Project name: G481C_4D

Status: done

Started: 2026-05-10 08:14:33
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNCGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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]                                                (00:00:11)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:11)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:11)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:11)
[INFO]       FoldX:    Starting FoldX energy minimization                                          (00:00:11)
[INFO]       CABS:     Running CABS flex simulation                                                (00:22:22)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (13:43:33)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (13:44:21)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (13:45:09)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (13:45:56)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (13:46:41)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (13:47:26)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (13:48:12)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (13:48:57)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (13:49:43)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (13:50:30)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (13:51:16)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (13:52:01)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (13:52:46)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (13:54:17)
[INFO]       Main:     Simulation completed successfully.                                          (13:55:01)
Show buried residues

Minimal score value
-4.0356
Maximal score value
5.2992
Average score
-0.5682
Total score value
-1318.8963

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 0.8895
2 G A -0.2453
3 P A -0.8288
4 G A -0.9557
5 A A -0.8735
6 R A -1.9592
7 G A -2.4322
8 R A -3.0996
9 R A -3.7926
10 R A -3.2108
11 R A -2.2234
12 R A -2.3886
13 R A 0.0000
14 P A 0.0182
15 M A 0.4075
16 S A 0.0000
17 P A 0.4549
18 P A 0.0325
19 P A -0.6435
20 P A -0.6798
21 P A -0.4452
22 P A -0.4259
23 P A -0.1083
24 V A 0.8397
25 R A -0.6687
26 A A 0.4212
27 L A 1.7805
28 P A 1.6745
29 L A 3.1946
30 L A 3.7131
31 L A 3.6389
32 L A 3.2769
33 L A 2.0182
34 A A 0.3766
35 G A -0.5577
36 P A -0.5632
37 G A -0.7543
38 A A -1.1943
39 A A -1.2512
40 A A -0.4359
41 P A -0.1767
42 P A -0.4984
43 C A -0.5784
44 L A -1.4962
45 D A -2.6050
46 G A -1.2580
47 S A -1.3207
48 P A -0.9823
49 C A 0.0000
50 A A -1.1207
51 N A -1.9607
52 G A -1.8231
53 G A -1.6122
54 R A -1.2164
55 C A -0.6416
56 T A -1.1141
57 Q A -1.7643
58 L A -1.4753
59 P A -1.4285
60 S A -2.0889
61 R A -3.3199
62 E A -3.1002
63 A A 0.0000
64 A A -0.8650
65 C A 0.0000
66 L A -0.3769
67 C A -0.7127
68 P A 0.0000
69 P A -0.9076
70 G A -1.5736
71 W A -1.5352
72 V A 0.0000
73 G A -0.4089
74 E A -0.4154
75 R A -0.7296
76 C A 0.0000
77 Q A -1.1111
78 L A -1.3662
79 E A -2.6603
80 D A -2.6988
81 P A -1.7413
82 C A -0.9850
83 H A -1.2025
84 S A -0.6243
85 G A -0.7074
86 P A -0.7021
87 C A -0.5857
88 A A -0.7986
89 G A -1.5424
90 R A -2.1492
91 G A -1.0500
92 V A 0.6721
93 C A -0.5229
94 Q A -1.0672
95 S A -1.1138
96 S A -0.2776
97 V A 0.0000
98 V A 0.5618
99 A A 0.1229
100 G A -0.6788
101 T A -0.7158
102 A A -1.3893
103 R A -2.1394
104 F A -1.7614
105 S A -1.6345
106 C A 0.0000
107 R A -2.4380
108 C A -1.7048
109 P A -1.8707
110 R A -2.7599
111 G A -1.4645
112 F A -1.3001
113 R A -2.6360
114 G A -2.2575
115 P A 0.0000
116 D A -2.3549
117 C A -0.5437
118 S A -0.8532
119 L A -0.9825
120 P A -1.0468
121 D A -0.8746
122 P A 0.1951
123 C A 0.0000
124 L A 1.6255
125 S A 0.6075
126 S A 0.4251
127 P A -0.3113
128 C A -0.1688
129 A A -0.7744
130 H A -1.1884
131 G A -1.1099
132 A A -1.2638
133 R A -1.6769
134 C A 0.2239
135 S A 0.4611
136 V A 0.5201
137 G A -0.2391
138 P A -1.2826
139 D A -2.0696
140 G A -1.2766
141 R A -1.0765
142 F A 1.1979
143 L A 0.5201
144 C A -0.1594
145 S A -0.9982
146 C A 0.0000
147 P A 0.0000
148 P A 0.0440
149 G A 0.1873
150 Y A -0.2759
151 Q A -1.5044
152 G A -1.8767
153 R A -2.2853
154 S A -1.2970
155 C A -0.9330
156 R A -1.8374
157 S A -1.1794
158 D A -0.4848
159 V A 1.1537
160 D A 0.3604
161 E A -0.2965
162 C A -0.8292
163 R A -1.6917
164 V A 0.4320
165 G A -0.9210
166 E A -2.3973
167 P A -1.7220
168 C A -1.9157
169 R A -2.7761
170 H A -2.4058
171 G A -1.7136
172 G A -1.3305
173 T A -1.3876
174 C A 0.0000
175 L A 0.0138
176 N A -0.2953
177 T A -0.3638
178 P A -0.0548
179 G A 0.1042
180 S A 0.1217
181 F A 0.5094
182 R A -1.0836
183 C A -0.7024
184 Q A -1.2378
185 C A -0.9547
186 P A -0.2764
187 A A -0.2279
188 G A -0.3960
189 Y A -0.0890
190 T A -0.3604
191 G A -0.1789
192 P A -0.0281
193 L A -0.5772
194 C A 0.0000
195 E A -1.5451
196 N A -1.2064
197 P A -0.2799
198 A A 0.3299
199 V A 0.1503
200 P A -0.3115
201 C A 0.2215
202 A A 0.3211
203 P A 0.1993
204 S A -0.1731
205 P A -0.4408
206 C A -0.1105
207 R A -0.7347
208 N A -1.4871
209 G A -1.2039
210 G A -0.6479
211 T A -0.8603
212 C A -1.0822
213 R A -2.6897
214 Q A -2.3589
215 S A -1.6425
216 G A -1.2075
217 D A -1.4968
218 L A 0.1039
219 T A -0.7820
220 Y A -1.2034
221 D A -2.2114
222 C A -0.9616
223 A A -0.6932
224 C A -0.2011
225 L A -0.0005
226 P A -0.0516
227 G A 0.5064
228 F A 1.6991
229 E A 0.0110
230 G A -0.7620
231 Q A -1.4358
232 N A -1.6815
233 C A -0.3385
234 E A 0.1755
235 V A 1.2442
236 N A 0.5626
237 V A 0.6933
238 D A -1.6490
239 D A -2.1518
240 C A 0.0000
241 P A -0.7991
242 G A -0.9159
243 H A -1.6643
244 R A -2.0931
245 C A -0.8732
246 L A 0.2024
247 N A -0.6595
248 G A -0.9726
249 G A -1.1313
250 T A -0.7738
251 C A -0.3447
252 V A 0.2643
253 D A 0.3174
254 G A 0.4754
255 V A 0.9732
256 N A 0.0749
257 T A 0.5063
258 Y A 0.0000
259 N A -0.4399
260 C A 0.0000
261 Q A -0.9431
262 C A 0.0000
263 P A -0.1337
264 P A 0.0000
265 E A -1.2061
266 W A -0.3074
267 T A -0.6976
268 G A -0.8190
269 Q A -0.6113
270 F A 0.4398
271 C A 0.0000
272 T A -0.8721
273 E A -1.2082
274 D A -1.4393
275 V A -0.6484
276 D A -1.5698
277 E A -1.0332
278 C A -0.1589
279 Q A -0.9304
280 L A -0.2398
281 Q A -1.0454
282 P A -1.2637
283 N A -0.9142
284 A A -1.0543
285 C A 0.0000
286 H A -1.2045
287 N A -1.1245
288 G A -0.8153
289 G A -0.4748
290 T A 0.3208
291 C A 0.6588
292 F A 1.3284
293 N A -0.0084
294 T A 0.1979
295 L A 0.5685
296 G A -0.5784
297 G A -0.2330
298 H A -0.1124
299 S A 0.0712
300 C A 0.2042
301 V A -0.0417
302 C A 0.0000
303 V A 0.4194
304 N A 0.0000
305 G A -0.0068
306 W A -0.0098
307 T A -0.6528
308 G A -1.5501
309 E A -2.3568
310 S A -1.5537
311 C A 0.0000
312 S A 0.0000
313 Q A -2.0629
314 N A -1.1923
315 I A 0.0468
316 D A -1.8786
317 D A 0.0000
318 C A -1.2742
319 A A -0.3246
320 T A -0.4465
321 A A 0.0000
322 V A 0.7791
323 C A 0.0000
324 F A 1.3695
325 H A -0.1646
326 G A -0.4004
327 A A 0.0602
328 T A 0.0444
329 C A -0.3758
330 H A -1.8495
331 D A -3.1817
332 R A -3.0194
333 V A -1.7282
334 A A 0.0000
335 S A 0.0000
336 F A 0.0000
337 Y A -0.0661
338 C A 0.0000
339 A A 0.0830
340 C A 0.2932
341 P A 0.1418
342 M A 0.9444
343 G A 0.2207
344 K A 0.0000
345 T A 0.0000
346 G A -0.0306
347 L A 0.0275
348 L A 0.2759
349 C A 0.0000
350 H A 0.0000
351 L A 0.0000
352 D A 0.0000
353 D A 0.0000
354 A A 0.0000
355 C A 0.0000
356 V A 0.0000
357 S A -1.5981
358 N A -1.7600
359 P A -0.9008
360 C A -0.4549
361 H A -1.1142
362 E A -1.5772
363 D A -1.0981
364 A A 0.0000
365 I A 0.9784
366 C A 0.0000
367 D A -0.2311
368 T A 0.0000
369 N A 0.0000
370 P A 0.0000
371 V A -0.2578
372 N A -0.6203
373 G A -0.4376
374 R A -0.4283
375 A A 0.0000
376 I A 0.1296
377 C A 0.0000
378 T A 0.3589
379 C A 0.1913
380 P A -0.0829
381 P A -0.5610
382 G A -0.8401
383 F A -0.1070
384 T A -0.2301
385 G A 0.0000
386 G A 0.0000
387 A A -0.5984
388 C A -0.3907
389 D A -1.1521
390 Q A -1.3461
391 D A -0.9441
392 V A -0.1804
393 D A -2.0378
394 E A -2.1135
395 C A -0.4942
396 S A 0.0069
397 I A 1.3486
398 G A 0.4132
399 A A 0.0390
400 N A -0.7474
401 P A -1.5404
402 C A 0.0000
403 E A -1.6518
404 H A 0.0000
405 L A -1.0164
406 G A -1.2017
407 R A -1.2826
408 C A -0.2891
409 V A -0.0074
410 N A -0.4495
411 T A -0.6401
412 Q A -1.1596
413 G A -1.1124
414 S A -0.2105
415 F A -0.0054
416 L A 0.0853
417 C A 0.0000
418 Q A -1.1487
419 C A -1.3214
420 G A -1.3802
421 R A -1.9821
422 G A -1.8050
423 Y A -0.7379
424 T A -1.0741
425 G A -1.5908
426 P A -1.6760
427 R A -2.8138
428 C A -1.7136
429 E A -2.7411
430 T A 0.0000
431 D A -1.4647
432 V A 0.0000
433 N A -1.0179
434 E A 0.0000
435 C A -0.2107
436 L A -0.1946
437 S A 0.0000
438 G A 0.0000
439 P A -0.1183
440 C A 0.0000
441 R A 0.0000
442 N A -1.7791
443 Q A -1.4572
444 A A -0.1161
445 T A 0.2156
446 C A 0.4138
447 L A 0.1213
448 D A -1.5928
449 R A -1.1114
450 I A 0.0899
451 G A 0.0000
452 Q A -0.7428
453 F A 0.0000
454 T A 0.0000
455 C A 0.0000
456 I A 1.8593
457 C A 0.8256
458 M A 0.0249
459 A A 0.1131
460 G A -0.4484
461 F A 0.0000
462 T A 0.0000
463 G A 0.0000
464 T A 0.1131
465 Y A 0.0000
466 C A 0.0000
467 E A 0.0000
468 V A 0.0000
469 D A -2.0958
470 I A -1.8659
471 D A -2.8260
472 E A -1.7691
473 C A -0.7600
474 Q A -1.1236
475 S A -0.6184
476 S A -0.3932
477 P A -0.0794
478 C A 0.4253
479 V A 0.2087
480 N A -1.1259
481 C A 0.1601
482 G A 0.4230
483 V A 1.3165
484 C A 0.3985
485 K A -1.0528
486 D A -1.9308
487 R A -2.6981
488 V A -2.0416
489 N A -1.9163
490 G A -1.0305
491 F A -0.2969
492 S A -0.1214
493 C A 0.4613
494 T A 0.3969
495 C A 0.0000
496 P A 0.0397
497 S A -0.0540
498 G A 0.1147
499 F A 1.3569
500 S A 0.5381
501 G A -0.0264
502 S A -0.0982
503 T A -0.0448
504 C A 0.1064
505 Q A -0.0980
506 L A 0.2133
507 D A 0.0000
508 V A -1.3432
509 D A -2.6909
510 E A -2.7492
511 C A -1.2032
512 A A -0.9116
513 S A -0.9566
514 T A -0.6270
515 P A -0.2833
516 C A -1.4358
517 R A -2.3201
518 N A -2.4578
519 G A -2.3419
520 A A 0.0000
521 K A -2.6432
522 C A -1.3822
523 V A -0.2191
524 D A -1.7523
525 Q A -2.1322
526 P A -1.5311
527 D A -2.1088
528 G A -1.5842
529 Y A -1.0568
530 E A -1.7339
531 C A -1.2975
532 R A -2.4415
533 C A -2.4833
534 A A -1.8541
535 E A -3.1195
536 G A -2.4063
537 F A -2.5592
538 E A -2.2492
539 G A -1.3278
540 T A -0.2113
541 L A 0.9374
542 C A 0.0000
543 D A -1.8098
544 R A -2.5287
545 N A -2.8782
546 V A -2.3224
547 D A -2.5959
548 D A -2.1239
549 C A -1.2272
550 S A -0.9988
551 P A -1.0983
552 D A -1.9875
553 P A -1.1110
554 C A -0.9755
555 H A -1.3473
556 H A -1.2582
557 G A -1.3612
558 R A -1.3317
559 C A -0.4542
560 V A 0.4109
561 D A -1.4221
562 G A -0.8506
563 I A -0.5156
564 A A -0.3647
565 S A -0.0517
566 F A -0.0361
567 S A 0.0930
568 C A -0.3245
569 A A -0.2243
570 C A -0.6530
571 A A -0.1484
572 P A -0.1323
573 G A 0.0188
574 Y A 0.4329
575 T A 0.0000
576 G A -0.8530
577 T A -1.1385
578 R A -1.7404
579 C A -0.6102
580 E A -0.5230
581 S A -0.2375
582 Q A -0.3304
583 V A 0.1413
584 D A -1.5810
585 E A -2.1495
586 C A 0.0000
587 R A -2.6054
588 S A -1.9687
589 Q A -1.6059
590 P A -0.9967
591 C A -1.6688
592 R A -2.8577
593 H A -3.2229
594 G A -2.1270
595 G A -2.2456
596 K A -2.7451
597 C A -1.4405
598 L A -0.1933
599 D A -0.5972
600 L A 0.7584
601 V A 0.8093
602 D A -1.0069
603 K A -0.2105
604 Y A 0.6697
605 L A 0.5514
606 C A -0.9205
607 R A -2.3076
608 C A 0.0000
609 P A -1.8743
610 S A -0.9708
611 G A -0.4844
612 T A 0.0000
613 T A -0.8595
614 G A 0.0223
615 V A 1.1489
616 N A -0.1987
617 C A -0.4067
618 E A -0.5171
619 V A 0.7461
620 N A -0.4025
621 I A -0.0827
622 D A -0.9023
623 D A -1.6878
624 C A -0.6729
625 A A -0.3761
626 S A -0.4268
627 N A -0.3052
628 P A 0.5063
629 C A 0.9041
630 T A 1.4197
631 F A 2.4369
632 G A 2.0826
633 V A 2.0447
634 C A 0.6353
635 R A -1.1730
636 D A -1.4353
637 G A -0.9796
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1982 E A -2.6360
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1987 A A 0.0000
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1991 L A 0.0000
1992 L A 0.0000
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1994 H A -1.8754
1995 F A -1.1982
1996 A A -1.3467
1997 N A -1.5007
1998 R A 0.0000
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2010 D A -2.4616
2011 V A 0.0000
2012 A A 0.0000
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2014 E A -3.3519
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2255 W A -0.1507
2256 A A -0.5018
2257 S A -0.3862
2258 P A -0.3100
2259 S A 0.0000
2260 P A 0.0000
2261 P A -0.1006
2262 S A 0.2368
2263 L A 0.5073
2264 S A -0.4867
2265 D A -1.4108
2266 W A -0.7743
2267 S A -1.0218
2268 E A -1.1414
2269 S A -0.8235
2270 T A -0.7757
2271 P A -0.5754
2272 S A -0.5275
2273 P A -0.2167
2274 A A 0.0479
2275 T A -0.3300
2276 A A -0.0660
2277 T A -0.2919
2278 G A -0.3745
2279 A A 0.1071
2280 M A 0.4098
2281 A A -0.1058
2282 T A -0.4424
2283 T A -0.5823
2284 T A -1.1987
2285 G A -0.9209
2286 A A -0.3730
2287 L A 0.3179
2288 P A -0.3160
2289 A A -0.3610
2290 Q A -0.9364
2291 P A -0.5777
2292 L A 0.0000
2293 P A -0.3359
2294 L A 0.0000
2295 S A -0.5271
2296 V A 0.0000
2297 P A -0.3570
2298 S A -0.2330
2299 S A -0.3104
2300 L A -0.0991
2301 A A -0.1265
2302 Q A -0.5659
2303 A A -0.5591
2304 Q A -0.8864
2305 T A -0.5809
2306 Q A -0.5869
2307 L A 0.5563
2308 G A -0.4559
2309 P A -0.9816
2310 Q A -1.7227
2311 P A -1.4506
2312 E A -1.4983
2313 V A -0.1632
2314 T A 0.0000
2315 P A -0.8802
2316 K A -1.4920
2317 R A -2.0767
2318 Q A -0.8048
2319 V A 1.5551
2320 L A 1.9953
2321 A A 1.0884
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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, -0.5682 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 -0.5682 View CSV PDB
model_10 -0.5714 View CSV PDB
model_1 -0.5727 View CSV PDB
model_7 -0.5743 View CSV PDB
model_8 -0.5758 View CSV PDB
model_3 -0.5772 View CSV PDB
model_4 -0.5778 View CSV PDB
CABS_average -0.585 View CSV PDB
model_0 -0.5864 View CSV PDB
model_6 -0.5872 View CSV PDB
model_2 -0.5885 View CSV PDB
model_11 -0.6147 View CSV PDB
model_5 -0.6257 View CSV PDB
input -0.7545 View CSV PDB