A 1.1631
650 T A 0.1111
651 G A -0.5073
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1935 V A 0.0000
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1938 L A 1.1917
1939 G A -0.0934
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1972 E A -1.2757
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1974 T A 0.0000
1975 P A 0.0000
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1977 F A 0.2098
1978 L A 0.0000
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1980 A A 0.0000
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1982 E A -2.1774
1983 G A -0.4339
1984 S A -0.0483
1985 Y A 0.0000
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1989 K A -0.3064
1990 L A 0.0000
1991 L A 0.0000
1992 L A 0.0000
1993 D A -0.2081
1994 H A 0.0000
1995 F A 0.0000
1996 A A -0.0374
1997 N A -0.3488
1998 R A -0.9509
1999 E A 0.0000
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2002 D A -0.5122
2003 H A -0.2431
2004 L A 0.0000
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2008 P A 0.0000
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2010 D A -0.4259
2011 V A 0.0000
2012 A A 0.0000
2013 Q A -0.6541
2014 E A -2.2498
2015 R A -1.9159
2016 L A 0.9380
2017 H A -0.1928
2018 Q A -0.5184
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2287 L A 1.5477
2288 P A 0.0000
2289 A A -0.0231
2290 Q A -0.2546
2291 P A 0.1218
2292 L A 1.1433
2293 P A 0.2776
2294 L A 0.6850
2295 S A 0.1281
2296 V A 1.0098
2297 P A -0.0411
2298 S A -0.1937
2299 S A -0.0923
2300 L A 0.0000
2301 A A 0.0000
2302 Q A 0.0000
2303 A A 0.0000
2304 Q A -0.4745
2305 T A -0.1707
2306 Q A -0.9053
2307 L A 1.2257
2308 G A -0.2744
2309 P A -0.4831
2310 Q A -0.3386
2311 P A -0.4001
2312 E A -1.5497
2313 V A 0.0008
2314 T A -0.0586
2315 P A -0.5810
2316 K A -1.8394
2317 R A -0.9125
2318 Q A -0.4574
2319 V A 1.0948
2320 L A 1.5962
2321 A A 0.3308
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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, -0.1845 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_6 -0.1845 View CSV PDB
model_0 -0.1976 View CSV PDB
model_2 -0.1994 View CSV PDB
model_3 -0.2019 View CSV PDB
model_4 -0.2031 View CSV PDB
model_8 -0.2034 View CSV PDB
model_9 -0.2036 View CSV PDB
model_1 -0.2089 View CSV PDB
CABS_average -0.214 View CSV PDB
model_5 -0.218 View CSV PDB
model_7 -0.2441 View CSV PDB
model_11 -0.2508 View CSV PDB
model_10 -0.2525 View CSV PDB
input -0.2783 View CSV PDB