Project name: C484R

Status: done

Started: 2026-05-06 07:03:58
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVRKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:25:59)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (10:24:52)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (10:25:31)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (10:26:10)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (10:26:49)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (10:27:29)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (10:28:07)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (10:28:46)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (10:29:25)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (10:30:04)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (10:30:43)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (10:31:21)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (10:32:00)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (10:32:39)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (10:33:55)
[INFO]       Main:     Simulation completed successfully.                                          (10:34:32)
Show buried residues

Minimal score value
-4.6268
Maximal score value
5.2638
Average score
-0.5714
Total score value
-1326.2946

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 0.5691
2 G A 0.0145
3 P A -1.1876
4 G A -0.8853
5 A A -1.1865
6 R A -2.4155
7 G A -2.6980
8 R A -4.3124
9 R A -4.6268
10 R A -3.8185
11 R A -3.4467
12 R A -2.1678
13 R A -1.0811
14 P A -0.4613
15 M A 0.2891
16 S A -0.4372
17 P A -0.3488
18 P A 0.0000
19 P A -0.2509
20 P A -0.1740
21 P A -0.5526
22 P A -0.6807
23 P A 0.0000
24 V A 0.0000
25 R A 0.0000
26 A A 0.0000
27 L A 0.0000
28 P A -0.1429
29 L A 0.0000
30 L A 0.0128
31 L A 0.6303
32 L A 1.2516
33 L A 0.0000
34 A A -0.7273
35 G A 0.0000
36 P A -0.7509
37 G A -0.8860
38 A A -0.4220
39 A A -0.8192
40 A A -1.1710
41 P A -0.3914
42 P A -0.4033
43 C A 0.1631
44 L A 0.5966
45 D A -0.8618
46 G A 0.0000
47 S A -0.5289
48 P A -0.0993
49 C A 0.5786
50 A A 0.2660
51 N A 0.0000
52 G A -0.0549
53 G A 0.0000
54 R A -0.6692
55 C A -0.4876
56 T A -0.7237
57 Q A -2.0394
58 L A -1.4540
59 P A -2.4539
60 S A -2.4243
61 R A -2.9523
62 E A -2.9112
63 A A 0.0000
64 A A 0.0000
65 C A 0.0000
66 L A 0.0000
67 C A 0.1665
68 P A 0.0000
69 P A -0.1719
70 G A -0.4139
71 W A -0.0528
72 V A 0.0000
73 G A 0.0000
74 E A 0.0000
75 R A -1.0673
76 C A -0.4446
77 Q A -0.6793
78 L A -0.8950
79 E A -1.7460
80 D A 0.0000
81 P A -0.7382
82 C A 0.0000
83 H A -1.3507
84 S A -1.0519
85 G A -0.6160
86 P A -1.0249
87 C A 0.0000
88 A A -1.5156
89 G A -1.6503
90 R A -2.3189
91 G A -1.8090
92 V A 0.0000
93 C A 0.0000
94 Q A 0.0000
95 S A 0.0000
96 S A 0.0000
97 V A 0.0000
98 V A 0.7649
99 A A 0.1739
100 G A -0.6825
101 T A -0.4742
102 A A -0.3317
103 R A -0.4142
104 F A 0.3584
105 S A 0.0000
106 C A -0.2278
107 R A 0.0000
108 C A 0.1631
109 P A 0.0927
110 R A -0.1554
111 G A 0.1921
112 F A 1.4311
113 R A 0.0000
114 G A -0.0964
115 P A -0.5900
116 D A -1.7419
117 C A -0.5169
118 S A -0.0367
119 L A 0.4408
120 P A 0.5094
121 D A 0.0115
122 P A 0.0000
123 C A 0.0000
124 L A 0.6811
125 S A -0.1506
126 S A -0.6826
127 P A -0.7445
128 C A -0.9686
129 A A -1.1497
130 H A -1.7353
131 G A -1.2920
132 A A -1.5553
133 R A -2.1533
134 C A 0.0000
135 S A -0.5078
136 V A 0.0000
137 G A -0.8829
138 P A -1.5437
139 D A -2.3880
140 G A -1.8393
141 R A -1.9961
142 F A -1.1577
143 L A -0.4684
144 C A -0.9500
145 S A -1.1799
146 C A 0.0000
147 P A -1.1455
148 P A -0.7897
149 G A -1.1199
150 Y A -1.8563
151 Q A 0.0000
152 G A -1.4298
153 R A -2.4695
154 S A -1.8478
155 C A 0.0000
156 R A -2.1295
157 S A -2.2897
158 D A -2.7579
159 V A -1.6076
160 D A -2.3270
161 E A -1.6687
162 C A -1.2304
163 R A -1.8587
164 V A -0.4923
165 G A -1.3968
166 E A -2.2570
167 P A -1.6215
168 C A -1.3266
169 R A -2.6075
170 H A -1.8312
171 G A -1.0686
172 G A -1.0583
173 T A 0.0000
174 C A -0.9956
175 L A -0.1326
176 N A -1.1868
177 T A -0.8501
178 P A -1.0289
179 G A -1.2678
180 S A -0.7035
181 F A -0.3540
182 R A -1.5006
183 C A -0.9618
184 Q A -0.9247
185 C A -0.5787
186 P A -0.1954
187 A A 0.0696
188 G A -0.3468
189 Y A -0.3054
190 T A -0.6728
191 G A -0.1504
192 P A 0.3938
193 L A 1.2402
194 C A 0.5467
195 E A -1.4044
196 N A -1.4855
197 P A -0.5311
198 A A 0.1531
199 V A 0.7528
200 P A 0.5205
201 C A 0.2768
202 A A 0.5214
203 P A -0.2389
204 S A -0.7402
205 P A -1.2881
206 C A 0.0000
207 R A -2.3892
208 N A -2.4009
209 G A -1.6048
210 G A -1.2262
211 T A -1.1319
212 C A -1.6996
213 R A -3.1086
214 Q A -2.5956
215 S A -1.6883
216 G A -1.4433
217 D A -1.7078
218 L A 0.3859
219 T A -0.7364
220 Y A -1.5538
221 D A -2.5666
222 C A -1.3305
223 A A -0.5094
224 C A -0.3117
225 L A 0.3288
226 P A -0.3832
227 G A -1.2350
228 F A -0.8991
229 E A -2.2843
230 G A -2.2952
231 Q A -2.2985
232 N A -1.5350
233 C A -0.5987
234 E A -1.6303
235 V A 0.0000
236 N A 0.0000
237 V A 0.0000
238 D A -2.4048
239 D A -1.2162
240 C A -0.5771
241 P A -0.7526
242 G A -1.0979
243 H A -1.3229
244 R A -1.9796
245 C A 0.0000
246 L A 0.2328
247 N A -1.2541
248 G A -1.1034
249 G A -1.0146
250 T A -0.9413
251 C A -0.3958
252 V A 0.2616
253 D A -1.0279
254 G A 0.0000
255 V A -1.6932
256 N A -1.7199
257 T A -1.0929
258 Y A -0.8129
259 N A -0.7609
260 C A 0.0000
261 Q A -1.0241
262 C A 0.0000
263 P A -0.7873
264 P A -1.6204
265 E A -2.2249
266 W A 0.0000
267 T A -1.3314
268 G A -1.1932
269 Q A -1.1462
270 F A -0.4835
271 C A -1.0041
272 T A -0.9116
273 E A -2.2128
274 D A -1.7185
275 V A -1.3767
276 D A -2.1360
277 E A -0.8777
278 C A -0.3874
279 Q A -0.9773
280 L A -0.0319
281 Q A -0.8295
282 P A -0.6908
283 N A -0.6742
284 A A -0.5310
285 C A 0.0000
286 H A -1.7918
287 N A -1.9933
288 G A -1.2946
289 G A -0.5460
290 T A 0.7302
291 C A 0.8410
292 F A 1.6660
293 N A 0.0506
294 T A 0.4813
295 L A 0.7091
296 G A -0.6121
297 G A -0.1959
298 H A -0.3885
299 S A -0.0884
300 C A 0.0000
301 V A 0.9638
302 C A 0.2621
303 V A 0.9154
304 N A -0.9101
305 G A -0.3048
306 W A 0.7691
307 T A -0.1463
308 G A -0.8112
309 E A -1.3287
310 S A -1.0341
311 C A -0.4523
312 S A -0.4399
313 Q A -0.9336
314 N A -1.1354
315 I A -1.2402
316 D A -2.2207
317 D A -1.3830
318 C A -0.3921
319 A A 0.1568
320 T A 0.1719
321 A A 0.9222
322 V A 1.4079
323 C A 1.4871
324 F A 1.4511
325 H A -0.1258
326 G A -0.2138
327 A A 0.3005
328 T A 0.2879
329 C A 0.2869
330 H A -0.7429
331 D A -1.6436
332 R A -1.6357
333 V A 0.0220
334 A A -0.5857
335 S A -0.6335
336 F A 0.1228
337 Y A 0.9088
338 C A 0.0000
339 A A 1.1608
340 C A 0.0000
341 P A -0.2011
342 M A -0.6800
343 G A -1.6208
344 K A -2.4721
345 T A -0.8189
346 G A 0.5153
347 L A 2.2834
348 L A 2.4412
349 C A 0.0000
350 H A 0.2021
351 L A -0.3923
352 D A -1.7239
353 D A -2.3944
354 A A -0.5956
355 C A 0.0000
356 V A 1.0787
357 S A -0.1832
358 N A -1.2779
359 P A -1.2097
360 C A -0.2739
361 H A -1.2647
362 E A -1.9635
363 D A -1.1840
364 A A -0.0292
365 I A 1.5401
366 C A 0.6155
367 D A -0.5615
368 T A 0.0000
369 N A -0.8075
370 P A -0.3245
371 V A 1.1647
372 N A -0.1696
373 G A -0.9210
374 R A -1.1735
375 A A -0.8071
376 I A 0.2280
377 C A 0.0000
378 T A -0.0100
379 C A 0.0000
380 P A -0.2221
381 P A -0.9129
382 G A -1.3977
383 F A 0.0000
384 T A -1.5145
385 G A -1.2629
386 G A -1.1928
387 A A -1.4117
388 C A 0.0000
389 D A -3.0461
390 Q A -2.9893
391 D A -2.7863
392 V A -1.3987
393 D A -2.0097
394 E A -0.8243
395 C A 0.8751
396 S A 1.1044
397 I A 2.1240
398 G A 0.6927
399 A A -0.2391
400 N A -0.7462
401 P A -0.2249
402 C A -0.5948
403 E A -1.5469
404 H A -1.2361
405 L A -0.1224
406 G A -1.0567
407 R A -1.2449
408 C A 0.7955
409 V A 1.6444
410 N A 0.6224
411 T A 0.3568
412 Q A -0.7730
413 G A -0.8235
414 S A 0.1131
415 F A 0.0000
416 L A 1.7020
417 C A 0.7218
418 Q A -1.0672
419 C A -0.7388
420 G A -0.7260
421 R A -0.7893
422 G A -0.0506
423 Y A 0.5074
424 T A 0.0000
425 G A -0.3208
426 P A -0.6129
427 R A -0.3615
428 C A -0.2830
429 E A 0.0000
430 T A 0.0000
431 D A -0.3521
432 V A -0.5706
433 N A -1.6981
434 E A 0.0000
435 C A -1.0928
436 L A -0.7518
437 S A 0.0000
438 G A -0.7278
439 P A -0.6138
440 C A -0.7745
441 R A -2.2187
442 N A -1.4543
443 Q A -1.2801
444 A A -0.1111
445 T A 0.4437
446 C A 0.2332
447 L A -0.1619
448 D A -1.8445
449 R A -1.5693
450 I A 0.2820
451 G A -0.6894
452 Q A -1.4430
453 F A 0.0000
454 T A -0.2645
455 C A 0.0000
456 I A 1.7234
457 C A 0.7198
458 M A 1.0030
459 A A 0.6274
460 G A 0.5679
461 F A 0.0000
462 T A 0.4957
463 G A 0.2601
464 T A 0.2153
465 Y A 0.0153
466 C A 0.0000
467 E A -1.0072
468 V A -0.2744
469 D A -0.2617
470 I A 1.1179
471 D A -0.8580
472 E A -1.8344
473 C A -1.8625
474 Q A -2.2520
475 S A -1.4833
476 S A -0.9403
477 P A -0.9156
478 C A -0.4808
479 V A -0.2105
480 N A -0.7561
481 G A -0.6040
482 G A -0.4128
483 V A 0.0954
484 R A -2.4137
485 K A -3.0660
486 D A -2.8401
487 R A -2.3796
488 V A -0.1404
489 N A -1.2168
490 G A -1.2599
491 F A -2.0167
492 S A -1.8583
493 C A 0.0000
494 T A -0.3601
495 C A -0.1265
496 P A -0.1047
497 S A -0.4590
498 G A -1.0097
499 F A -0.2877
500 S A -0.9764
501 G A -0.9926
502 S A -0.6411
503 T A -0.9636
504 C A 0.0000
505 Q A -1.4805
506 L A 0.0000
507 D A -2.6006
508 V A -2.2319
509 D A -2.4614
510 E A -1.5685
511 C A -0.2583
512 A A 0.1420
513 S A 0.0107
514 T A -0.6810
515 P A -0.9490
516 C A 0.0000
517 R A -2.4985
518 N A -2.7381
519 G A -2.1964
520 A A -2.0533
521 K A -2.3009
522 C A -0.8936
523 V A -0.9134
524 D A -1.7027
525 Q A -1.9808
526 P A -1.9379
527 D A -1.6338
528 G A -0.9790
529 Y A -0.1178
530 E A -1.3611
531 C A -0.9141
532 R A -2.2657
533 C A -1.9031
534 A A -1.9551
535 E A -2.3209
536 G A -1.2054
537 F A -0.8110
538 E A -1.5125
539 G A -0.9722
540 T A -0.0623
541 L A 0.7055
542 C A 0.0000
543 D A -1.2353
544 R A -1.2131
545 N A 0.0000
546 V A 0.2686
547 D A -0.7700
548 D A -1.8853
549 C A -0.8924
550 S A -1.4703
551 P A -2.0427
552 D A -2.4970
553 P A -1.9274
554 C A -2.2556
555 H A -2.9814
556 H A -2.3742
557 G A -1.6412
558 R A -1.6267
559 C A -0.5654
560 V A 0.6137
561 D A 0.0892
562 G A 0.4211
563 I A 1.6001
564 A A 0.9374
565 S A 0.8812
566 F A 1.0720
567 S A 0.3673
568 C A -0.0114
569 A A 0.0621
570 C A -0.3304
571 A A 0.0778
572 P A 0.2721
573 G A 0.3913
574 Y A 0.5554
575 T A -0.2160
576 G A -0.7916
577 T A -1.5262
578 R A -3.0052
579 C A -2.4274
580 E A -2.0231
581 S A -1.0291
582 Q A -0.2835
583 V A 0.4999
584 D A -1.1563
585 E A -1.1146
586 C A 0.0000
587 R A -2.2204
588 S A -1.4400
589 Q A -1.2283
590 P A -1.4775
591 C A -1.5169
592 R A -1.4246
593 H A -1.9833
594 G A -1.6533
595 G A -1.9379
596 K A -2.4243
597 C A -0.7514
598 L A 0.5895
599 D A -0.4468
600 L A 0.8814
601 V A 0.9622
602 D A -1.2511
603 K A -0.7068
604 Y A 0.4866
605 L A 0.9264
606 C A -0.6217
607 R A -1.9528
608 C A -1.7054
609 P A -1.0930
610 S A -0.7082
611 G A 0.0765
612 T A -0.2130
613 T A -0.0209
614 G A -0.2451
615 V A 0.0000
616 N A -0.6288
617 C A 0.0643
618 E A 0.1177
619 V A 1.2544
620 N A 0.0000
621 I A 0.6192
622 D A -1.1840
623 D A -1.9057
624 C A 0.0000
625 A A -0.5406
626 S A -0.8284
627 N A -0.9933
628 P A -0.0494
629 C A 0.9006
630 T A 1.3755
631 F A 2.3752
632 G A 1.5435
633 V A 0.9767
634 C A -0.4125
635 R A -2.5486
636 D A -2.6027
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1974 T A 0.0000
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1982 E A -1.6393
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1991 L A 0.0000
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1997 N A 0.0000
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1999 E A -1.8890
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2001 T A -0.9035
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2255 W A -0.6002
2256 A A -0.6422
2257 S A 0.0000
2258 P A -0.8159
2259 S A -0.4760
2260 P A -0.3914
2261 P A -0.3031
2262 S A -0.0323
2263 L A 0.6868
2264 S A -0.3729
2265 D A -0.9493
2266 W A -0.1890
2267 S A -0.3612
2268 E A 0.0000
2269 S A 0.0000
2270 T A 0.0000
2271 P A -0.8281
2272 S A -0.4710
2273 P A -0.5302
2274 A A -0.2293
2275 T A -0.2096
2276 A A -0.3157
2277 T A -0.3315
2278 G A -0.3864
2279 A A 0.3043
2280 M A 0.9151
2281 A A 0.3732
2282 T A 0.0000
2283 T A 0.2544
2284 T A 0.0000
2285 G A 0.0000
2286 A A -0.1140
2287 L A -0.1998
2288 P A -0.3957
2289 A A -0.2781
2290 Q A -0.4746
2291 P A -0.3686
2292 L A -0.1343
2293 P A -0.1604
2294 L A 0.0000
2295 S A -0.1334
2296 V A 0.0000
2297 P A 0.0000
2298 S A 0.0000
2299 S A -0.4094
2300 L A 0.0000
2301 A A -0.1570
2302 Q A -0.3800
2303 A A -0.3056
2304 Q A -0.3385
2305 T A -0.3064
2306 Q A 0.0000
2307 L A 0.0634
2308 G A 0.0000
2309 P A 0.0000
2310 Q A -1.5784
2311 P A -1.4124
2312 E A -1.5336
2313 V A -0.8936
2314 T A 0.0000
2315 P A -0.5466
2316 K A -1.4780
2317 R A -2.0948
2318 Q A -0.9379
2319 V A 0.8949
2320 L A 1.5412
2321 A A 0.9747
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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, -0.5714 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_5 -0.5714 View CSV PDB
model_6 -0.5812 View CSV PDB
model_3 -0.5885 View CSV PDB
model_4 -0.5915 View CSV PDB
model_2 -0.5942 View CSV PDB
model_1 -0.6055 View CSV PDB
CABS_average -0.6121 View CSV PDB
model_0 -0.6149 View CSV PDB
model_7 -0.6249 View CSV PDB
model_9 -0.6275 View CSV PDB
model_8 -0.6399 View CSV PDB
model_11 -0.6427 View CSV PDB
model_10 -0.6633 View CSV PDB
input -0.7597 View CSV PDB