Project name: T465C_4D

Status: done

Started: 2026-05-14 00:54:03
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTCCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:19:19)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (11:26:15)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (11:26:54)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (11:27:32)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (11:28:11)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (11:28:49)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (11:29:28)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (11:30:06)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (11:30:44)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (11:31:23)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (11:32:01)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (11:32:39)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (11:33:18)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (11:33:56)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (11:35:10)
[INFO]       Main:     Simulation completed successfully.                                          (11:35:48)
Show buried residues

Minimal score value
-3.8861
Maximal score value
5.1978
Average score
-0.5566
Total score value
-1291.8428

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 0.8621
2 G A -0.2129
3 P A -0.6794
4 G A -1.0603
5 A A 0.0000
6 R A -2.4616
7 G A 0.0000
8 R A -3.8861
9 R A -3.8647
10 R A -3.1946
11 R A -3.4528
12 R A 0.0000
13 R A -1.4237
14 P A -1.0373
15 M A -0.0742
16 S A -0.4646
17 P A -0.4218
18 P A -0.6933
19 P A -0.4973
20 P A -0.3723
21 P A 0.0337
22 P A 0.0000
23 P A 0.0461
24 V A 0.4916
25 R A -0.4021
26 A A 1.0072
27 L A 2.2541
28 P A 2.0738
29 L A 3.0905
30 L A 2.8723
31 L A 1.4360
32 L A 1.4003
33 L A 0.6856
34 A A 0.2589
35 G A -0.3974
36 P A -0.5175
37 G A -0.4645
38 A A -0.0882
39 A A -0.1999
40 A A -0.4377
41 P A -0.7817
42 P A -0.2701
43 C A 0.0000
44 L A 0.0000
45 D A -1.0450
46 G A -0.6817
47 S A -0.2706
48 P A 0.7086
49 C A 0.0000
50 A A 0.0000
51 N A 0.0000
52 G A 0.0000
53 G A -0.8477
54 R A -1.0282
55 C A 0.0000
56 T A -0.2350
57 Q A 0.0000
58 L A -0.7022
59 P A -1.0749
60 S A -1.4851
61 R A -2.2755
62 E A -2.2020
63 A A 0.0000
64 A A -0.9188
65 C A 0.0000
66 L A -0.4499
67 C A -0.4379
68 P A 0.1708
69 P A -0.0302
70 G A -0.0856
71 W A 0.0000
72 V A 0.0000
73 G A -1.2432
74 E A -2.1312
75 R A -1.5446
76 C A 0.0000
77 Q A 0.0413
78 L A 0.0000
79 E A 0.0000
80 D A 0.0000
81 P A 0.0000
82 C A 0.3203
83 H A -0.1929
84 S A -0.3559
85 G A -0.6781
86 P A -1.2747
87 C A -1.0328
88 A A -0.9389
89 G A -1.4796
90 R A -2.3277
91 G A -1.3636
92 V A 0.2204
93 C A 0.2918
94 Q A -0.1833
95 S A -0.1062
96 S A 0.3253
97 V A 0.9350
98 V A 1.3945
99 A A 1.1174
100 G A 0.0000
101 T A 0.0000
102 A A 0.0000
103 R A 0.0000
104 F A 0.0000
105 S A 0.0000
106 C A 0.0000
107 R A -0.9316
108 C A 0.0000
109 P A -1.4356
110 R A -2.2047
111 G A -0.8513
112 F A 0.3268
113 R A -0.3514
114 G A 0.0000
115 P A 0.0000
116 D A -1.7033
117 C A -0.1242
118 S A 0.0000
119 L A 0.9097
120 P A 0.2160
121 D A -1.1729
122 P A -0.5335
123 C A 0.0000
124 L A 1.2081
125 S A -0.1496
126 S A -0.5085
127 P A -0.3305
128 C A -0.1725
129 A A -0.4339
130 H A -1.5948
131 G A -1.5532
132 A A 0.0000
133 R A -2.4139
134 C A 0.0000
135 S A -0.6680
136 V A -0.3001
137 G A -0.6602
138 P A -1.2364
139 D A -2.1532
140 G A -1.6822
141 R A -0.9774
142 F A -0.2169
143 L A -0.4743
144 C A 0.0000
145 S A -0.9535
146 C A 0.0000
147 P A -0.5982
148 P A -0.3650
149 G A -0.2411
150 Y A 0.2064
151 Q A 0.0000
152 G A -1.3695
153 R A -2.0645
154 S A -1.3516
155 C A 0.0000
156 R A -2.3462
157 S A 0.0000
158 D A -2.2775
159 V A -1.8337
160 D A -2.5081
161 E A -2.8381
162 C A 0.0000
163 R A -1.8083
164 V A -0.1228
165 G A -0.9950
166 E A -2.2469
167 P A -1.8319
168 C A -1.9646
169 R A -2.8860
170 H A -2.4927
171 G A -1.7266
172 G A -1.3276
173 T A -1.2988
174 C A -1.1220
175 L A -0.2903
176 N A -1.6711
177 T A -0.8497
178 P A -1.1743
179 G A -2.1184
180 S A -1.5543
181 F A -1.3633
182 R A -1.9667
183 C A -1.3675
184 Q A -1.8495
185 C A -1.7133
186 P A -1.1585
187 A A -0.7503
188 G A -0.4763
189 Y A -0.4410
190 T A -0.5639
191 G A -0.6716
192 P A -0.5992
193 L A -0.9897
194 C A 0.0000
195 E A -1.7811
196 N A -1.6105
197 P A -1.0272
198 A A -0.7142
199 V A -0.5600
200 P A -0.8094
201 C A -0.7892
202 A A 0.0000
203 P A -0.2046
204 S A -0.3286
205 P A -0.5581
206 C A 0.0000
207 R A -2.4580
208 N A -2.5679
209 G A -1.7596
210 G A 0.0000
211 T A -1.3813
212 C A 0.0000
213 R A -1.8714
214 Q A -1.2754
215 S A -1.1859
216 G A -1.3380
217 D A -1.5867
218 L A -0.4651
219 T A -0.3752
220 Y A -0.2259
221 D A -0.9081
222 C A -0.3453
223 A A -0.3940
224 C A -0.7153
225 L A -0.4781
226 P A -0.7248
227 G A -0.6254
228 F A -0.5028
229 E A -1.5583
230 G A -1.6774
231 Q A -1.7159
232 N A -1.4927
233 C A 0.0000
234 E A 0.0000
235 V A 0.0308
236 N A -0.4117
237 V A -0.0604
238 D A -1.4651
239 D A -1.3599
240 C A -0.3884
241 P A -0.8902
242 G A -1.0344
243 H A -0.9396
244 R A -1.7630
245 C A 0.0000
246 L A -0.4892
247 N A -1.0376
248 G A -1.0189
249 G A -0.9087
250 T A 0.0000
251 C A 0.0000
252 V A -0.6810
253 D A -1.2694
254 G A 0.0000
255 V A 0.0000
256 N A -1.8152
257 T A -1.0925
258 Y A -0.2384
259 N A -1.0468
260 C A -0.2069
261 Q A -1.2314
262 C A -0.9744
263 P A -1.0853
264 P A -1.4648
265 E A -2.1945
266 W A 0.0000
267 T A -0.7639
268 G A -0.8426
269 Q A -0.7325
270 F A 0.7166
271 C A -0.2369
272 T A -0.4984
273 E A -0.7397
274 D A 0.0000
275 V A -0.6313
276 D A -1.4218
277 E A -0.8629
278 C A -0.8557
279 Q A -1.6954
280 L A -1.2215
281 Q A 0.0000
282 P A -1.1414
283 N A -0.8597
284 A A -0.5190
285 C A 0.0000
286 H A -0.7228
287 N A -1.0125
288 G A -1.2982
289 G A -1.2387
290 T A 0.0000
291 C A -0.1087
292 F A -0.2501
293 N A -0.4615
294 T A 0.0000
295 L A -0.3399
296 G A 0.0000
297 G A -0.2040
298 H A -0.2447
299 S A -0.4117
300 C A -0.1020
301 V A -0.2793
302 C A 0.0000
303 V A 0.0000
304 N A 0.0000
305 G A 0.0000
306 W A -0.3480
307 T A 0.0000
308 G A 0.0000
309 E A -0.7164
310 S A -0.5953
311 C A 0.0000
312 S A -0.7063
313 Q A -1.0421
314 N A -0.9433
315 I A -0.3608
316 D A 0.0000
317 D A -0.3441
318 C A 0.0000
319 A A 0.5457
320 T A 0.4455
321 A A 0.0000
322 V A 1.8885
323 C A 1.1141
324 F A 0.7030
325 H A -0.7471
326 G A -0.7868
327 A A -0.2405
328 T A -0.1923
329 C A 0.0106
330 H A -0.2934
331 D A -0.9417
332 R A -1.2048
333 V A -0.5360
334 A A -0.2809
335 S A -0.3192
336 F A 0.1634
337 Y A 0.5542
338 C A 0.0000
339 A A 0.3602
340 C A 0.2175
341 P A 0.0856
342 M A 0.5370
343 G A -0.0408
344 K A -0.1925
345 T A 0.1432
346 G A 0.3621
347 L A 0.7721
348 L A 1.0884
349 C A 1.0866
350 H A 0.4492
351 L A 0.5641
352 D A 0.0000
353 D A -1.1979
354 A A -0.5782
355 C A 0.0000
356 V A 0.6537
357 S A -0.3314
358 N A -0.6844
359 P A -0.6345
360 C A 0.0000
361 H A -2.5871
362 E A -3.1610
363 D A -2.7441
364 A A -1.6556
365 I A -0.3323
366 C A 0.0218
367 D A -0.7188
368 T A -0.1617
369 N A 0.0000
370 P A 0.2035
371 V A 0.0901
372 N A -0.0388
373 G A -0.3696
374 R A 0.0000
375 A A 0.0000
376 I A 0.0000
377 C A 0.0000
378 T A 0.0000
379 C A 0.0000
380 P A -0.7674
381 P A 0.0000
382 G A 0.0000
383 F A -0.7090
384 T A -0.5117
385 G A -0.8608
386 G A -0.9116
387 A A -0.7442
388 C A 0.0000
389 D A -1.8917
390 Q A 0.0000
391 D A 0.0000
392 V A -0.6279
393 D A 0.0000
394 E A -0.3383
395 C A 0.0000
396 S A 0.0585
397 I A 0.0904
398 G A -0.5056
399 A A -0.7542
400 N A -0.6565
401 P A -0.6718
402 C A -0.5900
403 E A -0.9381
404 H A -0.4914
405 L A 0.6136
406 G A -0.2238
407 R A -0.7495
408 C A -0.4393
409 V A 0.0000
410 N A -0.6682
411 T A 0.0000
412 Q A -1.0723
413 G A -1.0342
414 S A -0.7765
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 -0.3925
421 R A -0.8589
422 G A -0.4187
423 Y A -0.5704
424 T A 0.0000
425 G A 0.0000
426 P A -0.9336
427 R A -0.8605
428 C A 0.0000
429 E A -1.1130
430 T A 0.0000
431 D A -1.2068
432 V A -0.2476
433 N A -0.7943
434 E A -0.8774
435 C A 0.3118
436 L A 1.7314
437 S A 0.5265
438 G A -0.3872
439 P A -0.9346
440 C A -0.5930
441 R A -1.0850
442 N A -1.7803
443 Q A -1.4258
444 A A 0.1610
445 T A 0.8985
446 C A 1.1969
447 L A 0.7671
448 D A -0.7814
449 R A -1.3844
450 I A 0.4474
451 G A -0.6951
452 Q A -1.0903
453 F A 0.6152
454 T A 0.9464
455 C A 0.0000
456 I A 2.4587
457 C A 0.0000
458 M A 1.2090
459 A A -0.0581
460 G A -0.2864
461 F A 0.3917
462 T A 0.1651
463 G A -0.4419
464 T A -0.3287
465 C A 0.3093
466 C A -0.1279
467 E A -1.8949
468 V A -1.1657
469 D A -1.4829
470 I A -0.9172
471 D A -1.1479
472 E A -1.9379
473 C A 0.0000
474 Q A -1.7087
475 S A -1.3901
476 S A -0.7237
477 P A -0.2219
478 C A 0.6331
479 V A 1.4747
480 N A 0.3869
481 G A -0.3950
482 G A -0.5774
483 V A 0.0000
484 C A -1.1639
485 K A -2.8634
486 D A -3.2196
487 R A -2.3655
488 V A 0.1891
489 N A -1.1253
490 G A -1.3143
491 F A -1.6513
492 S A -1.0892
493 C A -0.3913
494 T A 0.2229
495 C A 0.8099
496 P A -0.0123
497 S A -0.4763
498 G A -0.6934
499 F A 0.0926
500 S A -0.4187
501 G A -0.5058
502 S A -0.2896
503 T A -0.1478
504 C A 0.2727
505 Q A -0.4759
506 L A -0.1650
507 D A -1.6694
508 V A -0.9634
509 D A -2.4044
510 E A -2.3922
511 C A 0.0000
512 A A -0.9022
513 S A -0.9197
514 T A -1.2005
515 P A -1.5311
516 C A -1.9907
517 R A -3.3843
518 N A -2.9095
519 G A -2.0126
520 A A -2.1796
521 K A -3.0228
522 C A 0.0000
523 V A -0.9862
524 D A -1.5859
525 Q A -1.8282
526 P A -1.7314
527 D A -2.8292
528 G A -1.9083
529 Y A -1.4347
530 E A -2.3131
531 C A -1.7238
532 R A -2.8435
533 C A -2.3818
534 A A -2.2512
535 E A -2.3468
536 G A -1.4430
537 F A -1.3497
538 E A -2.2920
539 G A -1.2741
540 T A -0.4729
541 L A 0.2198
542 C A 0.0000
543 D A -1.6617
544 R A -2.7089
545 N A -2.5673
546 V A -1.9998
547 D A -2.6095
548 D A -2.2568
549 C A -0.8068
550 S A -0.5861
551 P A -1.0681
552 D A -1.2802
553 P A -1.0273
554 C A -1.2380
555 H A -1.5921
556 H A -2.0220
557 G A -1.7736
558 R A -2.0507
559 C A -0.9799
560 V A -0.4470
561 D A -1.2173
562 G A -0.1522
563 I A 0.6648
564 A A 0.3614
565 S A -0.1074
566 F A -0.0732
567 S A -0.6782
568 C A 0.0000
569 A A -1.1466
570 C A 0.0000
571 A A -0.4088
572 P A -0.2769
573 G A 0.4095
574 Y A 0.3409
575 T A -0.6752
576 G A -1.1359
577 T A -1.5524
578 R A -1.8512
579 C A -1.2681
580 E A -2.1536
581 S A -1.1187
582 Q A -0.6208
583 V A 0.4450
584 D A -1.0135
585 E A -1.7516
586 C A -1.7701
587 R A -2.4767
588 S A -1.8109
589 Q A -2.3406
590 P A -1.3032
591 C A -1.5204
592 R A -1.8113
593 H A -2.5123
594 G A -1.8895
595 G A -2.2956
596 K A -2.5618
597 C A -1.1662
598 L A 0.3160
599 D A -0.3528
600 L A 1.5346
601 V A 1.5653
602 D A -0.2377
603 K A -0.7956
604 Y A 0.0000
605 L A 1.1069
606 C A -0.7762
607 R A -2.3590
608 C A 0.0000
609 P A -1.3894
610 S A -0.6338
611 G A -0.1235
612 T A 0.2223
613 T A 0.5542
614 G A 0.5275
615 V A 1.2557
616 N A -0.5395
617 C A -0.2260
618 E A 0.3251
619 V A 2.1103
620 N A 0.0000
621 I A 1.4104
622 D A -1.0325
623 D A -2.2009
624 C A 0.0000
625 A A -1.1568
626 S A -1.1566
627 N A -1.4225
628 P A -0.4137
629 C A 0.0000
630 T A 1.0163
631 F A 2.3623
632 G A 1.8416
633 V A 1.1668
634 C A -0.3528
635 R A -2.9048
636 D A -3.2236
637 G A -1.9181
638 I A 0.1078
639 N A -1.7468
640 R A -2.9099
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2260 P A 0.0000
2261 P A -0.3945
2262 S A -0.4183
2263 L A 0.0000
2264 S A 0.0000
2265 D A 0.0000
2266 W A 0.0000
2267 S A -0.5222
2268 E A -0.8310
2269 S A -0.9312
2270 T A -1.1269
2271 P A -1.0019
2272 S A -0.4765
2273 P A -0.3963
2274 A A 0.0000
2275 T A 0.0000
2276 A A 0.2237
2277 T A 0.1673
2278 G A 0.2637
2279 A A 0.0000
2280 M A 0.0000
2281 A A 0.5818
2282 T A 0.0000
2283 T A -0.0683
2284 T A 0.1156
2285 G A -0.2566
2286 A A 0.4400
2287 L A 1.1045
2288 P A 0.1479
2289 A A -0.1686
2290 Q A -1.0043
2291 P A -0.6950
2292 L A 0.0090
2293 P A -0.1463
2294 L A -0.1213
2295 S A 0.0000
2296 V A 0.0000
2297 P A 0.1101
2298 S A 0.4016
2299 S A 0.2403
2300 L A 0.2179
2301 A A -0.3520
2302 Q A -0.6033
2303 A A -0.4252
2304 Q A -0.6903
2305 T A -0.4438
2306 Q A -0.0641
2307 L A 0.4326
2308 G A -0.2248
2309 P A -0.8394
2310 Q A -1.2814
2311 P A -1.2554
2312 E A -2.1301
2313 V A -1.2181
2314 T A -1.3259
2315 P A -1.2654
2316 K A -1.8576
2317 R A -2.4388
2318 Q A -1.1681
2319 V A -0.4015
2320 L A -0.2311
2321 A A -0.1839
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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, -0.5566 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 -0.5566 View CSV PDB
model_3 -0.565 View CSV PDB
model_5 -0.5651 View CSV PDB
model_4 -0.5671 View CSV PDB
model_6 -0.5765 View CSV PDB
CABS_average -0.5955 View CSV PDB
model_1 -0.6025 View CSV PDB
model_0 -0.6086 View CSV PDB
model_7 -0.6106 View CSV PDB
model_2 -0.6116 View CSV PDB
model_8 -0.6122 View CSV PDB
model_10 -0.623 View CSV PDB
model_11 -0.6468 View CSV PDB
input -0.7544 View CSV PDB