Project name: C484R_5_4D

Status: done

Started: 2026-05-19 00:22:04
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVRKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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                                                (00:28:19)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (14:30:39)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (14:31:17)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (14:31:56)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (14:32:35)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (14:33:15)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (14:33:55)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (14:34:35)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (14:35:16)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (14:35:56)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (14:36:34)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (14:37:13)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (14:37:52)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (14:38:30)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (14:39:48)
[INFO]       Main:     Simulation completed successfully.                                          (14:40:28)
Show buried residues

Minimal score value
-2.5469
Maximal score value
2.1702
Average score
-0.2266
Total score value
-525.8848

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 1.0069
2 G A -0.1267
3 P A -0.4199
4 G A -0.5032
5 A A -0.3817
6 R A -1.9216
7 G A -1.0158
8 R A -1.0597
9 R A -2.3102
10 R A -2.5469
11 R A -2.5468
12 R A -2.4615
13 R A -1.8212
14 P A -0.4012
15 M A 0.9931
16 S A 0.0824
17 P A -0.3100
18 P A -0.2747
19 P A -0.1055
20 P A -0.1721
21 P A 0.0000
22 P A -0.2980
23 P A -0.1695
24 V A 0.3193
25 R A -1.6979
26 A A -0.2491
27 L A 0.3488
28 P A 0.1580
29 L A 1.6390
30 L A 1.2147
31 L A 1.6530
32 L A 1.7966
33 L A 1.7873
34 A A 0.2186
35 G A -0.5124
36 P A -0.4332
37 G A -0.5121
38 A A -0.0697
39 A A 0.0333
40 A A -0.0502
41 P A -0.1849
42 P A 0.0000
43 C A 0.2389
44 L A 0.3687
45 D A -0.8250
46 G A -0.5782
47 S A -0.2014
48 P A -0.2160
49 C A 0.2352
50 A A -0.1295
51 N A -1.3512
52 G A -0.8005
53 G A -0.8839
54 R A -1.9097
55 C A -0.2198
56 T A -0.0330
57 Q A -0.0837
58 L A 0.2446
59 P A -0.0570
60 S A -0.5835
61 R A -2.2295
62 E A -2.1626
63 A A -0.2993
64 A A 0.0548
65 C A 0.4758
66 L A 1.6008
67 C A 0.3307
68 P A 0.0000
69 P A -0.2564
70 G A -0.0672
71 W A 0.0000
72 V A 0.5857
73 G A -0.2632
74 E A -0.8837
75 R A 0.0000
76 C A 0.0000
77 Q A 0.0000
78 L A -0.0369
79 E A -1.7956
80 D A -0.5197
81 P A 0.0000
82 C A 0.0000
83 H A -0.1748
84 S A -0.2544
85 G A -0.1974
86 P A -0.2651
87 C A 0.0000
88 A A 0.0000
89 G A -0.5866
90 R A -0.6369
91 G A -0.5531
92 V A 0.0000
93 C A 0.1062
94 Q A -0.1609
95 S A -0.0022
96 S A -0.0579
97 V A 0.0000
98 V A 0.0000
99 A A -0.0818
100 G A -0.4671
101 T A -0.0920
102 A A -0.0255
103 R A -0.1912
104 F A 0.4263
105 S A 0.0441
106 C A 0.0000
107 R A -0.6677
108 C A 0.0000
109 P A -0.3807
110 R A -1.9176
111 G A -0.7035
112 F A 0.0000
113 R A -1.1010
114 G A 0.0000
115 P A -0.5999
116 D A -1.8158
117 C A -0.2252
118 S A -0.0713
119 L A 0.0000
120 P A 0.0000
121 D A -0.2802
122 P A 0.0000
123 C A 0.0000
124 L A 1.2629
125 S A -0.0057
126 S A -0.2815
127 P A -0.0977
128 C A 0.4684
129 A A 0.0405
130 H A -0.6397
131 G A -0.5557
132 A A -0.4130
133 R A -1.8212
134 C A -0.2290
135 S A 0.1679
136 V A 1.7452
137 G A 0.2249
138 P A -0.4013
139 D A -1.8809
140 G A -0.9899
141 R A -1.1697
142 F A 0.5237
143 L A 1.6720
144 C A 0.6862
145 S A -0.0237
146 C A 0.0052
147 P A -0.2572
148 P A -0.2414
149 G A -0.0423
150 Y A 0.9624
151 Q A -1.0333
152 G A -1.0416
153 R A -1.9554
154 S A -0.5317
155 C A -0.0647
156 R A 0.0000
157 S A -0.1435
158 D A -0.2416
159 V A 1.1060
160 D A -0.3908
161 E A 0.0000
162 C A -0.2334
163 R A -1.5366
164 V A 1.4234
165 G A 0.0000
166 E A -1.3880
167 P A -0.6360
168 C A -0.3140
169 R A -2.0177
170 H A -1.4331
171 G A -0.7423
172 G A -0.5577
173 T A -0.0881
174 C A 0.3666
175 L A 1.3641
176 N A -0.1463
177 T A -0.1500
178 P A -0.1735
179 G A -0.3409
180 S A -0.1197
181 F A 0.0275
182 R A -0.7121
183 C A 0.0000
184 Q A -0.7362
185 C A -0.0811
186 P A -0.2230
187 A A -0.0763
188 G A -0.3939
189 Y A 0.2295
190 T A 0.0313
191 G A 0.0000
192 P A 0.0795
193 L A 1.2618
194 C A 0.6092
195 E A -1.9211
196 N A -1.6332
197 P A -0.5006
198 A A 0.0000
199 V A 1.0161
200 P A -0.0213
201 C A 0.0385
202 A A -0.0372
203 P A -0.2619
204 S A -0.1535
205 P A -0.1595
206 C A 0.0000
207 R A -2.1433
208 N A -1.7156
209 G A -1.0011
210 G A -0.5053
211 T A -0.0650
212 C A 0.0759
213 R A -2.0915
214 Q A -1.4924
215 S A -0.4753
216 G A -0.5682
217 D A -1.7221
218 L A 0.1969
219 T A 0.0915
220 Y A 0.4040
221 D A -0.9970
222 C A -0.0453
223 A A 0.0716
224 C A 0.2567
225 L A 0.4916
226 P A 0.0131
227 G A -0.2953
228 F A 1.4719
229 E A -1.5174
230 G A -0.9556
231 Q A -1.5104
232 N A -1.4978
233 C A 0.0000
234 E A -1.8010
235 V A 0.0000
236 N A -1.2533
237 V A 0.0000
238 D A -1.4620
239 D A -0.7205
240 C A -0.0319
241 P A -0.2592
242 G A -0.5493
243 H A -0.7409
244 R A -1.9013
245 C A 0.0000
246 L A 0.2341
247 N A -1.3361
248 G A -0.7976
249 G A -0.7191
250 T A -0.0523
251 C A 0.4274
252 V A 0.7168
253 D A 0.0000
254 G A -0.2572
255 V A 0.4952
256 N A -0.3627
257 T A 0.1074
258 Y A 1.0613
259 N A -0.9451
260 C A -0.0496
261 Q A -1.1205
262 C A 0.0000
263 P A -0.0811
264 P A -0.6075
265 E A -1.6391
266 W A 0.8304
267 T A 0.1141
268 G A -0.6973
269 Q A -0.9147
270 F A 1.7117
271 C A 0.0000
272 T A 0.0000
273 E A -0.7313
274 D A 0.0000
275 V A 1.1268
276 D A -0.2314
277 E A -0.5315
278 C A 0.0000
279 Q A -0.9041
280 L A 1.2065
281 Q A -0.3601
282 P A -0.4178
283 N A -0.2821
284 A A 0.0705
285 C A 0.1723
286 H A -0.9570
287 N A -1.4391
288 G A -0.2383
289 G A -0.4857
290 T A -0.1081
291 C A 0.6225
292 F A 1.9263
293 N A -0.0080
294 T A 0.1709
295 L A 1.3972
296 G A -0.1589
297 G A -0.2673
298 H A -0.5690
299 S A -0.2130
300 C A 0.3176
301 V A 1.1095
302 C A 0.0000
303 V A 1.6241
304 N A -0.2904
305 G A -0.2681
306 W A 0.1033
307 T A -0.1091
308 G A -0.8204
309 E A -1.9334
310 S A -0.2070
311 C A 0.5734
312 S A -0.1305
313 Q A -0.3598
314 N A -0.6587
315 I A 0.0000
316 D A -0.3922
317 D A -0.5972
318 C A 0.0000
319 A A 0.0451
320 T A -0.1110
321 A A 0.3358
322 V A 1.7996
323 C A 0.8527
324 F A 1.7801
325 H A -0.7147
326 G A -0.6539
327 A A 0.0000
328 T A -0.0329
329 C A -0.0652
330 H A -1.3093
331 D A -2.0204
332 R A -0.2322
333 V A 1.7449
334 A A 0.3446
335 S A 0.2416
336 F A 2.1702
337 Y A 1.6980
338 C A 0.3696
339 A A 0.0628
340 C A 0.0752
341 P A -0.1535
342 M A 0.2595
343 G A -0.5573
344 K A -1.1583
345 T A -0.1912
346 G A 0.1181
347 L A 1.4665
348 L A 0.5824
349 C A 0.0000
350 H A -0.3791
351 L A 0.9261
352 D A -0.4327
353 D A -1.9410
354 A A -0.1791
355 C A 0.7353
356 V A 0.0000
357 S A -0.2129
358 N A 0.0000
359 P A -0.3145
360 C A -0.1804
361 H A -1.2590
362 E A -2.3396
363 D A -2.1316
364 A A 0.0699
365 I A 2.0632
366 C A 0.3614
367 D A -1.3285
368 T A 0.0000
369 N A -0.3893
370 P A -0.1120
371 V A 0.4952
372 N A -0.9775
373 G A -1.0076
374 R A -1.9307
375 A A 0.0000
376 I A 0.4023
377 C A 0.0000
378 T A -0.0417
379 C A 0.0000
380 P A -0.2778
381 P A -0.2158
382 G A -0.3103
383 F A 1.8408
384 T A 0.2771
385 G A -0.1765
386 G A -0.2395
387 A A -0.0322
388 C A 0.0000
389 D A -0.7796
390 Q A 0.0000
391 D A -1.7654
392 V A -0.3084
393 D A -2.0595
394 E A -2.0080
395 C A 0.3476
396 S A 0.0886
397 I A 0.7545
398 G A -0.0595
399 A A -0.2560
400 N A -1.1498
401 P A -0.2422
402 C A 0.0000
403 E A -1.9595
404 H A -0.7853
405 L A 1.3514
406 G A -0.3366
407 R A -1.8377
408 C A 0.0492
409 V A 0.2939
410 N A -1.1715
411 T A -0.5101
412 Q A -1.2302
413 G A -0.3768
414 S A -0.0553
415 F A 0.1818
416 L A 0.5369
417 C A 0.0000
418 Q A -0.4183
419 C A 0.0000
420 G A -0.8192
421 R A -1.9496
422 G A -0.4428
423 Y A 0.0000
424 T A 0.0000
425 G A 0.0000
426 P A -0.2281
427 R A -1.7126
428 C A 0.3208
429 E A -0.1613
430 T A -0.0750
431 D A 0.0000
432 V A 0.5819
433 N A -0.2272
434 E A -0.4269
435 C A 0.5147
436 L A 1.2325
437 S A -0.0176
438 G A -0.5441
439 P A -0.3259
440 C A -0.2278
441 R A -1.6159
442 N A -1.5362
443 Q A 0.0000
444 A A 0.0417
445 T A -0.0013
446 C A 0.3821
447 L A 1.4278
448 D A -0.5044
449 R A -0.5397
450 I A 0.2659
451 G A -0.4603
452 Q A -0.5125
453 F A 0.1110
454 T A 0.0000
455 C A 0.0000
456 I A 0.6579
457 C A 0.0000
458 M A 0.8290
459 A A 0.1752
460 G A 0.0000
461 F A 0.0000
462 T A -0.0306
463 G A -0.1206
464 T A 0.1145
465 Y A 0.9299
466 C A 0.0000
467 E A -1.6720
468 V A 0.2039
469 D A -1.0194
470 I A 0.0000
471 D A -1.6123
472 E A 0.0000
473 C A 0.0000
474 Q A -1.1983
475 S A 0.0000
476 S A 0.0000
477 P A 0.0000
478 C A 0.0000
479 V A 0.0111
480 N A -1.2977
481 G A -0.6834
482 G A -0.3154
483 V A 0.0000
484 R A -2.0704
485 K A -1.6165
486 D A -1.0664
487 R A -1.7758
488 V A 0.2644
489 N A -1.1334
490 G A -0.3033
491 F A 0.1627
492 S A -0.1287
493 C A 0.0000
494 T A -0.0792
495 C A 0.0000
496 P A -0.2965
497 S A -0.3507
498 G A -0.4635
499 F A -0.1052
500 S A -0.1722
501 G A -0.5235
502 S A -0.2699
503 T A 0.0000
504 C A 0.0265
505 Q A -1.1461
506 L A -0.3876
507 D A -1.6356
508 V A 0.0997
509 D A -0.4842
510 E A -1.7920
511 C A 0.0503
512 A A 0.0683
513 S A -0.1881
514 T A -0.1122
515 P A 0.0869
516 C A 0.3590
517 R A -1.9433
518 N A -1.7163
519 G A -0.7095
520 A A -0.4042
521 K A -1.6575
522 C A 0.2585
523 V A 1.5148
524 D A -1.4149
525 Q A -1.5461
526 P A -0.5475
527 D A -0.4487
528 G A -0.2189
529 Y A -0.0974
530 E A -1.6750
531 C A -0.3616
532 R A -1.7214
533 C A -0.0193
534 A A -0.2237
535 E A -1.8966
536 G A -0.4579
537 F A 1.5936
538 E A -0.8904
539 G A -0.6734
540 T A 0.1620
541 L A 1.5815
542 C A 0.1506
543 D A -1.5743
544 R A -2.2363
545 N A -0.8634
546 V A 0.8641
547 D A -1.8674
548 D A -2.0789
549 C A -0.1363
550 S A -0.2157
551 P A -0.4328
552 D A -0.8232
553 P A -0.3703
554 C A -0.1146
555 H A -1.1596
556 H A -1.2713
557 G A -0.9944
558 R A -1.8216
559 C A 0.4339
560 V A 0.8625
561 D A -1.6302
562 G A -0.2200
563 I A 1.9659
564 A A 0.3622
565 S A 0.1555
566 F A 1.5633
567 S A 0.2598
568 C A 0.0692
569 A A 0.0548
570 C A 0.0143
571 A A -0.0055
572 P A -0.1820
573 G A -0.1257
574 Y A 1.1463
575 T A 0.1560
576 G A -0.1382
577 T A -0.3886
578 R A -1.8168
579 C A -0.2371
580 E A -0.2631
581 S A -0.3779
582 Q A -0.1864
583 V A 1.3130
584 D A -1.4319
585 E A -0.6895
586 C A 0.2892
587 R A -1.8315
588 S A -0.6817
589 Q A -1.1818
590 P A -0.4061
591 C A -0.2677
592 R A -1.8929
593 H A -0.7646
594 G A -0.3212
595 G A -0.7945
596 K A -1.7023
597 C A 0.3904
598 L A 1.5403
599 D A -0.3504
600 L A 0.4236
601 V A 0.1283
602 D A -1.9689
603 K A -1.8493
604 Y A -0.0807
605 L A 0.6781
606 C A 0.0000
607 R A -1.3631
608 C A 0.0000
609 P A -0.2800
610 S A -0.2300
611 G A -0.3653
612 T A -0.0813
613 T A -0.1325
614 G A -0.1924
615 V A 0.3859
616 N A -1.1005
617 C A 0.0375
618 E A 0.2983
619 V A 1.7386
620 N A 0.0000
621 I A 1.8781
622 D A -0.5070
623 D A -0.8207
624 C A 0.5799
625 A A 0.1143
626 S A -0.3468
627 N A -0.8186
628 P A -0.3579
629 C A 0.1424
630 T A 0.3415
631 F A 1.9064
632 G A 0.6283
633 V A 1.7969
634 C A 0.2331
635 R A -1.8436
636 D A -0.5560
637 G A 0.0000
638 I A 1.1846
639 N A -1.3515
640 R A -2.0480
641 Y A -0.3627
642 D A -0.8470
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1974 T A 0.0000
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1977 F A 0.0000
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1982 E A -0.4531
1983 G A -0.1457
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1990 L A -0.0646
1991 L A 0.0000
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1995 F A 0.0807
1996 A A 0.0480
1997 N A 0.0000
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1999 E A 0.0000
2000 I A 0.3876
2001 T A -0.0619
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2003 H A 0.0000
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2012 A A 0.0000
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2016 L A 0.8669
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2018 Q A -1.2690
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2269 S A -0.3530
2270 T A -0.1006
2271 P A -0.2628
2272 S A 0.0328
2273 P A -0.0993
2274 A A -0.0028
2275 T A -0.0642
2276 A A 0.0064
2277 T A -0.0908
2278 G A -0.4660
2279 A A -0.0392
2280 M A 0.2057
2281 A A 0.0400
2282 T A -0.0708
2283 T A -0.0302
2284 T A -0.0180
2285 G A 0.0000
2286 A A 0.1240
2287 L A 0.4188
2288 P A -0.1585
2289 A A -0.2538
2290 Q A -1.1208
2291 P A -0.1483
2292 L A 1.4601
2293 P A 0.1355
2294 L A 0.4999
2295 S A 0.3571
2296 V A 1.7046
2297 P A 0.0500
2298 S A -0.2926
2299 S A -0.2095
2300 L A 0.0000
2301 A A -0.1734
2302 Q A -1.1870
2303 A A 0.0000
2304 Q A -1.2017
2305 T A -0.3656
2306 Q A -0.3309
2307 L A 1.3789
2308 G A 0.0031
2309 P A -0.5328
2310 Q A -1.2711
2311 P A -0.4514
2312 E A -0.2003
2313 V A 1.5425
2314 T A 0.2527
2315 P A -0.3080
2316 K A -0.6556
2317 R A -2.1258
2318 Q A -1.2474
2319 V A 1.6854
2320 L A 1.0709
2321 A A 0.1964
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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, -0.2266 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 -0.2266 View CSV PDB
model_1 -0.2266 View CSV PDB
model_0 -0.2282 View CSV PDB
model_3 -0.2337 View CSV PDB
model_5 -0.2405 View CSV PDB
CABS_average -0.2435 View CSV PDB
model_10 -0.2439 View CSV PDB
model_9 -0.2477 View CSV PDB
model_7 -0.2496 View CSV PDB
model_6 -0.2527 View CSV PDB
model_8 -0.2532 View CSV PDB
model_4 -0.2556 View CSV PDB
model_11 -0.2632 View CSV PDB
input -0.2805 View CSV PDB