Project name: P1008S_5_4D

Status: done

Started: 2026-05-21 00:23:37
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQSCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimization                                          (00:00:02)
[INFO]       CABS:     Running CABS flex simulation                                                (00:37:24)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (20:35:05)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (20:36:15)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (20:37:15)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (20:38:11)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (20:39:11)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (20:40:08)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (20:41:05)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (20:42:04)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (20:43:04)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (20:43:58)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (20:44:56)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (20:45:53)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (20:46:51)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (20:48:50)
[INFO]       Main:     Simulation completed successfully.                                          (20:49:47)
Show buried residues

Minimal score value
-2.3523
Maximal score value
2.6711
Average score
-0.1925
Total score value
-446.7221

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 0.9640
2 G A -0.2964
3 P A -0.3455
4 G A -0.4867
5 A A -0.3853
6 R A -1.9206
7 G A -1.1574
8 R A -2.2446
9 R A -2.0521
10 R A -0.7440
11 R A -1.0658
12 R A -1.9032
13 R A -1.0999
14 P A -0.2373
15 M A 0.0000
16 S A -0.0498
17 P A -0.1039
18 P A -0.2684
19 P A -0.1223
20 P A -0.2034
21 P A -0.2963
22 P A -0.1683
23 P A 0.0651
24 V A 1.4546
25 R A -1.1012
26 A A -0.1308
27 L A 0.3679
28 P A -0.0651
29 L A 0.8807
30 L A 1.7194
31 L A 0.6014
32 L A 0.4575
33 L A 0.2855
34 A A 0.0000
35 G A -0.4742
36 P A -0.2210
37 G A -0.4700
38 A A -0.0606
39 A A 0.0639
40 A A 0.0008
41 P A -0.1412
42 P A -0.2579
43 C A 0.2260
44 L A 0.6704
45 D A -1.6870
46 G A -0.8508
47 S A -0.3105
48 P A -0.0856
49 C A 0.0000
50 A A 0.0342
51 N A 0.0000
52 G A 0.0000
53 G A 0.0000
54 R A 0.0000
55 C A 0.0000
56 T A -0.0166
57 Q A 0.0000
58 L A 0.2055
59 P A -0.1622
60 S A -0.6099
61 R A -2.2283
62 E A -2.1581
63 A A -0.3055
64 A A -0.0136
65 C A 0.0000
66 L A 0.0000
67 C A 0.0000
68 P A -0.0735
69 P A -0.0430
70 G A 0.0000
71 W A 0.1625
72 V A 0.2391
73 G A -0.3597
74 E A -2.1318
75 R A -1.9335
76 C A 0.0000
77 Q A -1.1654
78 L A -0.3388
79 E A -1.7391
80 D A 0.0000
81 P A -0.0827
82 C A -0.0034
83 H A -0.3038
84 S A -0.1740
85 G A -0.5226
86 P A -0.3202
87 C A 0.0977
88 A A -0.0427
89 G A -0.5063
90 R A -0.4335
91 G A -0.2281
92 V A 1.4303
93 C A 0.1635
94 Q A -1.1848
95 S A -0.0834
96 S A -0.2934
97 V A 0.8211
98 V A 1.5690
99 A A 0.2493
100 G A -0.4649
101 T A -0.1382
102 A A -0.2851
103 R A -1.4962
104 F A 1.5760
105 S A 0.3148
106 C A 0.0740
107 R A 0.0000
108 C A 0.4238
109 P A -0.4690
110 R A -1.8663
111 G A -0.5989
112 F A 0.7695
113 R A -0.2652
114 G A -0.1193
115 P A -0.3504
116 D A -0.3854
117 C A 0.4081
118 S A 0.0354
119 L A 0.5521
120 P A -0.1109
121 D A 0.0000
122 P A -0.1312
123 C A 0.8968
124 L A 1.6330
125 S A 0.0682
126 S A -0.1470
127 P A -0.1440
128 C A 0.1122
129 A A -0.1371
130 H A -1.0748
131 G A -0.6494
132 A A -0.4185
133 R A -1.7909
134 C A -0.1073
135 S A 0.0258
136 V A 0.3315
137 G A -0.1365
138 P A -0.5094
139 D A -1.8797
140 G A -0.6715
141 R A 0.0000
142 F A 1.7025
143 L A 1.8237
144 C A 0.3974
145 S A 0.0061
146 C A 0.2334
147 P A 0.0000
148 P A -0.3428
149 G A -0.4265
150 Y A 0.2910
151 Q A -0.3334
152 G A -0.8803
153 R A -1.9739
154 S A -0.4819
155 C A 0.0985
156 R A -1.5310
157 S A -0.3896
158 D A -0.1353
159 V A 0.5472
160 D A -0.6129
161 E A -0.7257
162 C A 0.0000
163 R A -1.8298
164 V A -0.2191
165 G A -0.6019
166 E A -1.0602
167 P A -0.4130
168 C A -0.2689
169 R A -1.8216
170 H A 0.0000
171 G A -0.5076
172 G A -0.3136
173 T A -0.0519
174 C A 0.2981
175 L A 0.2492
176 N A -1.0039
177 T A -0.2980
178 P A -0.3486
179 G A -0.5537
180 S A 0.0671
181 F A 1.5429
182 R A -1.3668
183 C A -0.3539
184 Q A -0.6823
185 C A -0.0034
186 P A -0.2092
187 A A -0.0371
188 G A -0.0367
189 Y A 0.0000
190 T A 0.0000
191 G A -0.1613
192 P A -0.0064
193 L A 1.4535
194 C A 0.0566
195 E A -1.7952
196 N A 0.0000
197 P A -0.2507
198 A A 0.3237
199 V A 1.6709
200 P A 0.3102
201 C A 0.1135
202 A A 0.0178
203 P A -0.1704
204 S A -0.2401
205 P A -0.2472
206 C A -0.2081
207 R A -2.0681
208 N A -1.7064
209 G A -0.7198
210 G A -0.6708
211 T A -0.0734
212 C A -0.1772
213 R A -1.9106
214 Q A -0.8528
215 S A -0.2497
216 G A -0.7961
217 D A -1.5510
218 L A 0.3540
219 T A 0.0602
220 Y A 0.1655
221 D A -0.6390
222 C A -0.0058
223 A A -0.1014
224 C A 0.0000
225 L A -0.0553
226 P A -0.0649
227 G A -0.1472
228 F A 1.7292
229 E A -0.3815
230 G A -0.4675
231 Q A -1.4551
232 N A -1.3871
233 C A 0.0130
234 E A -1.5884
235 V A 0.2118
236 N A 0.1539
237 V A 1.1198
238 D A -1.6769
239 D A -1.2546
240 C A 0.0000
241 P A -0.3434
242 G A -0.5671
243 H A -0.5567
244 R A -1.0582
245 C A -0.0304
246 L A 0.3031
247 N A -0.3769
248 G A -0.6117
249 G A -0.6013
250 T A -0.1424
251 C A 0.4379
252 V A 1.3459
253 D A -1.5260
254 G A -0.5258
255 V A -0.1152
256 N A -1.2925
257 T A -0.2419
258 Y A 0.0869
259 N A -1.1667
260 C A -0.2769
261 Q A -1.1309
262 C A -0.0628
263 P A -0.0496
264 P A 0.0000
265 E A -1.1094
266 W A 0.0000
267 T A 0.0000
268 G A -0.6128
269 Q A -0.3423
270 F A 1.2048
271 C A 0.0000
272 T A 0.0000
273 E A 0.0000
274 D A 0.0000
275 V A 0.0000
276 D A 0.0000
277 E A 0.0000
278 C A -0.1187
279 Q A -1.0558
280 L A 0.3264
281 Q A -0.4956
282 P A -0.3094
283 N A -0.2704
284 A A -0.0168
285 C A 0.0000
286 H A -0.5764
287 N A -0.4982
288 G A -0.3264
289 G A -0.3741
290 T A -0.0946
291 C A 0.4398
292 F A 1.5357
293 N A 0.0000
294 T A 0.0202
295 L A 0.2728
296 G A 0.0000
297 G A -0.0797
298 H A 0.0000
299 S A -0.0976
300 C A 0.0000
301 V A 0.3995
302 C A 0.0000
303 V A 0.5605
304 N A 0.0000
305 G A -0.0239
306 W A 0.8696
307 T A 0.0413
308 G A -0.4574
309 E A -0.7925
310 S A -0.3057
311 C A 0.0000
312 S A 0.0000
313 Q A -1.1692
314 N A 0.0000
315 I A 1.7933
316 D A -0.9250
317 D A -0.5684
318 C A 0.0000
319 A A -0.0304
320 T A -0.0365
321 A A 0.2921
322 V A 1.4367
323 C A 0.4901
324 F A 0.2265
325 H A -1.0065
326 G A -0.6563
327 A A -0.2033
328 T A 0.0156
329 C A 0.0778
330 H A -0.3060
331 D A 0.0000
332 R A 0.0000
333 V A 0.0000
334 A A 0.0000
335 S A 0.0000
336 F A 0.0000
337 Y A 0.1724
338 C A 0.0000
339 A A 0.0000
340 C A 0.0000
341 P A -0.1982
342 M A 0.0962
343 G A -0.5229
344 K A -0.4623
345 T A -0.0779
346 G A 0.0000
347 L A 0.0000
348 L A 0.0000
349 C A 0.2504
350 H A 0.0000
351 L A 0.0000
352 D A 0.0000
353 D A -0.2855
354 A A 0.0000
355 C A 0.0000
356 V A 0.6901
357 S A -0.3022
358 N A -1.3457
359 P A -0.4534
360 C A -0.1286
361 H A -1.3095
362 E A -2.3278
363 D A -2.1187
364 A A -0.2482
365 I A 1.0154
366 C A 0.5119
367 D A -0.1115
368 T A 0.0000
369 N A 0.0000
370 P A 0.0000
371 V A 1.3311
372 N A 0.0000
373 G A -0.4801
374 R A -0.5185
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 -0.0562
381 P A -0.0432
382 G A 0.0000
383 F A 0.0000
384 T A 0.0000
385 G A -0.0325
386 G A -0.0606
387 A A 0.0923
388 C A -0.0554
389 D A -1.8441
390 Q A -1.1813
391 D A -1.5316
392 V A 0.0000
393 D A -1.7253
394 E A 0.0000
395 C A 0.0699
396 S A -0.0926
397 I A 0.0000
398 G A 0.0000
399 A A -0.0057
400 N A -0.2132
401 P A -0.1670
402 C A -0.2968
403 E A -1.9917
404 H A -1.2367
405 L A 0.2603
406 G A -0.7177
407 R A -1.8536
408 C A 0.2565
409 V A 0.9863
410 N A -0.0887
411 T A -0.1324
412 Q A -0.2334
413 G A -0.1382
414 S A -0.0672
415 F A 0.0000
416 L A 0.2855
417 C A 0.0000
418 Q A -0.5600
419 C A 0.0000
420 G A -0.3937
421 R A -1.3309
422 G A -0.4532
423 Y A 1.2223
424 T A 0.1601
425 G A -0.3436
426 P A -0.5087
427 R A -1.8391
428 C A -0.2892
429 E A -0.3545
430 T A 0.0000
431 D A -0.2920
432 V A 1.4070
433 N A -1.0909
434 E A -0.9576
435 C A 0.6448
436 L A 1.6249
437 S A 0.1980
438 G A 0.0000
439 P A -0.0515
440 C A 0.0000
441 R A -1.9157
442 N A -1.6467
443 Q A -0.7781
444 A A -0.2639
445 T A 0.0052
446 C A 0.2503
447 L A 0.6074
448 D A -1.2093
449 R A -1.7650
450 I A 1.5715
451 G A -0.2880
452 Q A -1.2894
453 F A 0.0390
454 T A 0.0326
455 C A 0.0000
456 I A 0.5803
457 C A 0.0000
458 M A 0.1125
459 A A -0.0396
460 G A -0.3087
461 F A -0.0024
462 T A -0.0252
463 G A -0.2178
464 T A 0.0627
465 Y A 0.7827
466 C A 0.0000
467 E A -0.8228
468 V A -0.1232
469 D A -1.5718
470 I A -0.0938
471 D A -1.7783
472 E A -1.0058
473 C A 0.0000
474 Q A -1.3073
475 S A -0.4565
476 S A -0.1312
477 P A -0.2361
478 C A 0.4271
479 V A 1.6646
480 N A -0.4772
481 G A -0.6211
482 G A -0.1867
483 V A 0.5142
484 C A 0.1241
485 K A -1.3569
486 D A -1.2781
487 R A 0.0000
488 V A 0.0000
489 N A -0.1273
490 G A 0.0000
491 F A 0.4584
492 S A 0.0000
493 C A 0.0000
494 T A 0.0000
495 C A 0.0000
496 P A -0.1580
497 S A -0.2170
498 G A -0.3683
499 F A 0.1491
500 S A -0.1617
501 G A 0.0000
502 S A -0.2159
503 T A -0.0425
504 C A -0.1663
505 Q A -1.1395
506 L A -0.3551
507 D A -1.6917
508 V A -0.4160
509 D A -2.0830
510 E A -2.0789
511 C A -0.0036
512 A A 0.0979
513 S A -0.2132
514 T A -0.1494
515 P A -0.0664
516 C A 0.4124
517 R A -1.5552
518 N A -1.5824
519 G A -0.4231
520 A A -0.2900
521 K A -1.8519
522 C A 0.0468
523 V A 0.4085
524 D A -0.9344
525 Q A -1.4341
526 P A -0.8171
527 D A -1.8599
528 G A -0.5513
529 Y A -0.0867
530 E A -0.9897
531 C A -0.4248
532 R A -1.9408
533 C A -0.0072
534 A A -0.2267
535 E A -1.8837
536 G A -0.3735
537 F A 1.5561
538 E A -1.2734
539 G A -0.4391
540 T A 0.2083
541 L A 1.5552
542 C A 0.0501
543 D A -1.8055
544 R A -0.6858
545 N A -0.7108
546 V A -0.1745
547 D A -2.0749
548 D A -2.1331
549 C A 0.0000
550 S A -0.2392
551 P A -0.4921
552 D A -1.8578
553 P A -0.5898
554 C A -0.1103
555 H A -0.8914
556 H A -1.1331
557 G A -0.6224
558 R A -1.8412
559 C A -0.0151
560 V A 1.6164
561 D A -0.6391
562 G A -0.2474
563 I A 1.9265
564 A A 0.3850
565 S A -0.1206
566 F A 0.0000
567 S A -0.1284
568 C A 0.0000
569 A A -0.1790
570 C A 0.3692
571 A A 0.0404
572 P A -0.2334
573 G A 0.0455
574 Y A 1.2241
575 T A 0.0000
576 G A -0.4660
577 T A -0.2033
578 R A -0.4913
579 C A 0.0468
580 E A -0.7373
581 S A -0.4596
582 Q A -0.3313
583 V A 0.2777
584 D A -1.8170
585 E A -1.2164
586 C A -0.2925
587 R A -1.9309
588 S A -0.6147
589 Q A -0.4210
590 P A -0.3183
591 C A 0.0000
592 R A -1.9620
593 H A -0.8332
594 G A -0.6193
595 G A -0.9222
596 K A -0.6682
597 C A 0.5247
598 L A 1.4238
599 D A -0.5287
600 L A 0.5978
601 V A 1.5818
602 D A -1.7879
603 K A -2.0062
604 Y A 0.1023
605 L A 1.3047
606 C A 0.1970
607 R A -1.6586
608 C A 0.3568
609 P A 0.0049
610 S A -0.2945
611 G A -0.3604
612 T A -0.1196
613 T A -0.1606
614 G A -0.1468
615 V A 1.4493
616 N A -0.9445
617 C A 0.0000
618 E A 0.0000
619 V A 1.7728
620 N A 0.0000
621 I A 1.8837
622 D A -0.6970
623 D A -2.0537
624 C A -0.0352
625 A A 0.0467
626 S A -0.2014
627 N A 0.0000
628 P A -0.2020
629 C A 0.3641
630 T A 0.2613
631 F A 1.2168
632 G A 0.2431
633 V A 0.7488
634 C A 0.0804
635 R A -2.0936
636 D A -2.1672
637 G A -0.4779
638 I A 0.8752
639 N A -0.8418
640 R A -1.7236
641 Y A 0.7191
642 D A -1.0980
643 C A 0.0644
644 V A 1.1068
645 C A 0.2319
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1997 N A -1.6156
1998 R A -2.0820
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2279 A A -0.0589
2280 M A 0.0000
2281 A A 0.0451
2282 T A -0.0732
2283 T A -0.1428
2284 T A -0.1587
2285 G A -0.4816
2286 A A 0.0519
2287 L A 0.6184
2288 P A -0.1199
2289 A A -0.0539
2290 Q A -0.1846
2291 P A -0.1090
2292 L A 0.9077
2293 P A 0.0584
2294 L A 0.2203
2295 S A 0.1906
2296 V A 1.7240
2297 P A 0.2557
2298 S A -0.2297
2299 S A 0.2150
2300 L A 1.5428
2301 A A 0.2100
2302 Q A -0.5557
2303 A A -0.3163
2304 Q A -1.2166
2305 T A -0.4563
2306 Q A -1.0130
2307 L A 0.8812
2308 G A 0.0231
2309 P A -0.5009
2310 Q A -1.2830
2311 P A -0.7607
2312 E A -1.7897
2313 V A -0.0157
2314 T A 0.1981
2315 P A -0.3687
2316 K A -2.0534
2317 R A -2.1992
2318 Q A -0.2044
2319 V A 1.8386
2320 L A 1.0120
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, -0.1925 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 -0.1925 View CSV PDB
model_3 -0.1963 View CSV PDB
model_6 -0.197 View CSV PDB
model_2 -0.2009 View CSV PDB
model_4 -0.2032 View CSV PDB
model_7 -0.2065 View CSV PDB
model_8 -0.2076 View CSV PDB
CABS_average -0.2103 View CSV PDB
model_10 -0.2142 View CSV PDB
model_0 -0.2172 View CSV PDB
model_1 -0.2218 View CSV PDB
model_11 -0.2289 View CSV PDB
model_9 -0.2376 View CSV PDB
input -0.2787 View CSV PDB