Project name: C194Y_5_4D

Status: done

Started: 2026-06-02 01:53:50
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLYENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:21:41)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (16:24:57)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (16:25:41)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (16:26:24)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (16:27:08)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (16:27:51)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (16:28:34)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (16:29:18)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (16:30:01)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (16:30:45)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (16:31:28)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (16:32:12)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (16:32:57)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (16:33:42)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (16:35:07)
[INFO]       Main:     Simulation completed successfully.                                          (16:35:50)
Show buried residues

Minimal score value
-2.7169
Maximal score value
2.6128
Average score
-0.2076
Total score value
-481.8838

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 1.0274
2 G A 0.0302
3 P A -0.1378
4 G A -0.1969
5 A A -0.3364
6 R A -1.8685
7 G A -1.1557
8 R A -2.2800
9 R A -2.3056
10 R A -0.9926
11 R A -2.0068
12 R A -1.0513
13 R A -0.9215
14 P A -0.0173
15 M A 1.0038
16 S A -0.0662
17 P A -0.3442
18 P A -0.3036
19 P A 0.0000
20 P A -0.2569
21 P A -0.1261
22 P A -0.2026
23 P A -0.2152
24 V A 0.0000
25 R A -1.7062
26 A A 0.0017
27 L A 1.3001
28 P A 0.1665
29 L A 1.5845
30 L A 0.9738
31 L A 1.3661
32 L A 0.6217
33 L A 0.5985
34 A A 0.0000
35 G A -0.1032
36 P A -0.3532
37 G A -0.4997
38 A A -0.0400
39 A A 0.0435
40 A A 0.0000
41 P A 0.0000
42 P A 0.0000
43 C A 0.1801
44 L A 0.0000
45 D A -1.8806
46 G A -0.8226
47 S A -0.1696
48 P A -0.2612
49 C A 0.0000
50 A A -0.0892
51 N A -0.2671
52 G A -0.1968
53 G A 0.0000
54 R A 0.0000
55 C A 0.0000
56 T A -0.3880
57 Q A -0.7458
58 L A 0.0000
59 P A -0.0606
60 S A -0.2109
61 R A -0.6090
62 E A -1.8646
63 A A 0.0000
64 A A 0.0125
65 C A 0.0000
66 L A 0.4738
67 C A 0.0963
68 P A -0.2853
69 P A -0.3725
70 G A -0.5034
71 W A 0.0000
72 V A 0.2759
73 G A -0.1164
74 E A 0.0000
75 R A -1.8233
76 C A -0.2393
77 Q A 0.0000
78 L A 0.0000
79 E A -1.3677
80 D A -1.3776
81 P A -0.1201
82 C A 0.5736
83 H A -0.6681
84 S A -0.2929
85 G A -0.2427
86 P A -0.2444
87 C A 0.0944
88 A A 0.0346
89 G A -0.6000
90 R A -1.9051
91 G A -0.3638
92 V A 0.3459
93 C A 0.3491
94 Q A -1.1177
95 S A -0.3081
96 S A -0.0834
97 V A 1.0176
98 V A 1.7587
99 A A 0.2276
100 G A -0.4609
101 T A -0.1245
102 A A 0.0000
103 R A -1.8050
104 F A -0.2718
105 S A -0.0041
106 C A -0.2073
107 R A -1.9332
108 C A 0.0000
109 P A -0.5370
110 R A -1.7524
111 G A -0.2413
112 F A 1.6160
113 R A -0.0141
114 G A -0.1488
115 P A -0.4255
116 D A -1.0884
117 C A 0.0239
118 S A 0.1000
119 L A 1.2970
120 P A 0.4644
121 D A -0.2182
122 P A -0.1209
123 C A 0.0000
124 L A 0.7058
125 S A -0.0128
126 S A -0.2833
127 P A -0.2772
128 C A 0.0498
129 A A -0.1777
130 H A -1.0170
131 G A -0.3393
132 A A -0.3235
133 R A -1.8058
134 C A -0.1729
135 S A 0.0418
136 V A 0.6066
137 G A -0.0402
138 P A -0.5995
139 D A -1.8652
140 G A -0.5868
141 R A -0.1824
142 F A 2.1324
143 L A 1.9446
144 C A 0.4800
145 S A -0.1529
146 C A 0.1060
147 P A -0.0526
148 P A -0.2764
149 G A -0.0921
150 Y A 0.1127
151 Q A -0.5486
152 G A -0.9175
153 R A -1.9267
154 S A -0.4894
155 C A -0.1915
156 R A -1.7701
157 S A -0.4924
158 D A -0.5092
159 V A 0.0491
160 D A -0.9489
161 E A -1.9421
162 C A 0.0000
163 R A -1.5060
164 V A 1.3322
165 G A -0.3423
166 E A -1.2316
167 P A -0.1021
168 C A 0.5642
169 R A -0.8969
170 H A -1.2411
171 G A -0.6892
172 G A -0.2723
173 T A -0.0673
174 C A 0.3469
175 L A 0.3368
176 N A -1.1312
177 T A -0.3145
178 P A -0.2968
179 G A -0.3160
180 S A -0.0681
181 F A 0.0000
182 R A -1.7292
183 C A -0.3870
184 Q A -1.0686
185 C A 0.2883
186 P A 0.1175
187 A A 0.0106
188 G A -0.1466
189 Y A 0.0000
190 T A -0.1378
191 G A -0.1141
192 P A 0.0265
193 L A 1.5553
194 Y A 0.2322
195 E A -1.8701
196 N A -0.9023
197 P A 0.0000
198 A A 0.0931
199 V A 0.3099
200 P A -0.0501
201 C A 0.2641
202 A A 0.0883
203 P A -0.1315
204 S A -0.1984
205 P A -0.2652
206 C A -0.1641
207 R A -0.3355
208 N A -0.6422
209 G A -0.6717
210 G A -0.5317
211 T A -0.0776
212 C A -0.0054
213 R A -2.2145
214 Q A -1.5345
215 S A -0.4277
216 G A -0.8385
217 D A -1.7261
218 L A 0.4886
219 T A 0.1262
220 Y A -0.1962
221 D A -1.9242
222 C A -0.2129
223 A A 0.0320
224 C A 0.0000
225 L A 1.7055
226 P A 0.1131
227 G A -0.1058
228 F A 1.8784
229 E A -0.5624
230 G A -0.8577
231 Q A -1.5316
232 N A -1.4814
233 C A -0.4636
234 E A -1.3438
235 V A -0.1330
236 N A 0.0000
237 V A 0.0175
238 D A -1.4218
239 D A -2.0045
240 C A 0.0000
241 P A -0.1480
242 G A -0.3643
243 H A -0.9414
244 R A -1.9238
245 C A 0.0620
246 L A 1.3301
247 N A -1.0519
248 G A -0.7427
249 G A -0.2957
250 T A -0.0432
251 C A 0.4741
252 V A 0.9295
253 D A -0.2201
254 G A 0.1454
255 V A 1.6830
256 N A -0.0279
257 T A -0.0897
258 Y A 0.0000
259 N A -0.3761
260 C A 0.0000
261 Q A -1.2539
262 C A 0.0000
263 P A -0.1320
264 P A -0.2498
265 E A 0.0000
266 W A 0.0982
267 T A -0.0445
268 G A -0.6130
269 Q A -0.3460
270 F A 0.2346
271 C A 0.0000
272 T A -0.0842
273 E A -0.6616
274 D A -1.5465
275 V A 1.2318
276 D A -0.3294
277 E A -0.9413
278 C A 0.0000
279 Q A -0.9091
280 L A 1.2680
281 Q A -0.0671
282 P A -0.3864
283 N A -0.4270
284 A A 0.0112
285 C A 0.0195
286 H A -1.2410
287 N A -1.5335
288 G A -0.8110
289 G A -0.4138
290 T A -0.0950
291 C A 0.6287
292 F A 1.9367
293 N A -0.0191
294 T A 0.1984
295 L A 1.5063
296 G A 0.0955
297 G A -0.2984
298 H A -0.9575
299 S A -0.2246
300 C A 0.4571
301 V A 0.6936
302 C A 0.8638
303 V A 0.3784
304 N A -0.6292
305 G A -0.6509
306 W A -0.0188
307 T A -0.0883
308 G A -0.7332
309 E A -1.9469
310 S A -0.4176
311 C A 0.6138
312 S A -0.1706
313 Q A -1.0266
314 N A -0.3845
315 I A 1.8491
316 D A 0.0441
317 D A -0.3116
318 C A 0.1580
319 A A 0.0000
320 T A -0.0645
321 A A 0.0173
322 V A 0.0000
323 C A 0.0000
324 F A 0.0000
325 H A 0.0000
326 G A -0.0781
327 A A -0.0012
328 T A -0.0296
329 C A 0.0000
330 H A -0.8180
331 D A -2.2337
332 R A -1.8489
333 V A 1.4412
334 A A 0.3941
335 S A -0.0327
336 F A 0.0000
337 Y A 0.3679
338 C A 0.0000
339 A A 0.0365
340 C A 0.0959
341 P A 0.0000
342 M A 0.5717
343 G A -0.2732
344 K A -0.4171
345 T A -0.1622
346 G A -0.4678
347 L A 0.0000
348 L A 0.2157
349 C A 0.1226
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 0.9770
357 S A 0.0538
358 N A -0.5728
359 P A -0.3542
360 C A 0.0000
361 H A -0.4041
362 E A 0.0000
363 D A 0.0000
364 A A 0.0000
365 I A 0.0000
366 C A 0.0000
367 D A -0.1894
368 T A 0.0000
369 N A 0.0000
370 P A -0.0596
371 V A 0.0000
372 N A 0.0000
373 G A 0.0000
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 0.0000
381 P A -0.0472
382 G A -0.0293
383 F A 0.3365
384 T A 0.0195
385 G A 0.0000
386 G A -0.3151
387 A A 0.1276
388 C A 0.4826
389 D A -1.4687
390 Q A -1.4508
391 D A 0.0000
392 V A 1.1267
393 D A 0.0000
394 E A -0.4648
395 C A 0.0000
396 S A -0.0261
397 I A 0.0000
398 G A 0.0000
399 A A 0.0585
400 N A 0.0000
401 P A -0.1371
402 C A 0.0000
403 E A -1.0485
404 H A -0.7323
405 L A 0.0534
406 G A -0.5144
407 R A -1.8831
408 C A 0.0000
409 V A 0.0000
410 N A 0.0000
411 T A 0.0000
412 Q A -0.2162
413 G A 0.0000
414 S A 0.0000
415 F A 0.0000
416 L A 0.0000
417 C A 0.0000
418 Q A -0.1856
419 C A 0.0000
420 G A -0.5166
421 R A -1.8611
422 G A 0.0000
423 Y A -0.1378
424 T A 0.0000
425 G A 0.0000
426 P A 0.0000
427 R A 0.0000
428 C A 0.0000
429 E A 0.0000
430 T A -0.0626
431 D A 0.0000
432 V A 0.7783
433 N A 0.0000
434 E A 0.0000
435 C A 0.0000
436 L A 1.1347
437 S A -0.0519
438 G A -0.3816
439 P A -0.1858
440 C A -0.0440
441 R A -0.7304
442 N A -0.5136
443 Q A -0.3562
444 A A 0.0000
445 T A -0.0099
446 C A 0.0000
447 L A 1.4760
448 D A -0.2891
449 R A -0.9075
450 I A 0.8408
451 G A 0.0166
452 Q A -0.2982
453 F A 0.0000
454 T A 0.1179
455 C A 0.0000
456 I A 1.2125
457 C A 0.0000
458 M A 0.1958
459 A A 0.0876
460 G A -0.0820
461 F A 0.0000
462 T A -0.1710
463 G A -0.0380
464 T A 0.1346
465 Y A 1.2408
466 C A 0.0000
467 E A -1.0304
468 V A 0.0494
469 D A 0.1583
470 I A 1.7926
471 D A -0.8466
472 E A -0.2990
473 C A 0.4528
474 Q A -1.0736
475 S A -0.2763
476 S A 0.0000
477 P A -0.0770
478 C A 0.4025
479 V A 1.7262
480 N A -0.0687
481 G A -0.5942
482 G A -0.1720
483 V A 1.3834
484 C A 0.0459
485 K A -1.9587
486 D A -2.1658
487 R A -2.0345
488 V A 0.4497
489 N A 0.0000
490 G A 0.0000
491 F A 0.0000
492 S A -0.0392
493 C A 0.0000
494 T A -0.0124
495 C A 0.0000
496 P A -0.0874
497 S A -0.2244
498 G A 0.0000
499 F A 0.0000
500 S A 0.0000
501 G A 0.0000
502 S A -0.0355
503 T A -0.0188
504 C A 0.0000
505 Q A 0.0000
506 L A 0.0420
507 D A -0.5649
508 V A 0.0000
509 D A 0.0000
510 E A -0.1907
511 C A 0.0500
512 A A 0.0591
513 S A -0.0684
514 T A -0.0841
515 P A -0.2362
516 C A -0.2816
517 R A -2.0562
518 N A -1.7050
519 G A -0.7051
520 A A -0.3733
521 K A -1.6655
522 C A 0.0544
523 V A 0.8133
524 D A -0.6807
525 Q A -0.9991
526 P A -0.5919
527 D A -1.0347
528 G A -0.1450
529 Y A 0.9095
530 E A -0.6685
531 C A -0.3031
532 R A -1.7496
533 C A -0.0424
534 A A -0.0090
535 E A -0.7291
536 G A -0.3931
537 F A 0.3537
538 E A -1.7073
539 G A -0.8152
540 T A 0.1494
541 L A 1.3544
542 C A 0.0000
543 D A -0.8023
544 R A -2.1017
545 N A -1.0951
546 V A 1.1865
547 D A -1.7900
548 D A -2.0233
549 C A 0.1861
550 S A -0.1129
551 P A -0.3960
552 D A -0.6852
553 P A -0.3911
554 C A -0.1578
555 H A -1.1634
556 H A -1.2664
557 G A -0.9803
558 R A -1.8894
559 C A -0.0266
560 V A 0.4734
561 D A -0.3545
562 G A -0.1524
563 I A 1.9315
564 A A 0.3888
565 S A -0.1640
566 F A 0.1165
567 S A -0.0302
568 C A 0.0000
569 A A 0.0307
570 C A 0.0549
571 A A 0.0001
572 P A -0.3229
573 G A -0.4439
574 Y A 0.2560
575 T A -0.0205
576 G A -0.0865
577 T A -0.4435
578 R A -1.7915
579 C A -0.2090
580 E A -0.9037
581 S A -0.4111
582 Q A -0.5215
583 V A 0.3440
584 D A -0.7325
585 E A -0.9753
586 C A 0.0000
587 R A -1.9121
588 S A -0.6069
589 Q A -0.5386
590 P A -0.2148
591 C A -0.0049
592 R A -0.7819
593 H A -0.8654
594 G A -0.6235
595 G A -0.6232
596 K A -1.3137
597 C A 0.1843
598 L A 1.0608
599 D A -0.4597
600 L A 0.8869
601 V A 1.5997
602 D A -1.7604
603 K A -1.7535
604 Y A 0.4317
605 L A 0.9360
606 C A -0.0491
607 R A -1.7982
608 C A -0.2834
609 P A -0.1256
610 S A 0.0000
611 G A -0.3447
612 T A -0.1145
613 T A -0.0658
614 G A 0.0129
615 V A 1.4553
616 N A -0.9433
617 C A 0.0000
618 E A -1.4259
619 V A -0.2451
620 N A -0.5982
621 I A 1.2502
622 D A -1.2395
623 D A -0.6122
624 C A 0.6515
625 A A 0.1586
626 S A -0.2235
627 N A -0.3373
628 P A -0.2828
629 C A 0.0599
630 T A 0.3762
631 F A 1.8492
632 G A 0.1874
633 V A 1.4208
634 C A 0.2315
635 R A -1.9928
636 D A -0.8833
637 G A -0.3414
638 I A 0.0506
639 N A -1.5712
640 R A -1.8555
641 Y A 0.7227
642 D A -0.8385
643 C A 0.0240
644 V A 0.3651
645 C A 0.0000
646 Q A -1.2258
647 P A -0.5998
648 G A -0.1861
649 F A 0.1474
650 T A -0.0067
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1954 A A 0.0000
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1974 T A 0.0000
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1977 F A 0.2120
1978 L A 0.0000
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1982 E A -1.7756
1983 G A 0.0000
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1986 E A -0.9883
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1990 L A -0.0778
1991 L A 0.0000
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1994 H A -0.6198
1995 F A 0.0000
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1997 N A -0.2370
1998 R A 0.0000
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2000 I A 0.5037
2001 T A 0.0628
2002 D A 0.0000
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2006 R A -2.1180
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2008 P A 0.0000
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2010 D A -1.5994
2011 V A 0.0000
2012 A A 0.0000
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2014 E A -2.4082
2015 R A -2.0379
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2018 Q A -1.5727
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2279 A A 0.2273
2280 M A 1.0760
2281 A A 0.2606
2282 T A -0.0200
2283 T A -0.0856
2284 T A -0.1706
2285 G A -0.4684
2286 A A 0.2690
2287 L A 1.5590
2288 P A 0.0000
2289 A A -0.0016
2290 Q A -0.2806
2291 P A -0.2498
2292 L A 0.1949
2293 P A 0.0788
2294 L A 1.4402
2295 S A 0.5827
2296 V A 1.7624
2297 P A 0.2753
2298 S A -0.1843
2299 S A 0.0000
2300 L A 0.0000
2301 A A -0.0374
2302 Q A -0.2373
2303 A A 0.0000
2304 Q A -1.2004
2305 T A -0.4018
2306 Q A -0.8297
2307 L A 0.0159
2308 G A -0.0682
2309 P A 0.0000
2310 Q A -1.2045
2311 P A -0.6077
2312 E A -1.7719
2313 V A -0.0719
2314 T A -0.3188
2315 P A -0.5937
2316 K A -2.1094
2317 R A -2.3416
2318 Q A -1.1150
2319 V A 0.5461
2320 L A 0.3231
2321 A A 0.0000
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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, -0.2076 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_2 -0.2076 View CSV PDB
model_4 -0.2259 View CSV PDB
model_0 -0.2261 View CSV PDB
model_6 -0.2288 View CSV PDB
model_1 -0.229 View CSV PDB
model_8 -0.2312 View CSV PDB
model_7 -0.2359 View CSV PDB
model_3 -0.236 View CSV PDB
CABS_average -0.2365 View CSV PDB
model_5 -0.2492 View CSV PDB
model_11 -0.2532 View CSV PDB
model_10 -0.256 View CSV PDB
model_9 -0.2587 View CSV PDB
input -0.2788 View CSV PDB