Project name: C606R_4D

Status: done

Started: 2026-05-07 02:41:34
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLRRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:29:27)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (18:55:15)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (18:56:45)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (18:58:23)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (18:59:57)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (19:01:32)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (19:03:05)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (19:04:30)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (19:05:59)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (19:07:22)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (19:08:49)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (19:10:22)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (19:11:51)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (19:13:22)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (19:16:26)
[INFO]       Main:     Simulation completed successfully.                                          (19:17:55)
Show buried residues

Minimal score value
-4.0013
Maximal score value
4.3753
Average score
-0.6082
Total score value
-1411.7399

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 -0.6300
2 G A -1.5592
3 P A -1.2566
4 G A -0.8979
5 A A -0.5504
6 R A -1.0430
7 G A -1.7860
8 R A -2.6046
9 R A -2.1535
10 R A -1.8294
11 R A 0.0000
12 R A -2.3876
13 R A -1.4424
14 P A 0.1021
15 M A 1.0174
16 S A 0.3412
17 P A 0.2277
18 P A -0.4153
19 P A -0.5946
20 P A -0.5853
21 P A -0.4432
22 P A -0.4317
23 P A -0.1995
24 V A -0.1016
25 R A -1.3040
26 A A -0.7203
27 L A 0.7489
28 P A 0.5673
29 L A 1.7311
30 L A 3.1343
31 L A 3.5545
32 L A 3.4965
33 L A 2.7566
34 A A 1.0471
35 G A -0.1439
36 P A -0.4779
37 G A -0.6894
38 A A -0.3072
39 A A 0.2021
40 A A 0.0388
41 P A -0.3828
42 P A -1.0440
43 C A -1.0757
44 L A -1.3142
45 D A -2.0432
46 G A -1.3852
47 S A -0.8231
48 P A -0.9883
49 C A -0.9364
50 A A -0.9684
51 N A -1.9577
52 G A -1.4576
53 G A -1.1822
54 R A -1.5357
55 C A -0.2081
56 T A -0.7377
57 Q A -1.6818
58 L A -0.8422
59 P A -1.1728
60 S A -1.3772
61 R A -2.2842
62 E A -2.7891
63 A A -1.5502
64 A A 0.0000
65 C A 0.0000
66 L A 0.7080
67 C A -0.2978
68 P A -0.5041
69 P A -0.7541
70 G A -1.1931
71 W A -1.2793
72 V A -1.0213
73 G A -1.3930
74 E A -1.6818
75 R A -1.0616
76 C A 0.0000
77 Q A 0.0000
78 L A -1.2881
79 E A -1.9473
80 D A -1.4530
81 P A -1.2531
82 C A 0.0000
83 H A -1.5093
84 S A -1.2229
85 G A -0.9660
86 P A -1.0701
87 C A -0.9784
88 A A -0.8677
89 G A -1.6500
90 R A -2.2640
91 G A -1.0292
92 V A 0.6784
93 C A -0.2886
94 Q A -1.0560
95 S A 0.0000
96 S A -1.2873
97 V A 0.0000
98 V A -0.9753
99 A A -0.9607
100 G A -0.6736
101 T A -0.5820
102 A A -1.0169
103 R A -1.5052
104 F A -0.3826
105 S A -0.7370
106 C A -0.8997
107 R A -1.1036
108 C A -1.2392
109 P A -1.4916
110 R A -2.4908
111 G A -1.2864
112 F A -0.4423
113 R A -1.8708
114 G A -0.9746
115 P A -1.1297
116 D A -1.6143
117 C A -0.5633
118 S A -0.4901
119 L A -0.2493
120 P A -1.0044
121 D A -1.2856
122 P A -0.4293
123 C A 0.7908
124 L A 1.5281
125 S A 0.3648
126 S A 0.1279
127 P A 0.0673
128 C A -0.2729
129 A A -0.1238
130 H A -0.6848
131 G A -0.8839
132 A A -1.1281
133 R A -1.4749
134 C A 0.2064
135 S A 0.6730
136 V A 1.1343
137 G A -0.6208
138 P A -1.3277
139 D A -2.2710
140 G A -1.7842
141 R A -1.3587
142 F A -0.0017
143 L A 0.1967
144 C A 0.0000
145 S A 0.0000
146 C A 0.0000
147 P A -0.2107
148 P A 0.3861
149 G A 0.8722
150 Y A 0.9279
151 Q A -0.6937
152 G A -1.4965
153 R A -2.2429
154 S A -1.3393
155 C A -1.3533
156 R A -1.1053
157 S A -0.7065
158 D A -0.0541
159 V A 1.1635
160 D A -0.4456
161 E A 0.0000
162 C A -0.8497
163 R A -1.2754
164 V A 0.6182
165 G A -0.7618
166 E A -1.8890
167 P A -1.1090
168 C A -1.2947
169 R A -2.1656
170 H A -1.4026
171 G A -1.1961
172 G A -0.7454
173 T A -0.6320
174 C A -0.4192
175 L A 0.5959
176 N A -0.7419
177 T A -0.6869
178 P A -0.4682
179 G A 0.0000
180 S A -0.3103
181 F A -0.5461
182 R A -1.1487
183 C A -0.4139
184 Q A -0.4197
185 C A -0.1233
186 P A -0.0244
187 A A -0.0708
188 G A 0.2407
189 Y A 0.1786
190 T A -0.2815
191 G A -0.8415
192 P A -0.8029
193 L A -0.1664
194 C A -0.3605
195 E A -1.9902
196 N A -1.3820
197 P A -0.7189
198 A A -0.1696
199 V A -0.1282
200 P A -0.0662
201 C A 0.0000
202 A A -0.8590
203 P A -0.7795
204 S A -1.0195
205 P A -1.7505
206 C A 0.0000
207 R A -2.7619
208 N A -2.6864
209 G A -2.0560
210 G A -1.4269
211 T A -1.2986
212 C A -2.0665
213 R A -2.9346
214 Q A -2.6346
215 S A -1.5011
216 G A -1.3707
217 D A -1.4528
218 L A -0.2163
219 T A -1.0547
220 Y A -1.4794
221 D A -2.2237
222 C A 0.0000
223 A A -0.5574
224 C A -0.0419
225 L A 1.2510
226 P A 0.1037
227 G A 0.2515
228 F A 1.0999
229 E A 0.0369
230 G A -0.8488
231 Q A -1.3402
232 N A -0.7042
233 C A 0.0000
234 E A -1.2747
235 V A -1.0492
236 N A 0.0000
237 V A -0.4611
238 D A -2.0064
239 D A -2.5818
240 C A -1.5324
241 P A -1.1463
242 G A -1.3438
243 H A -0.9302
244 R A -0.4183
245 C A 0.0621
246 L A 0.3816
247 N A -1.0077
248 G A -0.8081
249 G A -0.5163
250 T A -0.4095
251 C A 0.2236
252 V A 1.0713
253 D A 0.3456
254 G A 0.4990
255 V A 0.6640
256 N A 0.0508
257 T A 0.4140
258 Y A 0.6636
259 N A -0.1790
260 C A -0.1076
261 Q A -0.7772
262 C A -0.6729
263 P A -0.7825
264 P A -0.9115
265 E A 0.0000
266 W A -0.3138
267 T A -0.6076
268 G A -0.8556
269 Q A -0.9763
270 F A 0.1869
271 C A -0.3343
272 T A -0.4861
273 E A -1.1606
274 D A -1.3124
275 V A -0.7362
276 D A -0.4335
277 E A -0.6352
278 C A 0.0000
279 Q A -0.5786
280 L A 0.5717
281 Q A -0.6628
282 P A -0.7425
283 N A -1.2219
284 A A -0.7944
285 C A -0.4968
286 H A -1.3359
287 N A -1.8189
288 G A -1.1387
289 G A -0.7822
290 T A 0.1475
291 C A 0.7621
292 F A 1.4713
293 N A 0.2387
294 T A 0.5436
295 L A 1.1099
296 G A -0.1670
297 G A -0.2298
298 H A 0.0000
299 S A -0.0140
300 C A 0.0000
301 V A 0.4500
302 C A 0.0000
303 V A 0.0241
304 N A -0.1588
305 G A 0.1506
306 W A 0.8909
307 T A 0.2327
308 G A -0.2068
309 E A -1.1525
310 S A 0.0000
311 C A 0.1001
312 S A -0.6660
313 Q A 0.0000
314 N A 0.0000
315 I A 0.7483
316 D A -0.7439
317 D A -0.3398
318 C A 0.2599
319 A A 0.3053
320 T A 0.4933
321 A A 1.6322
322 V A 2.3207
323 C A 1.9015
324 F A 1.9549
325 H A 0.2099
326 G A 0.1483
327 A A 1.1154
328 T A 0.0000
329 C A 0.0000
330 H A 0.0000
331 D A 0.0000
332 R A -1.3528
333 V A -0.3640
334 A A -0.4030
335 S A 0.4507
336 F A 1.8714
337 Y A 1.8786
338 C A 0.0000
339 A A 1.1188
340 C A 0.0000
341 P A 0.1194
342 M A 0.4370
343 G A -0.2481
344 K A -0.5075
345 T A -0.1737
346 G A 0.3532
347 L A 0.8571
348 L A 2.0092
349 C A 1.8584
350 H A 0.0000
351 L A 0.7354
352 D A -0.5975
353 D A -0.6153
354 A A -0.2926
355 C A 0.0000
356 V A 1.1813
357 S A 0.4546
358 N A 0.0000
359 P A 0.0988
360 C A -0.4972
361 H A -2.0444
362 E A -3.1415
363 D A -2.5993
364 A A -0.8394
365 I A 0.8160
366 C A 0.8876
367 D A 0.0809
368 T A 0.0000
369 N A -0.9597
370 P A -0.2914
371 V A 0.9224
372 N A -0.7604
373 G A -1.5134
374 R A -2.1111
375 A A -0.8161
376 I A 0.3131
377 C A 0.7181
378 T A 0.4156
379 C A 0.0000
380 P A -0.7247
381 P A -1.0452
382 G A -0.8936
383 F A -0.5758
384 T A -0.9921
385 G A -0.7334
386 G A -0.8808
387 A A -0.3994
388 C A -0.9989
389 D A -1.6587
390 Q A -1.6508
391 D A -1.3471
392 V A -1.4084
393 D A -2.1308
394 E A -1.6790
395 C A -0.2932
396 S A -0.1246
397 I A 0.0375
398 G A -0.7040
399 A A 0.0000
400 N A -2.1338
401 P A -1.8738
402 C A 0.0000
403 E A -2.2395
404 H A 0.0000
405 L A 0.8743
406 G A 0.1805
407 R A -0.4799
408 C A -0.3807
409 V A -0.2365
410 N A -1.2442
411 T A -1.0513
412 Q A -1.3769
413 G A -1.2968
414 S A -1.1728
415 F A 0.0000
416 L A -0.8887
417 C A 0.0000
418 Q A -0.5094
419 C A 0.0000
420 G A -1.1503
421 R A -1.0797
422 G A -0.8136
423 Y A -1.1931
424 T A 0.0000
425 G A 0.0000
426 P A -1.2446
427 R A -3.1273
428 C A 0.0000
429 E A -2.8852
430 T A -1.6310
431 D A -1.2412
432 V A -0.3165
433 N A -1.0482
434 E A -1.1037
435 C A 0.1935
436 L A 0.6273
437 S A -0.3065
438 G A -0.0486
439 P A -0.5970
440 C A -1.3306
441 R A -2.9191
442 N A -3.0694
443 Q A -2.0622
444 A A -0.4837
445 T A 0.7470
446 C A 0.9111
447 L A 0.7051
448 D A -1.4295
449 R A -1.8564
450 I A -0.3006
451 G A -0.9398
452 Q A -1.1826
453 F A 0.0000
454 T A 0.3860
455 C A 0.0000
456 I A 1.6566
457 C A 0.2866
458 M A 0.0000
459 A A -0.5945
460 G A -0.2804
461 F A 1.0255
462 T A 0.1574
463 G A -0.0630
464 T A 0.2473
465 Y A 1.0922
466 C A 0.0000
467 E A -1.4161
468 V A 0.0000
469 D A -1.7414
470 I A -1.8190
471 D A -3.6042
472 E A -3.5620
473 C A 0.0000
474 Q A -2.6238
475 S A -2.0958
476 S A 0.0000
477 P A -0.6959
478 C A -0.1706
479 V A 0.0794
480 N A -0.5700
481 G A -0.7427
482 G A -0.6275
483 V A -0.4617
484 C A -1.1302
485 K A -2.7496
486 D A -3.9025
487 R A -3.1499
488 V A -1.4797
489 N A -2.0978
490 G A -1.7620
491 F A -1.4826
492 S A -1.0146
493 C A -0.4059
494 T A 0.0611
495 C A 0.0000
496 P A -0.3448
497 S A -0.9593
498 G A -0.8185
499 F A -0.1938
500 S A -0.7146
501 G A -0.6016
502 S A -0.5168
503 T A -0.5622
504 C A 0.0000
505 Q A -0.9652
506 L A -0.9125
507 D A -1.9388
508 V A -1.5884
509 D A -2.9017
510 E A -2.4369
511 C A -0.6677
512 A A -0.4156
513 S A -0.1203
514 T A -0.4867
515 P A -0.8706
516 C A 0.0000
517 R A -3.3643
518 N A -2.9586
519 G A -2.2920
520 A A -2.2255
521 K A -2.5207
522 C A -1.4093
523 V A -1.1135
524 D A -2.1013
525 Q A -2.6394
526 P A -2.6308
527 D A -2.5122
528 G A -2.0224
529 Y A -1.9238
530 E A -2.5519
531 C A -1.4714
532 R A -2.4687
533 C A -2.1754
534 A A -1.3508
535 E A -1.3239
536 G A -0.7094
537 F A 0.4257
538 E A -0.7085
539 G A -0.5211
540 T A 0.2002
541 L A 1.1551
542 C A -0.1935
543 D A -1.7010
544 R A -2.1279
545 N A -1.5051
546 V A -0.8216
547 D A -1.9159
548 D A -1.7539
549 C A -1.0704
550 S A -1.2162
551 P A -0.9056
552 D A 0.0000
553 P A -0.7604
554 C A -1.1762
555 H A -1.5348
556 H A -1.7630
557 G A -1.6439
558 R A -1.7534
559 C A -0.5818
560 V A 0.2425
561 D A -1.0610
562 G A 0.0973
563 I A 0.8018
564 A A -0.2872
565 S A -0.0648
566 F A -0.2028
567 S A -0.4728
568 C A -0.8016
569 A A -0.8361
570 C A -1.0763
571 A A -0.5799
572 P A -0.0788
573 G A 0.0274
574 Y A 0.6921
575 T A 0.2649
576 G A -0.7362
577 T A -1.1394
578 R A -1.8355
579 C A 0.0000
580 E A -0.9016
581 S A -0.3251
582 Q A 0.2360
583 V A 0.8857
584 D A -1.3091
585 E A -2.3465
586 C A -1.5908
587 R A -2.4833
588 S A -1.7521
589 Q A -1.5942
590 P A -0.9023
591 C A -0.0140
592 R A 0.0000
593 H A -1.3508
594 G A -1.7458
595 G A -2.0092
596 K A -1.8941
597 C A -0.9677
598 L A 0.0771
599 D A -0.7504
600 L A 0.5218
601 V A 0.4030
602 D A -1.6998
603 K A -1.6631
604 Y A -0.8750
605 L A -0.1925
606 R A -1.5267
607 R A -1.7989
608 C A -1.4591
609 P A -1.1672
610 S A -1.1140
611 G A -0.3786
612 T A 0.0000
613 T A -0.6566
614 G A -0.4714
615 V A 0.0000
616 N A -1.0727
617 C A 0.2478
618 E A 0.3648
619 V A 1.4894
620 N A 0.0000
621 I A 1.5286
622 D A -0.3531
623 D A -1.7969
624 C A -1.0655
625 A A -0.7401
626 S A -1.1172
627 N A -1.4492
628 P A -0.3795
629 C A 0.0000
630 T A -0.0346
631 F A 0.4681
632 G A 0.2783
633 V A 1.0328
634 C A 0.0000
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2253 E A -2.2076
2254 H A 0.0000
2255 W A 0.4379
2256 A A 0.0189
2257 S A -0.3419
2258 P A -0.6792
2259 S A -0.8780
2260 P A -0.7943
2261 P A -0.4234
2262 S A -0.2779
2263 L A 0.7603
2264 S A -0.4997
2265 D A -1.5743
2266 W A -1.4160
2267 S A -1.6798
2268 E A -1.3840
2269 S A -0.9207
2270 T A -1.0433
2271 P A -0.9597
2272 S A -0.7164
2273 P A -0.5925
2274 A A -0.3924
2275 T A -0.1565
2276 A A 0.0315
2277 T A 0.0746
2278 G A 0.0768
2279 A A 0.4260
2280 M A 0.9366
2281 A A 0.4957
2282 T A -0.2737
2283 T A 0.0000
2284 T A 0.0000
2285 G A -0.4475
2286 A A -0.3806
2287 L A 0.0000
2288 P A 0.0000
2289 A A 0.0000
2290 Q A -1.4218
2291 P A -0.6780
2292 L A 0.7556
2293 P A 1.0301
2294 L A 1.7558
2295 S A 0.8689
2296 V A 1.5612
2297 P A 0.4652
2298 S A -0.1785
2299 S A -0.3129
2300 L A 0.8840
2301 A A -0.1144
2302 Q A -1.4024
2303 A A -0.7394
2304 Q A -0.5724
2305 T A -1.0210
2306 Q A -1.5417
2307 L A -0.6172
2308 G A -1.0049
2309 P A -1.2053
2310 Q A -0.8718
2311 P A -0.7187
2312 E A -0.5800
2313 V A 0.2500
2314 T A -0.0705
2315 P A 0.0000
2316 K A -0.9396
2317 R A 0.0000
2318 Q A -1.6669
2319 V A 0.0000
2320 L A 0.9417
2321 A A 0.7239
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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, -0.6082 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_3 -0.6082 View CSV PDB
model_8 -0.6089 View CSV PDB
model_4 -0.6161 View CSV PDB
model_5 -0.6196 View CSV PDB
model_7 -0.6208 View CSV PDB
model_1 -0.6242 View CSV PDB
model_0 -0.6292 View CSV PDB
CABS_average -0.6293 View CSV PDB
model_6 -0.6388 View CSV PDB
model_11 -0.6405 View CSV PDB
model_10 -0.6475 View CSV PDB
model_9 -0.6488 View CSV PDB
model_2 -0.6491 View CSV PDB
input -0.7499 View CSV PDB