Project name: P590S_4D

Status: done

Started: 2026-05-14 06:11:21
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQSCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:26:14)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (11:31:13)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (11:31:57)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (11:32:41)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (11:33:26)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (11:34:09)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (11:34:53)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (11:35:36)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (11:36:21)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (11:37:07)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (11:37:52)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (11:38:38)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (11:39:23)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (11:40:07)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (11:41:33)
[INFO]       Main:     Simulation completed successfully.                                          (11:42:15)
Show buried residues

Minimal score value
-4.4562
Maximal score value
4.2565
Average score
-0.5807
Total score value
-1347.7777

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 0.1543
2 G A -0.2089
3 P A -0.2223
4 G A 0.0000
5 A A -0.7465
6 R A -1.4775
7 G A 0.0000
8 R A -1.4088
9 R A -1.8902
10 R A -1.6392
11 R A -1.2160
12 R A -1.0734
13 R A -1.4166
14 P A 0.0000
15 M A -0.2114
16 S A -0.6635
17 P A -0.3991
18 P A -0.4431
19 P A 0.0000
20 P A -0.3884
21 P A -0.4204
22 P A -0.7633
23 P A -0.5166
24 V A -0.3232
25 R A -1.4699
26 A A -1.0002
27 L A -0.4093
28 P A -0.2740
29 L A 0.1803
30 L A -0.1115
31 L A 0.0345
32 L A 0.0000
33 L A 0.0000
34 A A 0.0000
35 G A 0.0000
36 P A -0.7313
37 G A -0.7867
38 A A -0.3623
39 A A -0.6959
40 A A -0.4599
41 P A -0.5764
42 P A 0.0000
43 C A 0.2911
44 L A 1.1804
45 D A -0.4796
46 G A -0.7749
47 S A -0.9308
48 P A -1.3034
49 C A -1.0752
50 A A -1.5428
51 N A -2.0731
52 G A -1.5935
53 G A -1.6480
54 R A -2.0000
55 C A -0.6505
56 T A -0.8927
57 Q A -1.4490
58 L A -1.0045
59 P A -1.0221
60 S A -1.0397
61 R A -1.6130
62 E A -1.7942
63 A A 0.0000
64 A A 0.0000
65 C A 0.0000
66 L A 0.0182
67 C A -0.8243
68 P A -0.6898
69 P A -0.9427
70 G A 0.0000
71 W A -0.5517
72 V A 0.0000
73 G A 0.0000
74 E A 0.0000
75 R A -2.4364
76 C A 0.0000
77 Q A -1.6590
78 L A -1.2872
79 E A -1.4724
80 D A -2.0811
81 P A -1.0065
82 C A -0.2310
83 H A -0.3809
84 S A 0.0048
85 G A -0.3332
86 P A -0.0741
87 C A -0.2870
88 A A -0.8988
89 G A -1.5390
90 R A -2.0373
91 G A -1.2160
92 V A 0.0000
93 C A 0.0000
94 Q A 0.0000
95 S A 0.0000
96 S A -0.2269
97 V A 0.0000
98 V A -0.4173
99 A A -0.8822
100 G A -0.9296
101 T A -0.4365
102 A A -0.6447
103 R A -0.8768
104 F A 0.8237
105 S A -0.1063
106 C A -0.1952
107 R A 0.0000
108 C A 0.0000
109 P A -1.0375
110 R A -1.3060
111 G A -0.5319
112 F A 0.2411
113 R A 0.0000
114 G A 0.0000
115 P A 0.0000
116 D A -1.5143
117 C A -0.3584
118 S A -0.2323
119 L A 0.3469
120 P A -0.5042
121 D A -0.7908
122 P A -0.3608
123 C A 0.5472
124 L A 1.6538
125 S A 0.5553
126 S A 0.5822
127 P A 0.4013
128 C A -0.0503
129 A A -0.7272
130 H A -1.3736
131 G A -1.3212
132 A A -1.1775
133 R A -1.6827
134 C A -0.0144
135 S A 0.1110
136 V A 0.0000
137 G A 0.0000
138 P A -1.4773
139 D A -2.6774
140 G A -2.2886
141 R A -2.1589
142 F A -0.2132
143 L A 0.9288
144 C A 0.2726
145 S A -0.3840
146 C A -0.7447
147 P A -0.9795
148 P A -0.6521
149 G A -0.6052
150 Y A -0.8986
151 Q A -1.8040
152 G A -1.9812
153 R A -2.0741
154 S A -1.1492
155 C A -0.5942
156 R A -1.0973
157 S A -1.1286
158 D A -0.5991
159 V A 0.1527
160 D A -1.4535
161 E A -1.0937
162 C A -1.0727
163 R A -2.1223
164 V A -0.7207
165 G A -1.3438
166 E A -2.5933
167 P A -2.0776
168 C A -2.1550
169 R A -2.8812
170 H A -2.4379
171 G A -1.5216
172 G A -1.2467
173 T A -1.2153
174 C A -0.7681
175 L A -0.3321
176 N A -0.9072
177 T A -0.7426
178 P A -0.7063
179 G A -1.0390
180 S A -0.3279
181 F A 0.0750
182 R A -1.2383
183 C A -1.3277
184 Q A -1.6977
185 C A 0.0000
186 P A -1.1813
187 A A -0.3495
188 G A 0.0434
189 Y A -0.3725
190 T A -0.6027
191 G A -0.8554
192 P A -0.2142
193 L A -0.2190
194 C A -1.0938
195 E A -1.3275
196 N A -0.8176
197 P A -0.4969
198 A A 0.4606
199 V A 0.7062
200 P A 0.2183
201 C A -0.0874
202 A A 0.1134
203 P A -0.2793
204 S A -0.8141
205 P A -0.9444
206 C A -1.3013
207 R A -2.3747
208 N A -2.3473
209 G A -1.5278
210 G A -1.0377
211 T A -0.6008
212 C A -0.6000
213 R A -2.0069
214 Q A -1.8180
215 S A -1.2628
216 G A -1.4117
217 D A -1.3421
218 L A 0.2700
219 T A -0.1646
220 Y A -0.1876
221 D A -1.6693
222 C A 0.0000
223 A A -0.7148
224 C A 0.0000
225 L A -0.1573
226 P A 0.0000
227 G A 0.0573
228 F A 0.8503
229 E A -1.0583
230 G A -1.7038
231 Q A -2.4357
232 N A -2.4113
233 C A 0.0000
234 E A -1.6374
235 V A -0.4291
236 N A -0.3108
237 V A -0.2240
238 D A -2.2351
239 D A -2.2588
240 C A -1.3436
241 P A -1.2478
242 G A -0.9886
243 H A -0.5400
244 R A -0.8311
245 C A -0.5181
246 L A -0.7775
247 N A -1.6363
248 G A -1.1728
249 G A -0.9546
250 T A 0.0000
251 C A -0.3422
252 V A 0.0477
253 D A -0.8039
254 G A -0.9865
255 V A -0.6540
256 N A -1.1362
257 T A -0.5561
258 Y A -0.8016
259 N A -1.0133
260 C A -0.6334
261 Q A -1.2536
262 C A -0.9308
263 P A -0.8313
264 P A -0.9266
265 E A -1.2969
266 W A 0.1527
267 T A 0.0064
268 G A 0.0318
269 Q A 0.1434
270 F A 0.2354
271 C A 0.0000
272 T A 0.0000
273 E A -0.5497
274 D A -0.4667
275 V A -0.2454
276 D A -0.6498
277 E A -1.1259
278 C A 0.0000
279 Q A -0.7109
280 L A -0.0644
281 Q A -1.1049
282 P A -1.0232
283 N A -1.5104
284 A A -1.2127
285 C A -1.1385
286 H A -1.4741
287 N A -1.8198
288 G A -1.6616
289 G A -1.4628
290 T A 0.0000
291 C A 0.0000
292 F A 0.0000
293 N A 0.0000
294 T A 0.0000
295 L A -0.7277
296 G A -0.6455
297 G A -0.6666
298 H A -0.7428
299 S A 0.0000
300 C A 0.0000
301 V A 0.0000
302 C A 0.0000
303 V A 0.9870
304 N A 0.3872
305 G A 0.1069
306 W A 0.4064
307 T A -0.5869
308 G A -1.2159
309 E A -1.9614
310 S A -1.0783
311 C A 0.0000
312 S A -0.7056
313 Q A -0.4874
314 N A -0.5336
315 I A -0.5229
316 D A -1.6184
317 D A 0.0000
318 C A 0.0860
319 A A 0.4010
320 T A 0.2767
321 A A 0.2445
322 V A 1.2228
323 C A 1.2056
324 F A 1.9086
325 H A 0.5433
326 G A -0.0963
327 A A -0.1565
328 T A 0.1150
329 C A 0.5108
330 H A -0.1868
331 D A -0.7171
332 R A 0.0000
333 V A -0.5642
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 0.0000
341 P A -0.9842
342 M A 0.0000
343 G A -1.8317
344 K A -1.7489
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 -0.4168
351 L A 0.3795
352 D A -0.6241
353 D A 0.0000
354 A A -0.5342
355 C A 0.0000
356 V A -0.4829
357 S A -0.5361
358 N A -0.7058
359 P A -1.0452
360 C A 0.0000
361 H A -1.8422
362 E A -2.8840
363 D A -2.6581
364 A A 0.0000
365 I A 0.0000
366 C A 0.0000
367 D A 0.0000
368 T A 0.0000
369 N A 0.0000
370 P A -0.7235
371 V A 0.0000
372 N A -1.0506
373 G A -1.4707
374 R A -2.0318
375 A A -1.0272
376 I A -0.5505
377 C A 0.0000
378 T A 0.0000
379 C A 0.0000
380 P A -0.8877
381 P A -0.9523
382 G A 0.0000
383 F A 0.0000
384 T A -1.5719
385 G A -1.2982
386 G A -1.2980
387 A A -0.8464
388 C A -1.1758
389 D A -2.1955
390 Q A -1.8498
391 D A -1.6375
392 V A -0.8528
393 D A -1.1906
394 E A -0.6538
395 C A 0.0000
396 S A -0.7938
397 I A 0.0000
398 G A -0.8594
399 A A -0.4179
400 N A -0.7056
401 P A -0.7564
402 C A -1.4955
403 E A -2.1392
404 H A -1.3816
405 L A -1.1259
406 G A -2.0026
407 R A -2.5049
408 C A 0.0000
409 V A -0.0419
410 N A -0.5304
411 T A -0.6506
412 Q A -1.6547
413 G A -1.1006
414 S A -0.4361
415 F A -0.2392
416 L A -0.0547
417 C A 0.0000
418 Q A -2.3438
419 C A -2.3282
420 G A -2.3843
421 R A -2.3839
422 G A -1.7281
423 Y A -1.1614
424 T A -1.0638
425 G A -1.5874
426 P A -1.4190
427 R A -2.3364
428 C A 0.0000
429 E A -1.5915
430 T A -0.9323
431 D A -0.5222
432 V A -0.6480
433 N A -0.9801
434 E A -0.7140
435 C A 0.0000
436 L A 0.0000
437 S A 0.0951
438 G A -0.1820
439 P A -0.2380
440 C A -0.2734
441 R A 0.0000
442 N A -2.1904
443 Q A -1.4157
444 A A -0.1964
445 T A 0.5834
446 C A 0.0000
447 L A 1.2308
448 D A -0.6240
449 R A -1.8858
450 I A -1.1970
451 G A -1.7128
452 Q A -1.4600
453 F A -0.0584
454 T A 0.6803
455 C A 1.5050
456 I A 2.5884
457 C A 1.0572
458 M A 0.9032
459 A A 0.1539
460 G A -0.3862
461 F A 1.2930
462 T A -0.1348
463 G A 0.2311
464 T A 0.1781
465 Y A 0.9598
466 C A 0.0000
467 E A -1.1194
468 V A -0.3187
469 D A -1.9112
470 I A -1.8547
471 D A -3.1157
472 E A -2.6365
473 C A 0.0000
474 Q A -2.3894
475 S A -1.6686
476 S A -0.8833
477 P A -0.5902
478 C A 0.0000
479 V A -0.2497
480 N A -1.4821
481 G A -0.9878
482 G A -0.0272
483 V A 0.9840
484 C A -0.2395
485 K A -1.7804
486 D A -2.1274
487 R A -2.2073
488 V A -0.6854
489 N A -1.1564
490 G A -0.9452
491 F A -0.1230
492 S A -0.2432
493 C A 0.4877
494 T A 0.5960
495 C A 0.4502
496 P A 0.1700
497 S A -0.0660
498 G A 0.0740
499 F A 1.3747
500 S A 0.3523
501 G A -0.4646
502 S A -0.4894
503 T A -0.1934
504 C A -0.0320
505 Q A -0.8623
506 L A -0.3656
507 D A 0.0000
508 V A -1.0529
509 D A -2.3815
510 E A -2.6978
511 C A -1.2662
512 A A -0.9953
513 S A -0.5962
514 T A -0.4109
515 P A -0.8531
516 C A -0.6253
517 R A -2.2820
518 N A -1.4603
519 G A -2.0061
520 A A -1.9123
521 K A -2.2583
522 C A -1.0280
523 V A -0.2283
524 D A -2.2597
525 Q A -2.4770
526 P A -2.4423
527 D A -2.9836
528 G A -1.9922
529 Y A -1.3557
530 E A -1.4684
531 C A -1.2928
532 R A -2.4983
533 C A -2.0898
534 A A -2.3895
535 E A -2.6841
536 G A -1.6958
537 F A -1.2744
538 E A -2.1145
539 G A -1.4092
540 T A -0.4579
541 L A -0.0018
542 C A 0.0000
543 D A 0.0000
544 R A -2.1826
545 N A -1.3711
546 V A -0.3208
547 D A -2.0583
548 D A -2.6248
549 C A 0.0000
550 S A -2.0097
551 P A -2.0441
552 D A -2.4326
553 P A -1.5437
554 C A 0.0000
555 H A -2.1348
556 H A -1.9618
557 G A -1.8271
558 R A -1.9237
559 C A -0.9566
560 V A -0.0249
561 D A -1.3871
562 G A -0.3993
563 I A 0.3584
564 A A -0.6883
565 S A -0.0730
566 F A -0.4772
567 S A -0.3569
568 C A -0.8367
569 A A 0.0000
570 C A 0.0000
571 A A 0.0000
572 P A -0.5292
573 G A -0.1000
574 Y A -0.1690
575 T A -0.5757
576 G A -1.6380
577 T A -1.6800
578 R A -2.8480
579 C A 0.0000
580 E A -2.6063
581 S A -1.3870
582 Q A -0.9847
583 V A 0.5416
584 D A -1.0277
585 E A -1.8967
586 C A 0.0000
587 R A -2.7346
588 S A -2.1304
589 Q A -2.0778
590 S A -1.7838
591 C A 0.0000
592 R A -2.9617
593 H A -2.2711
594 G A -1.7087
595 G A -1.7910
596 K A -1.4442
597 C A -0.9169
598 L A 0.4573
599 D A -0.1395
600 L A 1.2266
601 V A 0.7970
602 D A -0.9540
603 K A -0.3919
604 Y A 0.2439
605 L A 0.8395
606 C A -0.7921
607 R A -2.4057
608 C A -1.6990
609 P A -1.1080
610 S A -0.8020
611 G A -0.9270
612 T A -0.9757
613 T A -0.9781
614 G A -0.8253
615 V A -0.4032
616 N A -1.5156
617 C A -1.4881
618 E A -1.5601
619 V A 0.0869
620 N A -0.7674
621 I A -0.2012
622 D A -2.0758
623 D A -1.8537
624 C A -0.8370
625 A A -0.1860
626 S A -0.1407
627 N A 0.1330
628 P A 0.1933
629 C A 1.4380
630 T A 1.3944
631 F A 2.3374
632 G A 2.1500
633 V A 1.7293
634 C A -0.1248
635 R A -2.1902
636 D A -2.4102
637 G A -1.3185
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2255 W A 0.0000
2256 A A -0.2416
2257 S A -0.4216
2258 P A -0.2227
2259 S A -0.3225
2260 P A -0.1519
2261 P A -0.0605
2262 S A 0.3772
2263 L A 0.8996
2264 S A -0.2426
2265 D A -1.4972
2266 W A -0.8323
2267 S A -1.3360
2268 E A -2.0656
2269 S A -1.1492
2270 T A -0.9213
2271 P A -0.3626
2272 S A -0.2932
2273 P A -0.2404
2274 A A -0.4893
2275 T A -0.4483
2276 A A -0.1393
2277 T A 0.0283
2278 G A 0.1590
2279 A A 0.5521
2280 M A 1.3327
2281 A A 0.3519
2282 T A -0.4309
2283 T A -1.2091
2284 T A -1.1002
2285 G A -0.7022
2286 A A 0.2815
2287 L A 0.9056
2288 P A -0.1311
2289 A A -0.4651
2290 Q A -0.9766
2291 P A -0.4031
2292 L A 1.1614
2293 P A 0.5239
2294 L A 0.9325
2295 S A 0.4295
2296 V A 1.2649
2297 P A 0.3614
2298 S A -0.1623
2299 S A -0.2725
2300 L A 0.2791
2301 A A 0.0000
2302 Q A -0.6484
2303 A A -0.2180
2304 Q A -0.8166
2305 T A -0.0499
2306 Q A -0.4723
2307 L A 0.5974
2308 G A -0.6047
2309 P A -1.1552
2310 Q A -1.6089
2311 P A -0.9976
2312 E A -0.5943
2313 V A 1.1034
2314 T A -0.0244
2315 P A -0.9344
2316 K A -2.2537
2317 R A -2.3225
2318 Q A -1.5230
2319 V A 0.0000
2320 L A 0.6232
2321 A A 0.4769
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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, -0.5807 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_9 -0.5807 View CSV PDB
model_2 -0.5878 View CSV PDB
model_3 -0.5932 View CSV PDB
model_1 -0.5985 View CSV PDB
model_4 -0.6008 View CSV PDB
model_7 -0.6034 View CSV PDB
CABS_average -0.6136 View CSV PDB
model_6 -0.6159 View CSV PDB
model_5 -0.6173 View CSV PDB
model_0 -0.6192 View CSV PDB
model_8 -0.6361 View CSV PDB
model_10 -0.6407 View CSV PDB
model_11 -0.6692 View CSV PDB
input -0.7629 View CSV PDB