Project name: R427C_4D

Status: done

Started: 2026-05-09 14:22:50
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPCCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                          (00:00:12)
[INFO]       CABS:     Running CABS flex simulation                                                (00:24:07)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (13:16:54)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (13:17:38)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (13:18:23)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (13:19:08)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (13:19:54)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (13:20:39)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (13:21:25)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (13:22:10)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (13:22:55)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (13:23:40)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (13:24:25)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (13:25:10)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (13:25:56)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (13:27:24)
[INFO]       Main:     Simulation completed successfully.                                          (13:28:08)
Show buried residues

Minimal score value
-4.59
Maximal score value
5.4123
Average score
-0.4805
Total score value
-1115.2793

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 0.2058
2 G A -0.5172
3 P A -0.6744
4 G A -0.5879
5 A A -0.6848
6 R A -1.3184
7 G A -1.8708
8 R A -3.0049
9 R A -2.8202
10 R A -3.6214
11 R A -3.5631
12 R A -2.9876
13 R A -1.7766
14 P A -1.1597
15 M A -0.5140
16 S A -0.4450
17 P A -0.4886
18 P A -0.2323
19 P A -0.3969
20 P A -0.6625
21 P A -0.3677
22 P A -0.1955
23 P A 0.1192
24 V A 0.8219
25 R A -0.9035
26 A A -0.3621
27 L A 0.0000
28 P A -0.3062
29 L A 0.0000
30 L A 1.6307
31 L A 0.0000
32 L A 0.8652
33 L A 1.5754
34 A A 0.2912
35 G A -0.7220
36 P A -0.8426
37 G A -0.7486
38 A A -0.4381
39 A A -0.5104
40 A A 0.0000
41 P A -0.2868
42 P A -0.4486
43 C A -0.5885
44 L A -1.3270
45 D A -2.3582
46 G A -1.4754
47 S A -0.8867
48 P A -1.1741
49 C A 0.0000
50 A A -0.9827
51 N A -1.5908
52 G A 0.0000
53 G A 0.0000
54 R A -0.4916
55 C A 0.0000
56 T A 0.0000
57 Q A 0.0000
58 L A -0.6756
59 P A -0.5721
60 S A -0.7953
61 R A -1.0322
62 E A -0.6156
63 A A 0.0000
64 A A 0.0000
65 C A 0.0000
66 L A 0.4353
67 C A 0.0000
68 P A -0.6126
69 P A -0.9658
70 G A -1.4378
71 W A -1.3952
72 V A 0.0000
73 G A 0.0000
74 E A -1.4523
75 R A -2.7739
76 C A 0.0000
77 Q A -1.8205
78 L A 0.0000
79 E A -2.7139
80 D A -2.6262
81 P A -1.3654
82 C A -0.4299
83 H A -0.1556
84 S A -0.2711
85 G A -0.4651
86 P A -0.2038
87 C A -0.4145
88 A A -0.9846
89 G A -1.6923
90 R A -2.8930
91 G A -2.4744
92 V A 0.0000
93 C A -1.9439
94 Q A -1.5442
95 S A 0.0000
96 S A 0.0000
97 V A 0.0000
98 V A -0.6660
99 A A -1.5344
100 G A -1.2132
101 T A -0.9751
102 A A -1.0581
103 R A 0.0000
104 F A 0.0000
105 S A -0.9135
106 C A 0.0000
107 R A -2.3555
108 C A 0.0000
109 P A 0.0000
110 R A -1.6678
111 G A 0.0000
112 F A 0.0000
113 R A 0.0000
114 G A 0.0000
115 P A -1.3882
116 D A 0.0000
117 C A 0.0000
118 S A -0.4287
119 L A 0.4100
120 P A -0.9049
121 D A 0.0000
122 P A 0.0000
123 C A 0.0000
124 L A 1.0056
125 S A 0.5428
126 S A -0.0488
127 P A -0.1039
128 C A 0.0000
129 A A -0.3325
130 H A 0.0000
131 G A -0.2587
132 A A 0.0000
133 R A -2.1586
134 C A 0.0000
135 S A -1.2143
136 V A 0.0000
137 G A 0.0000
138 P A -1.7024
139 D A -2.6183
140 G A -1.7600
141 R A -1.7775
142 F A 0.0000
143 L A 0.6982
144 C A 0.0000
145 S A -0.6471
146 C A 0.0000
147 P A -0.6587
148 P A -0.3124
149 G A -0.0938
150 Y A -0.3200
151 Q A -1.4695
152 G A -1.6049
153 R A -1.9456
154 S A 0.0000
155 C A 0.0000
156 R A 0.0000
157 S A -0.6811
158 D A 0.0000
159 V A 0.0992
160 D A -1.3417
161 E A -1.0440
162 C A -0.5864
163 R A -1.4811
164 V A -0.0194
165 G A -0.4249
166 E A 0.0000
167 P A -0.9895
168 C A -1.5183
169 R A -2.5856
170 H A -2.0629
171 G A -1.6153
172 G A -1.4594
173 T A -0.4224
174 C A -0.1942
175 L A -0.1648
176 N A -1.2999
177 T A -0.7188
178 P A -0.5852
179 G A -0.2763
180 S A 0.0000
181 F A 0.0000
182 R A -0.6776
183 C A 0.0000
184 Q A -0.2089
185 C A 0.0000
186 P A -0.2133
187 A A -0.5108
188 G A -0.3377
189 Y A -0.0432
190 T A 0.0000
191 G A 0.0000
192 P A 0.0000
193 L A 1.0098
194 C A -0.2333
195 E A -1.6083
196 N A -0.8541
197 P A -0.3174
198 A A 0.3132
199 V A 0.9139
200 P A 0.5048
201 C A 0.4067
202 A A 0.0842
203 P A -0.4841
204 S A 0.0000
205 P A -0.5506
206 C A 0.0000
207 R A -0.5416
208 N A -0.3479
209 G A -0.7289
210 G A -0.9793
211 T A 0.0000
212 C A -1.5009
213 R A -2.1929
214 Q A -2.2318
215 S A -1.8116
216 G A -1.6047
217 D A -1.9392
218 L A -1.0826
219 T A -0.9904
220 Y A -0.9083
221 D A -1.2013
222 C A -0.7572
223 A A -0.0053
224 C A 0.7310
225 L A 1.3673
226 P A 0.5717
227 G A 0.5218
228 F A 1.0425
229 E A -0.7478
230 G A -1.2220
231 Q A -1.9515
232 N A -1.9776
233 C A -0.7785
234 E A -1.0954
235 V A -0.1146
236 N A 0.0000
237 V A -0.1604
238 D A -1.3031
239 D A 0.0000
240 C A -1.0017
241 P A -1.0502
242 G A -1.3418
243 H A -1.7411
244 R A -2.1755
245 C A -0.7921
246 L A 0.3411
247 N A -0.4314
248 G A -0.5041
249 G A -0.5464
250 T A -1.2501
251 C A -1.3184
252 V A -0.8393
253 D A 0.0000
254 G A -0.0245
255 V A 1.0337
256 N A -0.0619
257 T A -0.0440
258 Y A 0.0000
259 N A -1.7498
260 C A 0.0000
261 Q A -1.2914
262 C A 0.0000
263 P A -0.5259
264 P A -0.8632
265 E A -1.0273
266 W A -0.6462
267 T A -0.8092
268 G A -1.2615
269 Q A -1.5130
270 F A -0.6102
271 C A -0.7742
272 T A -0.5288
273 E A -1.2164
274 D A -1.9191
275 V A -0.6650
276 D A -1.0894
277 E A -1.1148
278 C A 0.0000
279 Q A -0.8408
280 L A -0.0013
281 Q A -1.0403
282 P A -0.7041
283 N A -0.5910
284 A A -0.6046
285 C A 0.0000
286 H A -0.7686
287 N A -0.9469
288 G A -0.3624
289 G A -0.0583
290 T A 0.5075
291 C A 0.5176
292 F A 1.3613
293 N A -0.1991
294 T A 0.2390
295 L A 0.8556
296 G A -0.3382
297 G A -0.4288
298 H A -0.5906
299 S A 0.1994
300 C A 0.0000
301 V A 1.3618
302 C A 0.0000
303 V A 0.8641
304 N A -0.3491
305 G A 0.0000
306 W A -0.0147
307 T A -0.2996
308 G A -0.8084
309 E A -1.8196
310 S A -1.0085
311 C A -0.4179
312 S A -0.6936
313 Q A -1.4177
314 N A -0.3536
315 I A 0.4161
316 D A -1.5250
317 D A 0.0000
318 C A 0.0000
319 A A -0.0634
320 T A 0.1264
321 A A 0.0000
322 V A 1.6994
323 C A 0.8928
324 F A 0.2362
325 H A -0.6975
326 G A -0.2520
327 A A 0.2570
328 T A 0.4095
329 C A -0.0439
330 H A -1.4318
331 D A -2.5576
332 R A -2.1005
333 V A -0.7549
334 A A -0.7288
335 S A 0.0000
336 F A 0.0000
337 Y A 0.0000
338 C A 0.0000
339 A A 0.1512
340 C A 0.0000
341 P A 0.0000
342 M A 0.0000
343 G A -0.8304
344 K A -1.1574
345 T A 0.0000
346 G A 0.0000
347 L A 0.0000
348 L A 0.0000
349 C A -0.0603
350 H A -0.8499
351 L A -0.9809
352 D A -1.9726
353 D A -2.4595
354 A A -1.5775
355 C A 0.0000
356 V A -0.3791
357 S A -0.5355
358 N A 0.0000
359 P A 0.8070
360 C A 0.0000
361 H A -0.0041
362 E A -1.5789
363 D A 0.0000
364 A A 0.0000
365 I A 0.0000
366 C A 0.0000
367 D A 0.0000
368 T A -0.6339
369 N A 0.0000
370 P A 0.0000
371 V A 0.0000
372 N A 0.0000
373 G A -1.2131
374 R A -1.9406
375 A A -0.8828
376 I A -0.1180
377 C A 0.0195
378 T A 0.0038
379 C A 0.0000
380 P A -0.6035
381 P A -0.7405
382 G A -1.1065
383 F A 0.0000
384 T A -1.2968
385 G A -1.0144
386 G A -0.7368
387 A A 0.0000
388 C A -1.0070
389 D A -2.4255
390 Q A -1.9107
391 D A -2.1433
392 V A -0.6691
393 D A -0.1764
394 E A 0.0000
395 C A 0.4922
396 S A 0.1136
397 I A 0.3147
398 G A 0.0000
399 A A 0.0000
400 N A -1.6264
401 P A -0.7970
402 C A 0.0000
403 E A -1.2349
404 H A -1.6720
405 L A 0.0000
406 G A -0.2658
407 R A 0.0000
408 C A 0.0000
409 V A 0.0000
410 N A 0.0000
411 T A 0.0000
412 Q A -0.9048
413 G A -0.7188
414 S A 0.0000
415 F A 0.7850
416 L A 0.0000
417 C A 0.0000
418 Q A 0.0000
419 C A 0.0000
420 G A -0.9878
421 R A -1.4445
422 G A 0.0000
423 Y A 0.0000
424 T A 0.0000
425 G A 0.0000
426 P A -0.1918
427 C A 0.2612
428 C A -0.4384
429 E A -1.6097
430 T A -0.8601
431 D A -0.5351
432 V A 0.5766
433 N A 0.0000
434 E A 0.0000
435 C A 0.0000
436 L A 0.9601
437 S A 0.4866
438 G A -0.1207
439 P A -0.3514
440 C A -0.1983
441 R A 0.0000
442 N A -0.8197
443 Q A -1.1428
444 A A -0.5752
445 T A 0.0000
446 C A 0.0000
447 L A 0.0000
448 D A 0.0000
449 R A -0.4078
450 I A -0.1832
451 G A -0.4782
452 Q A -0.3074
453 F A 0.0000
454 T A 0.2435
455 C A 0.0000
456 I A 0.7933
457 C A 0.0000
458 M A 1.2041
459 A A 0.4017
460 G A 0.8600
461 F A 2.1428
462 T A 1.0989
463 G A 0.0937
464 T A 0.1327
465 Y A 0.2542
466 C A 0.7308
467 E A 0.4041
468 V A 1.6586
469 D A 0.6745
470 I A 0.2082
471 D A -1.2947
472 E A -2.7174
473 C A 0.0000
474 Q A -2.0698
475 S A -1.2506
476 S A -0.6718
477 P A -0.1013
478 C A 0.1591
479 V A 0.1437
480 N A -1.2920
481 G A -0.7663
482 G A -0.2704
483 V A 0.4243
484 C A -0.7861
485 K A -1.8792
486 D A -2.4052
487 R A -2.2406
488 V A -0.1813
489 N A -1.3866
490 G A -1.2217
491 F A -0.9980
492 S A -0.7763
493 C A 0.0000
494 T A 0.0305
495 C A 0.1134
496 P A -0.2783
497 S A -0.8441
498 G A -0.9603
499 F A 0.1244
500 S A -0.5681
501 G A -0.7629
502 S A -0.6012
503 T A -0.2643
504 C A 0.0000
505 Q A -0.9576
506 L A -0.2341
507 D A -1.8544
508 V A -1.9426
509 D A -2.4207
510 E A -2.1548
511 C A 0.0000
512 A A -0.5553
513 S A -0.6102
514 T A -0.7689
515 P A -0.7982
516 C A -1.4167
517 R A -2.8980
518 N A -2.7017
519 G A -1.6615
520 A A -1.0270
521 K A -1.7409
522 C A -1.4056
523 V A -1.1162
524 D A -2.0847
525 Q A -2.6327
526 P A -2.2757
527 D A -3.1660
528 G A -1.9161
529 Y A -1.6010
530 E A -2.0194
531 C A 0.0000
532 R A -2.3082
533 C A -1.7757
534 A A -1.4212
535 E A -2.0489
536 G A -1.6260
537 F A -0.5711
538 E A -1.7855
539 G A -1.7943
540 T A -0.8571
541 L A -0.1740
542 C A -0.6665
543 D A -2.3525
544 R A 0.0000
545 N A -2.2038
546 V A -1.5062
547 D A -2.4180
548 D A -2.3341
549 C A -0.7381
550 S A -0.5236
551 P A -0.6359
552 D A -1.7971
553 P A -1.6035
554 C A -1.6880
555 H A -2.5847
556 H A -2.1612
557 G A -1.1234
558 R A -1.6525
559 C A -0.2832
560 V A 0.3805
561 D A -0.5025
562 G A 0.3784
563 I A 1.9382
564 A A 1.1379
565 S A 0.7989
566 F A 1.8295
567 S A 0.7968
568 C A -0.0927
569 A A -0.0359
570 C A -0.0803
571 A A -0.1233
572 P A 0.2809
573 G A 0.0000
574 Y A 0.5067
575 T A 0.0000
576 G A -1.3593
577 T A -1.7517
578 R A -2.6423
579 C A -1.5631
580 E A -2.3487
581 S A -1.2824
582 Q A -1.3389
583 V A -0.3443
584 D A -1.1596
585 E A -2.0588
586 C A -1.4681
587 R A -2.8634
588 S A -1.8867
589 Q A -1.7632
590 P A -0.9964
591 C A -0.9411
592 R A -1.2169
593 H A -0.8416
594 G A -1.2935
595 G A -1.6951
596 K A -2.3592
597 C A -1.1579
598 L A -0.5968
599 D A -0.2847
600 L A 1.2407
601 V A 1.2917
602 D A -0.6578
603 K A -0.8319
604 Y A 0.0000
605 L A -0.7672
606 C A 0.0000
607 R A -2.0383
608 C A -1.1059
609 P A -0.9475
610 S A -0.9325
611 G A -0.3750
612 T A 0.3537
613 T A 0.1018
614 G A 0.0008
615 V A 0.3666
616 N A -0.7332
617 C A -0.7090
618 E A 0.0000
619 V A 0.5122
620 N A 0.0000
621 I A 1.2034
622 D A -0.0584
623 D A -1.3936
624 C A -0.7106
625 A A -0.4276
626 S A -0.7824
627 N A -0.7038
628 P A -0.3848
629 C A 0.0000
630 T A 1.2271
631 F A 2.4032
632 G A 1.2250
633 V A 1.2157
634 C A 0.0731
635 R A -1.8401
636 D A -1.6351
637 G A 0.0000
638 I A -0.0255
639 N A -1.7898
640 R A -2.5992
641 Y A 0.0000
642 D A -1.1099
643 C A 0.0000
644 V A 0.6213
645 C A 0.0000
646 Q A -1.0249
647 P A -0.6902
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2278 G A -0.4787
2279 A A -0.2548
2280 M A 0.0000
2281 A A -0.3655
2282 T A -0.5085
2283 T A -0.6015
2284 T A -0.4199
2285 G A -0.1475
2286 A A 0.4708
2287 L A 1.1332
2288 P A 0.3326
2289 A A -0.1762
2290 Q A -0.4008
2291 P A -0.5262
2292 L A -0.0038
2293 P A 0.1132
2294 L A 0.9463
2295 S A 0.1738
2296 V A 0.1233
2297 P A -0.1701
2298 S A -0.3467
2299 S A -1.1109
2300 L A 0.0000
2301 A A -1.8795
2302 Q A -2.0626
2303 A A -1.5567
2304 Q A -1.4796
2305 T A 0.0000
2306 Q A -1.0533
2307 L A 0.0000
2308 G A -0.9744
2309 P A -0.9747
2310 Q A 0.0000
2311 P A -1.5729
2312 E A -2.0042
2313 V A -0.9516
2314 T A -1.0841
2315 P A -1.5681
2316 K A -3.2494
2317 R A -3.4988
2318 Q A -2.1826
2319 V A -0.2127
2320 L A 1.4122
2321 A A 0.6679
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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, -0.4805 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 -0.4805 View CSV PDB
model_3 -0.4844 View CSV PDB
model_2 -0.4874 View CSV PDB
model_0 -0.4976 View CSV PDB
model_6 -0.498 View CSV PDB
model_1 -0.4985 View CSV PDB
model_8 -0.5052 View CSV PDB
CABS_average -0.5264 View CSV PDB
model_7 -0.5527 View CSV PDB
model_10 -0.5645 View CSV PDB
model_4 -0.5685 View CSV PDB
model_9 -0.5691 View CSV PDB
model_11 -0.6099 View CSV PDB
input -0.7561 View CSV PDB