Project name: R607C_5_4D

Status: done

Started: 2026-05-22 01:14:58
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCCCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
input PDB
Selected Chain(s) A
Distance of aggregation 5 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]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimization                                          (00:00:03)
[INFO]       CABS:     Running CABS flex simulation                                                (00:35:45)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (20:35:48)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (20:37:04)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (20:38:20)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (20:39:35)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (20:40:48)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (20:41:58)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (20:43:13)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (20:44:25)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (20:45:36)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (20:46:45)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (20:47:55)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (20:49:05)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (20:50:16)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (20:52:38)
[INFO]       Main:     Simulation completed successfully.                                          (20:53:50)
Show buried residues

Minimal score value
-2.5919
Maximal score value
2.2644
Average score
-0.2252
Total score value
-522.6694

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 1.0012
2 G A -0.1967
3 P A -0.2634
4 G A -0.5066
5 A A -0.0309
6 R A 0.0000
7 G A -0.5880
8 R A -0.9217
9 R A -2.2701
10 R A -2.4778
11 R A -2.5919
12 R A -2.3253
13 R A -1.4625
14 P A -0.2899
15 M A 0.2069
16 S A -0.2496
17 P A -0.0523
18 P A 0.0000
19 P A -0.2618
20 P A -0.0906
21 P A -0.0434
22 P A -0.3167
23 P A 0.1653
24 V A 1.3987
25 R A -1.5079
26 A A 0.0041
27 L A 1.5088
28 P A 0.3375
29 L A 1.7926
30 L A 2.0443
31 L A 1.6650
32 L A 2.0471
33 L A 1.8487
34 A A 0.2626
35 G A -0.3458
36 P A -0.3070
37 G A -0.4947
38 A A -0.0995
39 A A 0.0000
40 A A 0.0585
41 P A 0.0000
42 P A -0.2405
43 C A 0.3242
44 L A 1.2203
45 D A -1.5828
46 G A -0.8269
47 S A -0.2369
48 P A -0.2541
49 C A 0.0581
50 A A -0.2341
51 N A -1.3600
52 G A -0.7312
53 G A -0.5675
54 R A -1.8184
55 C A -0.1017
56 T A -0.1934
57 Q A -1.2007
58 L A 0.0000
59 P A -0.2943
60 S A -0.3888
61 R A -1.0656
62 E A -1.9486
63 A A 0.0000
64 A A 0.0000
65 C A 0.0000
66 L A 0.5873
67 C A 0.0000
68 P A -0.2400
69 P A -0.3893
70 G A -0.4437
71 W A 0.1031
72 V A 0.2586
73 G A -0.2220
74 E A 0.0000
75 R A -0.3615
76 C A 0.3819
77 Q A -1.1107
78 L A 0.0000
79 E A -2.1085
80 D A -2.1349
81 P A -0.4421
82 C A -0.0747
83 H A -1.0119
84 S A -0.4921
85 G A -0.5215
86 P A -0.1363
87 C A 0.1335
88 A A -0.0241
89 G A -0.8078
90 R A -2.0215
91 G A -0.7702
92 V A 0.2259
93 C A 0.1918
94 Q A -0.5921
95 S A -0.0294
96 S A -0.2693
97 V A 0.0000
98 V A 1.0808
99 A A 0.1771
100 G A -0.4649
101 T A -0.1384
102 A A -0.3553
103 R A -1.5968
104 F A 0.9617
105 S A 0.0606
106 C A 0.0000
107 R A -1.8441
108 C A 0.0000
109 P A -0.5868
110 R A -1.7798
111 G A -0.4602
112 F A 1.0925
113 R A 0.0000
114 G A -0.2551
115 P A -0.5489
116 D A -1.3122
117 C A 0.2399
118 S A -0.0132
119 L A 0.4547
120 P A 0.0041
121 D A 0.0000
122 P A -0.2102
123 C A 0.0000
124 L A 1.5078
125 S A 0.0709
126 S A -0.1419
127 P A -0.2177
128 C A 0.1009
129 A A -0.0814
130 H A -0.9911
131 G A -0.3872
132 A A -0.3641
133 R A -1.7647
134 C A 0.0615
135 S A 0.2413
136 V A 1.2394
137 G A 0.1388
138 P A -0.6071
139 D A -1.9282
140 G A -0.8123
141 R A 0.0000
142 F A 0.7894
143 L A 1.5132
144 C A 0.4400
145 S A -0.0002
146 C A 0.1243
147 P A -0.0577
148 P A -0.2715
149 G A 0.1014
150 Y A 1.2484
151 Q A -0.1444
152 G A -0.8677
153 R A -1.9722
154 S A -0.5706
155 C A 0.0000
156 R A -0.8321
157 S A -0.4353
158 D A -0.6839
159 V A -0.0301
160 D A -1.8021
161 E A -0.6755
162 C A -0.1008
163 R A -1.5368
164 V A 0.9467
165 G A -0.5507
166 E A -1.9249
167 P A -0.3400
168 C A 0.1079
169 R A -1.9394
170 H A -1.4601
171 G A -0.7176
172 G A -0.5048
173 T A -0.0998
174 C A 0.2975
175 L A 0.6951
176 N A -0.5668
177 T A -0.2331
178 P A -0.2863
179 G A -0.2159
180 S A -0.2011
181 F A -0.2657
182 R A -1.4947
183 C A 0.0000
184 Q A -1.1906
185 C A -0.1690
186 P A -0.1610
187 A A 0.1573
188 G A 0.0000
189 Y A 1.2910
190 T A 0.1923
191 G A -0.2012
192 P A -0.0892
193 L A 1.1051
194 C A 0.4920
195 E A -1.6975
196 N A 0.0000
197 P A -0.0990
198 A A 0.1344
199 V A 0.6530
200 P A 0.1698
201 C A 0.3389
202 A A 0.0188
203 P A -0.2780
204 S A -0.2596
205 P A -0.2724
206 C A -0.3022
207 R A -2.0193
208 N A -1.6954
209 G A -0.7924
210 G A -0.5580
211 T A -0.0979
212 C A -0.2889
213 R A -1.9014
214 Q A -0.7181
215 S A -0.3308
216 G A -0.6252
217 D A -1.7231
218 L A 0.2458
219 T A 0.1133
220 Y A 0.1852
221 D A -0.6558
222 C A -0.0227
223 A A 0.0284
224 C A 0.0000
225 L A 1.5196
226 P A 0.0591
227 G A -0.4941
228 F A 0.0000
229 E A -1.8783
230 G A -0.8816
231 Q A -1.4223
232 N A -0.9554
233 C A 0.2247
234 E A -1.6819
235 V A 0.0000
236 N A -0.2856
237 V A 1.2318
238 D A -1.4002
239 D A -2.0270
240 C A -0.2594
241 P A -0.2862
242 G A -0.5355
243 H A -1.3952
244 R A -2.0149
245 C A -0.1975
246 L A 0.0886
247 N A -1.2719
248 G A -0.6448
249 G A -0.5301
250 T A -0.1060
251 C A 0.3959
252 V A 0.5297
253 D A -1.6307
254 G A -0.3941
255 V A 0.1265
256 N A -0.7667
257 T A -0.1474
258 Y A -0.0394
259 N A -0.2919
260 C A 0.0000
261 Q A -0.4553
262 C A 0.0187
263 P A -0.0803
264 P A -0.5917
265 E A -1.8401
266 W A -0.1952
267 T A -0.0209
268 G A -0.3710
269 Q A -0.8525
270 F A 1.7110
271 C A 0.0000
272 T A -0.0708
273 E A -0.5819
274 D A -1.7863
275 V A -0.1829
276 D A -0.4928
277 E A 0.0000
278 C A -0.1604
279 Q A -1.0058
280 L A 0.5927
281 Q A -0.3815
282 P A -0.4150
283 N A -0.3579
284 A A 0.0000
285 C A 0.0000
286 H A -0.7690
287 N A -0.8796
288 G A -0.2475
289 G A -0.1099
290 T A -0.0009
291 C A 0.4801
292 F A 1.8759
293 N A -0.0843
294 T A 0.1637
295 L A 1.4533
296 G A 0.1012
297 G A -0.4974
298 H A -0.3733
299 S A 0.0606
300 C A 0.0000
301 V A 1.5698
302 C A 0.4395
303 V A 0.0000
304 N A -0.5185
305 G A -0.1605
306 W A 0.0000
307 T A -0.0738
308 G A -0.6827
309 E A -1.6869
310 S A -0.4081
311 C A 0.1597
312 S A -0.1292
313 Q A -0.2071
314 N A 0.0000
315 I A 0.3079
316 D A -0.6408
317 D A 0.0000
318 C A 0.0913
319 A A 0.0288
320 T A 0.0940
321 A A 0.2917
322 V A 1.5666
323 C A 0.0000
324 F A 1.1237
325 H A -0.8370
326 G A -0.6533
327 A A -0.1863
328 T A 0.0167
329 C A 0.0140
330 H A -0.4742
331 D A -0.6365
332 R A -1.7340
333 V A 0.5027
334 A A 0.1750
335 S A -0.3419
336 F A 0.0000
337 Y A 0.9263
338 C A 0.0000
339 A A 0.0000
340 C A 0.1194
341 P A 0.0000
342 M A 0.4839
343 G A -0.0772
344 K A 0.0000
345 T A 0.0000
346 G A -0.1241
347 L A 0.5335
348 L A 0.5403
349 C A 0.0000
350 H A -0.1771
351 L A 0.0000
352 D A -0.5270
353 D A -0.7422
354 A A -0.1176
355 C A 0.0000
356 V A 1.4917
357 S A -0.1621
358 N A -1.3737
359 P A -0.5853
360 C A -0.2960
361 H A -1.3182
362 E A -2.3412
363 D A -2.1281
364 A A 0.0579
365 I A 2.0433
366 C A 0.4349
367 D A -0.4892
368 T A 0.0000
369 N A -0.2570
370 P A 0.0926
371 V A 0.8939
372 N A -0.5453
373 G A -0.4090
374 R A -0.5108
375 A A -0.0334
376 I A 0.2448
377 C A 0.0000
378 T A 0.0000
379 C A 0.0341
380 P A -0.2265
381 P A -0.3032
382 G A -0.0691
383 F A 0.1874
384 T A 0.0000
385 G A -0.1230
386 G A -0.2918
387 A A -0.0041
388 C A 0.0000
389 D A -1.9102
390 Q A -0.9784
391 D A 0.0000
392 V A 0.0000
393 D A -0.5404
394 E A -0.7927
395 C A 0.2056
396 S A 0.0695
397 I A 0.6502
398 G A -0.3168
399 A A -0.0742
400 N A 0.0000
401 P A -0.2179
402 C A -0.2035
403 E A -1.9827
404 H A -1.2016
405 L A 0.4821
406 G A -0.3495
407 R A -0.3919
408 C A 0.0000
409 V A 0.5274
410 N A -0.3604
411 T A -0.3774
412 Q A -1.3142
413 G A -0.7310
414 S A -0.3709
415 F A 0.4665
416 L A 1.5872
417 C A 0.0000
418 Q A -0.2996
419 C A -0.1720
420 G A -0.6251
421 R A -1.0548
422 G A -0.2640
423 Y A 0.7911
424 T A 0.1666
425 G A -0.2129
426 P A -0.4209
427 R A -0.9686
428 C A 0.0000
429 E A -0.0777
430 T A -0.2509
431 D A -0.7545
432 V A 0.7353
433 N A -0.2269
434 E A -0.8258
435 C A 0.3493
436 L A 1.5527
437 S A 0.0172
438 G A -0.5138
439 P A -0.0363
440 C A 0.4396
441 R A -0.4031
442 N A -1.4300
443 Q A -0.9016
444 A A -0.1380
445 T A 0.0096
446 C A 0.2102
447 L A 0.2556
448 D A -0.8232
449 R A -1.0671
450 I A 1.7758
451 G A 0.0432
452 Q A -1.3160
453 F A 0.0898
454 T A 0.0000
455 C A 0.0000
456 I A 0.3892
457 C A 0.0000
458 M A 1.0643
459 A A 0.2549
460 G A 0.0000
461 F A 0.0000
462 T A 0.0000
463 G A 0.0000
464 T A 0.1783
465 Y A 1.3018
466 C A 0.0000
467 E A -1.7445
468 V A -0.1239
469 D A -0.6953
470 I A -0.1536
471 D A -1.8036
472 E A -0.7797
473 C A 0.0000
474 Q A -1.2391
475 S A -0.4613
476 S A -0.1891
477 P A -0.2741
478 C A 0.0000
479 V A 1.2101
480 N A -0.4905
481 G A -0.6553
482 G A -0.3936
483 V A 0.1981
484 C A -0.0838
485 K A -2.0096
486 D A -2.4594
487 R A -1.8532
488 V A 1.3713
489 N A 0.0613
490 G A -0.1889
491 F A 0.7200
492 S A -0.0605
493 C A 0.1884
494 T A 0.0295
495 C A 0.1469
496 P A -0.2314
497 S A -0.1808
498 G A -0.0366
499 F A 1.0705
500 S A -0.0815
501 G A -0.5148
502 S A -0.1453
503 T A -0.0791
504 C A 0.0000
505 Q A -0.9328
506 L A 0.9142
507 D A -1.3161
508 V A -0.1986
509 D A -1.1914
510 E A -0.5650
511 C A 0.0645
512 A A 0.0417
513 S A -0.2048
514 T A -0.0930
515 P A -0.2312
516 C A -0.2195
517 R A -1.7351
518 N A -1.6496
519 G A -0.7036
520 A A -0.3355
521 K A -1.6695
522 C A 0.0171
523 V A 0.6930
524 D A -1.0384
525 Q A -1.4410
526 P A -0.8148
527 D A -1.8526
528 G A -0.3032
529 Y A 1.0734
530 E A -0.9016
531 C A -0.3683
532 R A -1.6903
533 C A 0.2622
534 A A -0.1944
535 E A -1.8329
536 G A -0.4407
537 F A -0.2234
538 E A -1.7428
539 G A -0.8011
540 T A 0.1741
541 L A 1.5537
542 C A 0.2423
543 D A -0.8110
544 R A -1.2692
545 N A -0.5514
546 V A 1.5886
547 D A -0.0669
548 D A -1.8194
549 C A -0.2696
550 S A -0.3392
551 P A -0.4314
552 D A -0.7471
553 P A -0.3134
554 C A 0.0000
555 H A -1.1793
556 H A -1.2145
557 G A -0.7065
558 R A -1.8456
559 C A 0.1472
560 V A 1.6706
561 D A -0.3711
562 G A -0.0275
563 I A 1.9322
564 A A 0.3553
565 S A -0.1408
566 F A 0.2012
567 S A -0.1423
568 C A 0.0000
569 A A -0.1442
570 C A 0.1671
571 A A -0.0072
572 P A -0.2668
573 G A 0.0581
574 Y A 1.1649
575 T A 0.0000
576 G A -0.4729
577 T A -0.3821
578 R A -1.3195
579 C A -0.4047
580 E A -1.8254
581 S A -0.7920
582 Q A -1.0510
583 V A -0.1400
584 D A -1.1477
585 E A -0.8320
586 C A 0.0000
587 R A -1.8846
588 S A -0.7892
589 Q A -1.2901
590 P A -0.4978
591 C A 0.0000
592 R A -1.9671
593 H A -1.0861
594 G A -0.6679
595 G A -0.8680
596 K A -1.6934
597 C A 0.0668
598 L A 0.5944
599 D A -0.3298
600 L A 1.5475
601 V A 1.7186
602 D A -1.6258
603 K A -0.9900
604 Y A 0.4056
605 L A 1.0431
606 C A 0.0000
607 C A 0.4473
608 C A 0.0000
609 P A -0.2797
610 S A -0.2081
611 G A 0.0498
612 T A -0.0920
613 T A -0.1069
614 G A 0.1520
615 V A 1.7127
616 N A -0.0217
617 C A -0.1529
618 E A -1.4669
619 V A 1.4072
620 N A 0.5871
621 I A 1.9183
622 D A -0.2503
623 D A -1.8289
624 C A -0.2534
625 A A 0.0525
626 S A -0.2977
627 N A -1.1147
628 P A -0.3869
629 C A 0.0471
630 T A 0.3278
631 F A 1.8925
632 G A 0.4688
633 V A 1.3477
634 C A 0.2112
635 R A -1.8419
636 D A -0.6870
637 G A -0.2042
638 I A 0.6961
639 N A -1.0704
640 R A -1.7131
641 Y A 0.6758
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1974 T A 0.0000
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1991 L A 0.0000
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1996 A A -0.0527
1997 N A -0.9933
1998 R A -2.2361
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2262 S A 0.0421
2263 L A 1.5239
2264 S A -0.0519
2265 D A -1.5733
2266 W A 0.8114
2267 S A -0.0768
2268 E A -0.5258
2269 S A -0.3123
2270 T A -0.1601
2271 P A -0.3081
2272 S A -0.3094
2273 P A -0.2850
2274 A A 0.0027
2275 T A -0.0179
2276 A A 0.0472
2277 T A -0.0068
2278 G A 0.0000
2279 A A 0.1082
2280 M A 0.2768
2281 A A 0.0771
2282 T A -0.0050
2283 T A -0.0397
2284 T A -0.1644
2285 G A -0.4688
2286 A A -0.0295
2287 L A 0.0000
2288 P A -0.2454
2289 A A -0.0548
2290 Q A -0.3179
2291 P A -0.1764
2292 L A 0.1993
2293 P A -0.1424
2294 L A 0.1160
2295 S A -0.3789
2296 V A 0.0000
2297 P A -0.2676
2298 S A -0.1407
2299 S A -0.0869
2300 L A 0.5358
2301 A A -0.1650
2302 Q A -1.2355
2303 A A -0.3408
2304 Q A -0.8671
2305 T A -0.3166
2306 Q A -0.6498
2307 L A 0.2010
2308 G A -0.1276
2309 P A -0.2640
2310 Q A -0.5208
2311 P A -0.6821
2312 E A -1.6408
2313 V A 0.7780
2314 T A 0.1168
2315 P A -0.5176
2316 K A -2.0797
2317 R A -2.2353
2318 Q A -0.5377
2319 V A 1.1615
2320 L A 1.1683
2321 A A 0.2403
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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, -0.2252 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_10 -0.2252 View CSV PDB
model_3 -0.2304 View CSV PDB
model_8 -0.2331 View CSV PDB
model_5 -0.2344 View CSV PDB
model_1 -0.235 View CSV PDB
model_9 -0.2386 View CSV PDB
CABS_average -0.2419 View CSV PDB
model_6 -0.2471 View CSV PDB
model_2 -0.2472 View CSV PDB
model_0 -0.2512 View CSV PDB
model_11 -0.2517 View CSV PDB
model_4 -0.2519 View CSV PDB
model_7 -0.2572 View CSV PDB
input -0.2769 View CSV PDB