Project name: C76R_5_4D

Status: done

Started: 2026-05-18 02:50:14
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERRQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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]                                                (00:00:00)
[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                                                (00:17:49)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (17:02:31)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (17:03:44)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (17:04:59)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (17:06:15)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (17:07:28)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (17:08:42)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (17:09:58)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (17:11:13)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (17:12:28)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (17:13:43)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (17:14:56)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (17:16:09)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (17:17:23)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (17:19:46)
[INFO]       Main:     Simulation completed successfully.                                          (17:20:58)
Show buried residues

Minimal score value
-2.5094
Maximal score value
2.4144
Average score
-0.2069
Total score value
-480.1273

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 0.9665
2 G A -0.3981
3 P A -0.4379
4 G A -0.5297
5 A A -0.0754
6 R A -0.2847
7 G A -0.6875
8 R A -1.3497
9 R A -2.1525
10 R A -1.3725
11 R A -1.8302
12 R A 0.0000
13 R A -0.9385
14 P A -0.3882
15 M A 0.1277
16 S A -0.1515
17 P A -0.1499
18 P A 0.0000
19 P A 0.0000
20 P A -0.2025
21 P A -0.1296
22 P A -0.1621
23 P A 0.0548
24 V A 1.3876
25 R A -1.5093
26 A A 0.1658
27 L A 1.5543
28 P A 0.0000
29 L A 0.6123
30 L A 0.0000
31 L A 1.7314
32 L A 1.2382
33 L A 0.0000
34 A A -0.0067
35 G A -0.1120
36 P A -0.1705
37 G A -0.4096
38 A A -0.0391
39 A A 0.0367
40 A A 0.0134
41 P A 0.0000
42 P A -0.2549
43 C A 0.0000
44 L A 0.2879
45 D A -1.7305
46 G A -0.6250
47 S A -0.1852
48 P A -0.2682
49 C A 0.0000
50 A A -0.2132
51 N A -1.3549
52 G A -0.7067
53 G A -0.3274
54 R A -1.0005
55 C A 0.0000
56 T A -0.0695
57 Q A -0.3189
58 L A 0.0000
59 P A -0.1941
60 S A -0.4175
61 R A -1.4386
62 E A -2.0177
63 A A -0.3851
64 A A 0.0461
65 C A 0.2624
66 L A 0.8946
67 C A 0.0000
68 P A -0.3285
69 P A -0.3492
70 G A -0.2109
71 W A 0.0000
72 V A 0.2731
73 G A 0.0000
74 E A -2.1676
75 R A -2.3324
76 R A -1.3537
77 Q A -1.3476
78 L A 0.0000
79 E A -1.6208
80 D A -1.7071
81 P A -0.3835
82 C A 0.4395
83 H A -0.8987
84 S A -0.4178
85 G A -0.1655
86 P A -0.2463
87 C A 0.0978
88 A A -0.0040
89 G A -0.5007
90 R A -0.3436
91 G A 0.0123
92 V A 1.0205
93 C A 0.6629
94 Q A -0.6571
95 S A -0.1985
96 S A 0.0158
97 V A 1.5800
98 V A 2.0161
99 A A 0.2767
100 G A -0.4732
101 T A -0.1503
102 A A 0.0000
103 R A -1.2371
104 F A 0.2341
105 S A 0.0000
106 C A 0.0456
107 R A -0.8306
108 C A 0.0000
109 P A 0.0000
110 R A -0.9603
111 G A -0.2734
112 F A 0.0000
113 R A 0.0000
114 G A 0.0000
115 P A -0.4156
116 D A -1.7883
117 C A -0.2589
118 S A -0.0082
119 L A 0.0000
120 P A 0.0000
121 D A -0.7079
122 P A 0.0000
123 C A 0.0000
124 L A 0.3275
125 S A -0.1598
126 S A -0.1745
127 P A -0.2143
128 C A 0.2618
129 A A 0.0361
130 H A -0.3769
131 G A -0.5207
132 A A -0.1122
133 R A 0.0000
134 C A 0.0000
135 S A 0.0000
136 V A 0.0000
137 G A 0.0000
138 P A -0.2991
139 D A -0.8300
140 G A 0.0000
141 R A -1.1781
142 F A 0.0000
143 L A 0.2957
144 C A 0.0000
145 S A 0.0000
146 C A 0.0000
147 P A -0.1675
148 P A -0.1199
149 G A 0.0000
150 Y A 0.0000
151 Q A -1.2882
152 G A -1.0584
153 R A -1.9763
154 S A -0.5298
155 C A 0.1592
156 R A 0.0000
157 S A -0.3768
158 D A -0.8293
159 V A 0.0592
160 D A -1.2921
161 E A 0.0000
162 C A 0.0000
163 R A -1.6174
164 V A 0.8493
165 G A -0.1714
166 E A -2.1334
167 P A -0.5628
168 C A -0.2821
169 R A -2.2501
170 H A -1.3716
171 G A -0.5001
172 G A -0.5196
173 T A -0.0955
174 C A 0.3072
175 L A 0.1363
176 N A -0.5927
177 T A -0.1979
178 P A -0.3474
179 G A -0.5260
180 S A -0.1504
181 F A 0.0000
182 R A -0.7903
183 C A 0.0000
184 Q A -0.7815
185 C A 0.1885
186 P A -0.1694
187 A A -0.0052
188 G A 0.0000
189 Y A 0.6259
190 T A 0.0892
191 G A 0.0000
192 P A 0.0263
193 L A 1.5014
194 C A 0.0000
195 E A -1.8923
196 N A -0.7381
197 P A -0.1255
198 A A 0.3512
199 V A 1.2467
200 P A 0.2624
201 C A 0.2946
202 A A 0.0000
203 P A -0.1935
204 S A -0.2901
205 P A -0.2823
206 C A -0.3306
207 R A -1.8760
208 N A -0.6709
209 G A -0.5165
210 G A -0.1936
211 T A -0.0767
212 C A -0.2170
213 R A -2.0338
214 Q A -0.8976
215 S A -0.5934
216 G A -0.8454
217 D A -1.8228
218 L A 0.0695
219 T A 0.1657
220 Y A 0.4188
221 D A -0.9181
222 C A 0.1117
223 A A 0.1189
224 C A 0.2758
225 L A 0.1496
226 P A 0.0872
227 G A -0.1697
228 F A 1.1572
229 E A -1.2093
230 G A -0.9605
231 Q A -1.5320
232 N A -1.5043
233 C A 0.0000
234 E A -0.6617
235 V A 0.0455
236 N A 0.0000
237 V A 1.4308
238 D A -1.7923
239 D A -2.1311
240 C A 0.0000
241 P A -0.2829
242 G A -0.3921
243 H A -1.2385
244 R A -1.3125
245 C A 0.2330
246 L A 1.3376
247 N A -1.0697
248 G A -0.7952
249 G A -0.5560
250 T A -0.0347
251 C A 0.5689
252 V A 1.2454
253 D A -0.2366
254 G A 0.1594
255 V A 1.5172
256 N A -0.9434
257 T A -0.2455
258 Y A 0.0000
259 N A -0.5427
260 C A 0.0000
261 Q A -1.1983
262 C A 0.0000
263 P A -0.1219
264 P A -0.3332
265 E A -0.8824
266 W A -0.2458
267 T A -0.0654
268 G A -0.6089
269 Q A -0.4386
270 F A 1.8264
271 C A 0.4189
272 T A 0.0000
273 E A -1.8793
274 D A -1.9033
275 V A 0.3835
276 D A -0.2001
277 E A -0.7843
278 C A 0.4780
279 Q A -0.1574
280 L A 1.4187
281 Q A 0.0117
282 P A -0.3378
283 N A -0.2027
284 A A 0.0027
285 C A 0.0000
286 H A 0.0000
287 N A -1.3035
288 G A -0.4018
289 G A 0.0000
290 T A -0.0542
291 C A 0.2176
292 F A 0.4578
293 N A -0.1459
294 T A 0.2340
295 L A 1.4557
296 G A -0.1976
297 G A -0.2919
298 H A -0.4675
299 S A -0.0729
300 C A 0.4590
301 V A 0.5359
302 C A 0.7266
303 V A 1.7973
304 N A 0.1256
305 G A -0.0657
306 W A 0.3843
307 T A 0.0000
308 G A -0.7862
309 E A -1.8029
310 S A -0.4266
311 C A 0.0682
312 S A 0.0000
313 Q A 0.0000
314 N A 0.0000
315 I A 0.0000
316 D A -1.3004
317 D A -0.5600
318 C A 0.0201
319 A A 0.2470
320 T A 0.1580
321 A A 0.3552
322 V A 1.7947
323 C A 0.6514
324 F A 0.9015
325 H A -0.8334
326 G A -0.4701
327 A A 0.0000
328 T A 0.0409
329 C A 0.1525
330 H A -0.1691
331 D A 0.0000
332 R A -0.1856
333 V A 0.3065
334 A A 0.1097
335 S A -0.0119
336 F A 0.3000
337 Y A 0.3981
338 C A 0.0000
339 A A 0.0269
340 C A 0.0271
341 P A -0.2030
342 M A -0.0499
343 G A -0.4572
344 K A -1.6358
345 T A 0.0000
346 G A -0.0486
347 L A 0.0000
348 L A 0.4076
349 C A 0.6046
350 H A -0.8245
351 L A 0.0000
352 D A -1.9632
353 D A 0.0000
354 A A 0.0254
355 C A 0.3480
356 V A 1.3214
357 S A -0.1859
358 N A -1.2650
359 P A -0.3333
360 C A 0.0428
361 H A -0.4363
362 E A -1.8871
363 D A -0.5949
364 A A 0.0000
365 I A 0.9120
366 C A 0.0000
367 D A -0.3788
368 T A 0.0000
369 N A -0.1405
370 P A 0.0000
371 V A 0.0000
372 N A -0.2124
373 G A -0.4625
374 R A -0.8120
375 A A 0.0000
376 I A 0.5391
377 C A 0.0000
378 T A -0.0292
379 C A 0.0000
380 P A 0.0000
381 P A 0.1212
382 G A -0.1685
383 F A 0.0000
384 T A -0.0192
385 G A -0.1090
386 G A -0.1215
387 A A 0.0980
388 C A 0.0000
389 D A -0.2844
390 Q A 0.0000
391 D A 0.0000
392 V A 0.0000
393 D A -0.3100
394 E A -0.2093
395 C A 0.0896
396 S A 0.0592
397 I A 0.2778
398 G A -0.1186
399 A A -0.2574
400 N A -1.3203
401 P A -0.5159
402 C A -0.1141
403 E A -1.0986
404 H A -1.0940
405 L A 0.0853
406 G A -0.7443
407 R A -1.9325
408 C A 0.0000
409 V A 0.0000
410 N A 0.0000
411 T A 0.0000
412 Q A 0.0000
413 G A -0.0786
414 S A 0.1318
415 F A 1.0010
416 L A 0.7904
417 C A 0.0299
418 Q A -0.8716
419 C A 0.0000
420 G A -0.6593
421 R A -1.1005
422 G A -0.3036
423 Y A -0.0576
424 T A 0.0340
425 G A -0.2028
426 P A -0.7318
427 R A -1.8421
428 C A -0.1866
429 E A -0.4743
430 T A -0.4672
431 D A -1.7511
432 V A 0.0000
433 N A 0.0000
434 E A -0.3152
435 C A 0.0000
436 L A 1.5365
437 S A 0.2367
438 G A 0.0000
439 P A 0.0000
440 C A 0.0000
441 R A 0.0000
442 N A -1.2351
443 Q A -0.6494
444 A A -0.0793
445 T A 0.0036
446 C A 0.1935
447 L A 0.2966
448 D A -0.5983
449 R A -1.4110
450 I A 1.6038
451 G A -0.3150
452 Q A -1.1768
453 F A 0.3213
454 T A 0.1117
455 C A 0.4410
456 I A 1.6323
457 C A 0.5712
458 M A 0.9202
459 A A 0.1243
460 G A 0.1041
461 F A 1.8713
462 T A 0.2573
463 G A -0.4751
464 T A -0.0662
465 Y A 0.2034
466 C A 0.0000
467 E A -0.3526
468 V A 0.0000
469 D A -0.4488
470 I A -0.1781
471 D A -1.6292
472 E A -0.9935
473 C A 0.0000
474 Q A -1.2388
475 S A -0.4495
476 S A -0.1351
477 P A -0.2381
478 C A 0.1464
479 V A -0.0023
480 N A -1.2852
481 G A -0.7771
482 G A -0.5228
483 V A -0.0955
484 C A 0.0000
485 K A -1.5430
486 D A -1.0808
487 R A -1.6704
488 V A 0.9693
489 N A -0.2648
490 G A -0.2050
491 F A 0.2863
492 S A 0.0157
493 C A 0.3910
494 T A 0.1023
495 C A 0.4151
496 P A -0.1203
497 S A -0.0758
498 G A -0.0049
499 F A 1.1939
500 S A 0.0970
501 G A -0.1155
502 S A -0.2266
503 T A -0.0698
504 C A 0.0000
505 Q A -0.7538
506 L A -0.2851
507 D A -1.4906
508 V A -0.1194
509 D A -1.5163
510 E A -1.1839
511 C A 0.5362
512 A A 0.0000
513 S A -0.2173
514 T A -0.1133
515 P A -0.2368
516 C A -0.2841
517 R A -2.0098
518 N A -1.7076
519 G A -0.7058
520 A A -0.3948
521 K A -1.6441
522 C A 0.0999
523 V A 0.5924
524 D A -0.8074
525 Q A -1.1955
526 P A -0.7834
527 D A -1.8563
528 G A -0.3417
529 Y A 0.4372
530 E A -0.2989
531 C A 0.0000
532 R A -1.8879
533 C A 0.0000
534 A A -0.2882
535 E A -1.8629
536 G A -0.7369
537 F A 0.0000
538 E A 0.0000
539 G A -0.5435
540 T A -0.0505
541 L A 1.5904
542 C A 0.2289
543 D A -2.0067
544 R A -1.8134
545 N A -0.2618
546 V A 0.6055
547 D A -0.8411
548 D A -1.8601
549 C A -0.1710
550 S A -0.2198
551 P A -0.3386
552 D A -0.3366
553 P A -0.2641
554 C A -0.0657
555 H A -1.0439
556 H A -0.6728
557 G A -0.5901
558 R A -1.8077
559 C A 0.3331
560 V A 1.7582
561 D A -0.1395
562 G A -0.2948
563 I A 1.2326
564 A A 0.2491
565 S A 0.1777
566 F A 1.8924
567 S A 0.6330
568 C A 0.2067
569 A A 0.1031
570 C A 0.0749
571 A A 0.0579
572 P A -0.0487
573 G A -0.1242
574 Y A 0.2644
575 T A 0.0000
576 G A -0.6857
577 T A -0.5137
578 R A -1.7721
579 C A 0.2475
580 E A -0.6387
581 S A -0.5797
582 Q A -1.0904
583 V A 0.2597
584 D A -1.7264
585 E A -0.8003
586 C A 0.0000
587 R A -1.8836
588 S A -0.6558
589 Q A -0.6188
590 P A -0.3238
591 C A -0.2259
592 R A -1.9960
593 H A -1.4278
594 G A -0.7455
595 G A -0.8763
596 K A -1.7570
597 C A 0.0807
598 L A 0.8686
599 D A -0.6460
600 L A 1.6005
601 V A 1.2388
602 D A -1.7642
603 K A -1.5005
604 Y A 0.0000
605 L A 0.7302
606 C A -0.0359
607 R A -1.8150
608 C A 0.0000
609 P A -0.2643
610 S A -0.1399
611 G A -0.0726
612 T A -0.1282
613 T A -0.1643
614 G A -0.1976
615 V A 1.5934
616 N A -0.1837
617 C A -0.1882
618 E A -0.5539
619 V A 1.5567
620 N A 0.0000
621 I A 1.2694
622 D A -0.6802
623 D A -0.9203
624 C A 0.5607
625 A A 0.1671
626 S A -0.1824
627 N A -0.5762
628 P A -0.3327
629 C A 0.0472
630 T A 0.3153
631 F A 1.8464
632 G A 0.2477
633 V A 1.5724
634 C A 0.1146
635 R A -2.1191
636 D A -1.8407
637 G A 0.0000
638 I A 0.4739
639 N A -1.3804
640 R A -1.0016
641 Y A 0.2492
642 D A -0.3286
643 C A 0.0000
644 V A 0.9839
645 C A 0.0000
646 Q A -0.5422
647 P A -0.3698
648 G A -0.1642
649 F A 0.0000
650 T A -0.0352
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1974 T A 0.0000
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1991 L A 0.0000
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1993 D A -0.2814
1994 H A -0.2412
1995 F A 0.0000
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1999 E A -0.3264
2000 I A 0.0000
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2007 L A 0.1488
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2010 D A -0.8054
2011 V A 0.0000
2012 A A 0.0000
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2014 E A -1.6838
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2016 L A 1.1235
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2018 Q A -1.3315
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2277 T A -0.1044
2278 G A -0.4650
2279 A A -0.0543
2280 M A 0.0000
2281 A A 0.0009
2282 T A -0.0309
2283 T A -0.0298
2284 T A -0.1470
2285 G A -0.4866
2286 A A 0.2391
2287 L A 1.4884
2288 P A 0.1536
2289 A A -0.0514
2290 Q A -0.3718
2291 P A -0.2401
2292 L A 0.3338
2293 P A -0.0968
2294 L A 0.0674
2295 S A -0.0939
2296 V A 0.1269
2297 P A -0.2543
2298 S A -0.2597
2299 S A 0.0000
2300 L A 1.5493
2301 A A 0.2467
2302 Q A -1.1913
2303 A A -0.2025
2304 Q A 0.0000
2305 T A -0.0368
2306 Q A 0.0000
2307 L A 1.5291
2308 G A 0.1491
2309 P A -0.3106
2310 Q A -0.3615
2311 P A -0.4048
2312 E A -0.5352
2313 V A 0.1908
2314 T A 0.0145
2315 P A -0.3868
2316 K A -2.0583
2317 R A -2.3891
2318 Q A -1.4933
2319 V A 0.3308
2320 L A 1.6095
2321 A A 0.3485
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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, -0.2069 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 -0.2069 View CSV PDB
model_1 -0.2091 View CSV PDB
model_0 -0.2111 View CSV PDB
model_9 -0.2201 View CSV PDB
model_2 -0.2204 View CSV PDB
model_4 -0.225 View CSV PDB
CABS_average -0.2259 View CSV PDB
model_5 -0.2311 View CSV PDB
model_7 -0.2315 View CSV PDB
model_6 -0.2372 View CSV PDB
model_8 -0.2375 View CSV PDB
model_10 -0.2398 View CSV PDB
model_11 -0.2416 View CSV PDB
input -0.2815 View CSV PDB