Project name: R75P(O) [mutate: RP75A]

Status: done

Started: 2026-03-23 07:14:16
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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
Mutated residues RP75A
Energy difference between WT (input) and mutated protein (by FoldX) 4.41973 kcal/mol

CAUTION: Your mutation/s can destabilize the protein structure

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]       FoldX:    Building mutant model                                                       (00:16:42)
[INFO]       CABS:     Running CABS flex simulation                                                (00:17:10)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (10:48:53)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (10:49:36)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (10:50:20)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (10:51:05)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (10:51:50)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (10:52:35)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (10:53:20)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (10:54:05)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (10:54:49)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (10:55:32)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (10:56:16)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (10:57:00)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (10:57:43)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (10:59:09)
[INFO]       Main:     Simulation completed successfully.                                          (10:59:53)
Show buried residues

Minimal score value
-4.0521
Maximal score value
4.363
Average score
-0.5693
Total score value
-1321.3218

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 0.8808
2 G A -0.1924
3 P A -0.4667
4 G A -0.3314
5 A A -0.6800
6 R A -1.8428
7 G A -1.9241
8 R A -2.2730
9 R A -2.3672
10 R A -2.2821
11 R A -3.2377
12 R A 0.0000
13 R A -2.0237
14 P A -1.1687
15 M A 0.0693
16 S A -0.4583
17 P A -0.1521
18 P A 0.3351
19 P A 0.1908
20 P A 1.0255
21 P A 0.0000
22 P A 0.1144
23 P A 0.4437
24 V A 1.3431
25 R A -0.1809
26 A A 1.1659
27 L A 1.7979
28 P A 1.4218
29 L A 2.8141
30 L A 3.0767
31 L A 2.4809
32 L A 2.6159
33 L A 1.3256
34 A A 0.0708
35 G A 0.0000
36 P A 0.0000
37 G A 0.0000
38 A A -0.2134
39 A A 0.0000
40 A A 0.0000
41 P A 0.0000
42 P A -1.0227
43 C A 0.0000
44 L A -0.0835
45 D A -1.7382
46 G A -0.9381
47 S A -0.5297
48 P A -0.4039
49 C A -0.0263
50 A A -0.8099
51 N A -1.8366
52 G A -1.5865
53 G A -1.7923
54 R A -2.1937
55 C A -0.8701
56 T A -0.9730
57 Q A -1.7733
58 L A -1.1718
59 P A -1.1747
60 S A -1.4332
61 R A -1.7782
62 E A -2.2182
63 A A -1.3186
64 A A 0.0000
65 C A 0.0000
66 L A 0.0000
67 C A 0.0000
68 P A -1.5401
69 P A -1.2488
70 G A -1.2387
71 W A -0.8262
72 V A 0.0000
73 G A -0.7752
74 E A -1.4989
75 P A 0.0000 mutated: RP75A
76 C A -0.5518
77 Q A -0.0835
78 L A 0.3170
79 E A -1.5115
80 D A -1.5719
81 P A -1.2315
82 C A 0.0000
83 H A -1.8838
84 S A -1.0425
85 G A -0.9647
86 P A -1.0010
87 C A -0.5789
88 A A 0.0000
89 G A -1.3370
90 R A -2.4232
91 G A -1.8138
92 V A -1.6743
93 C A -1.3627
94 Q A -1.7662
95 S A -1.1861
96 S A -0.7641
97 V A -0.4464
98 V A -0.0390
99 A A -0.3517
100 G A -0.3722
101 T A -0.3304
102 A A -0.8399
103 R A -1.7183
104 F A -1.1231
105 S A -1.3002
106 C A 0.0000
107 R A -2.3775
108 C A 0.0000
109 P A -1.1254
110 R A -0.5659
111 G A 0.0926
112 F A -0.0009
113 R A -0.9968
114 G A -1.1310
115 P A -1.3914
116 D A -1.4055
117 C A -0.1329
118 S A -0.0371
119 L A 0.0477
120 P A 0.0020
121 D A 0.0000
122 P A 0.5192
123 C A 0.0000
124 L A 0.9772
125 S A 0.1489
126 S A 0.0748
127 P A -0.4672
128 C A 0.0000
129 A A -1.1301
130 H A -1.7464
131 G A -1.3765
132 A A -1.4659
133 R A -1.9244
134 C A 0.0000
135 S A 0.1755
136 V A 0.0000
137 G A 0.0000
138 P A -1.3027
139 D A -2.4100
140 G A -1.8305
141 R A -1.4083
142 F A 1.3169
143 L A 1.3680
144 C A -0.0197
145 S A -1.0023
146 C A -1.1470
147 P A -0.7555
148 P A -0.6427
149 G A -1.2986
150 Y A -1.6804
151 Q A -2.1331
152 G A -2.0074
153 R A -2.3210
154 S A -1.5120
155 C A -1.0393
156 R A -2.3562
157 S A -2.1754
158 D A -2.2785
159 V A -0.9317
160 D A -1.6998
161 E A -1.5762
162 C A -1.3506
163 R A -2.3072
164 V A -0.6295
165 G A -1.1957
166 E A -2.6069
167 P A -1.1681
168 C A -0.9424
169 R A -2.5382
170 H A -1.4766
171 G A -1.2211
172 G A -0.9400
173 T A -0.8961
174 C A -0.6698
175 L A 0.2969
176 N A -1.0427
177 T A -0.6918
178 P A -0.9440
179 G A -0.7822
180 S A -0.5656
181 F A -0.5128
182 R A -0.5329
183 C A 0.0000
184 Q A -0.7655
185 C A -0.5380
186 P A -0.2522
187 A A 0.0016
188 G A -0.1428
189 Y A 0.5078
190 T A -0.3646
191 G A -0.4075
192 P A -0.2957
193 L A 0.9762
194 C A 0.1728
195 E A -1.3793
196 N A -0.9907
197 P A -0.5530
198 A A -0.3008
199 V A 0.0000
200 P A -0.7249
201 C A 0.0000
202 A A -0.6106
203 P A -0.2325
204 S A -0.6606
205 P A -0.7676
206 C A -1.0029
207 R A -1.4921
208 N A -1.8910
209 G A -1.4471
210 G A -1.0525
211 T A -0.9984
212 C A -1.2264
213 R A -2.3283
214 Q A -1.8587
215 S A -1.0394
216 G A -1.2685
217 D A -1.3996
218 L A -0.0718
219 T A -0.6459
220 Y A 0.0000
221 D A -1.9232
222 C A 0.0000
223 A A -0.6965
224 C A -0.3453
225 L A 0.0000
226 P A -0.1927
227 G A -0.8185
228 F A -1.0049
229 E A -2.3997
230 G A -1.9500
231 Q A -2.2411
232 N A -1.9381
233 C A 0.0000
234 E A -1.9258
235 V A -1.0571
236 N A -1.3693
237 V A -0.7155
238 D A -1.9852
239 D A -2.4553
240 C A -1.6028
241 P A -1.4807
242 G A -1.5938
243 H A -1.8887
244 R A -2.0738
245 C A -1.2050
246 L A -0.5952
247 N A -1.6355
248 G A -1.4904
249 G A -1.3261
250 T A -0.7719
251 C A -0.8084
252 V A -0.4061
253 D A -1.5064
254 G A -0.2968
255 V A 0.7544
256 N A -0.6236
257 T A -0.1081
258 Y A 0.0000
259 N A -0.5229
260 C A 0.0000
261 Q A -1.2050
262 C A 0.0000
263 P A -1.1534
264 P A -0.8992
265 E A -1.1328
266 W A -1.0482
267 T A 0.0000
268 G A -1.3996
269 Q A -0.8359
270 F A 0.6143
271 C A -0.3873
272 T A -0.9117
273 E A -1.7531
274 D A -1.0043
275 V A -0.1026
276 D A -0.7371
277 E A -0.5106
278 C A 0.0000
279 Q A -0.4899
280 L A 0.4229
281 Q A -0.4994
282 P A -0.5629
283 N A -0.6647
284 A A -0.5117
285 C A 0.0000
286 H A -0.8943
287 N A -1.3809
288 G A -1.1067
289 G A -0.5337
290 T A 0.3107
291 C A 1.0925
292 F A 1.7677
293 N A 0.5678
294 T A 0.4825
295 L A 0.4822
296 G A -0.3870
297 G A -0.3872
298 H A 0.0000
299 S A 0.0606
300 C A 0.0000
301 V A 0.0655
302 C A 0.0000
303 V A 0.1608
304 N A 0.0399
305 G A -0.1626
306 W A -0.1205
307 T A -0.8421
308 G A -1.1922
309 E A -1.7256
310 S A -1.4608
311 C A 0.0000
312 S A 0.0000
313 Q A -0.9324
314 N A 0.0000
315 I A -0.4011
316 D A -1.4618
317 D A -0.8764
318 C A -0.4234
319 A A 0.4328
320 T A 0.6544
321 A A 1.1976
322 V A 1.5869
323 C A 0.0000
324 F A 0.2780
325 H A -0.7953
326 G A -0.6997
327 A A 0.0000
328 T A 0.0000
329 C A 0.0000
330 H A -0.3871
331 D A 0.0000
332 R A -1.1212
333 V A 0.1856
334 A A -0.2215
335 S A -0.3428
336 F A 0.3207
337 Y A 0.6696
338 C A 0.0000
339 A A 0.2295
340 C A 0.0000
341 P A -0.4261
342 M A -0.3039
343 G A -0.4061
344 K A -0.4135
345 T A 0.2102
346 G A 0.9054
347 L A 1.6818
348 L A 2.0122
349 C A 1.1094
350 H A 1.0057
351 L A 0.7803
352 D A -0.2898
353 D A -0.2087
354 A A -0.1792
355 C A 0.0000
356 V A 1.0922
357 S A 0.3545
358 N A 0.1496
359 P A -0.0818
360 C A -0.0065
361 H A -0.7741
362 E A -2.2313
363 D A -2.0293
364 A A -0.2703
365 I A 1.4621
366 C A 0.6135
367 D A -0.7784
368 T A 0.0000
369 N A -0.7915
370 P A -0.1946
371 V A 1.0098
372 N A -1.0092
373 G A -1.2492
374 R A -2.1951
375 A A 0.0000
376 I A -0.0653
377 C A 0.0000
378 T A 0.4918
379 C A 0.1042
380 P A -0.3482
381 P A -0.6201
382 G A -0.5965
383 F A 0.1595
384 T A 0.0000
385 G A -0.4038
386 G A -0.3858
387 A A 0.0000
388 C A 0.0000
389 D A -0.6838
390 Q A -0.5826
391 D A 0.0000
392 V A -0.2771
393 D A -1.5442
394 E A -0.3698
395 C A 0.9084
396 S A 0.6678
397 I A 1.8944
398 G A 0.3924
399 A A 0.3861
400 N A -0.7204
401 P A -0.7801
402 C A -0.8182
403 E A -1.0924
404 H A -0.8166
405 L A 0.6133
406 G A -0.6817
407 R A -1.8295
408 C A 0.1873
409 V A 0.0000
410 N A -1.1763
411 T A -1.3034
412 Q A -1.4720
413 G A -1.2070
414 S A -0.5551
415 F A 0.1115
416 L A 0.0000
417 C A 0.0000
418 Q A 0.0000
419 C A -0.8648
420 G A -0.8708
421 R A -1.4350
422 G A -1.0105
423 Y A -0.5169
424 T A -1.0849
425 G A 0.0000
426 P A 0.0000
427 R A -0.7654
428 C A 0.0000
429 E A 0.0000
430 T A -1.3349
431 D A -1.1730
432 V A -0.6985
433 N A -1.3117
434 E A -0.6576
435 C A 0.3650
436 L A 0.6654
437 S A 0.2465
438 G A -0.1390
439 P A 0.0000
440 C A -0.8995
441 R A -2.6870
442 N A -2.4723
443 Q A -1.1741
444 A A -0.1011
445 T A 0.7566
446 C A 0.0000
447 L A 0.0000
448 D A -0.2960
449 R A 0.0000
450 I A 1.0231
451 G A -0.3445
452 Q A -0.5256
453 F A 0.2597
454 T A 0.4946
455 C A 1.3418
456 I A 1.8720
457 C A 1.2125
458 M A 0.9938
459 A A 0.2499
460 G A 0.1373
461 F A 1.5429
462 T A 0.4512
463 G A -0.0114
464 T A 0.2471
465 Y A 0.9211
466 C A 0.0000
467 E A -1.1460
468 V A 0.0000
469 D A -1.7678
470 I A -1.2015
471 D A -2.3160
472 E A -2.2681
473 C A 0.0000
474 Q A -1.9459
475 S A -1.5761
476 S A -1.0186
477 P A -0.5900
478 C A -0.1902
479 V A 0.2210
480 N A -1.0874
481 G A -0.8905
482 G A -0.7696
483 V A -0.4710
484 C A 0.0000
485 K A -2.0306
486 D A -2.2636
487 R A -2.3613
488 V A -2.2048
489 N A -1.8932
490 G A -0.9485
491 F A 0.0485
492 S A -0.1638
493 C A -0.2507
494 T A 0.0014
495 C A -0.0226
496 P A -0.0179
497 S A -0.3839
498 G A -0.8019
499 F A -0.0626
500 S A -0.5409
501 G A -0.9118
502 S A -0.8234
503 T A -0.6295
504 C A -0.3657
505 Q A -0.8319
506 L A -0.6958
507 D A -2.0029
508 V A -1.7453
509 D A -2.4175
510 E A -2.7596
511 C A -1.2267
512 A A -0.5487
513 S A -0.3821
514 T A -0.1209
515 P A -0.6653
516 C A -1.3383
517 R A -2.3226
518 N A -2.4376
519 G A -1.8039
520 A A -1.6951
521 K A -1.5321
522 C A -0.4344
523 V A -0.5634
524 D A -1.8982
525 Q A -2.4588
526 P A -2.4899
527 D A -2.9547
528 G A -1.7492
529 Y A -0.7248
530 E A -1.4244
531 C A 0.0000
532 R A -1.9532
533 C A 0.0000
534 A A -1.5958
535 E A -1.9378
536 G A -2.0187
537 F A -1.7054
538 E A -2.5115
539 G A -1.4000
540 T A -0.7837
541 L A -0.4238
542 C A -0.9792
543 D A -2.2190
544 R A -2.2040
545 N A -2.0815
546 V A -1.1684
547 D A -2.6605
548 D A -2.3482
549 C A -1.6957
550 S A -1.5475
551 P A -1.4624
552 D A -1.8601
553 P A -1.7307
554 C A -1.9525
555 H A -2.2813
556 H A -2.1344
557 G A -1.7870
558 R A -1.9261
559 C A -1.1045
560 V A 0.0487
561 D A -1.2675
562 G A 0.0659
563 I A 1.5393
564 A A 0.4417
565 S A 0.1672
566 F A -0.5528
567 S A -0.7409
568 C A 0.0000
569 A A -1.3052
570 C A 0.0000
571 A A 0.0000
572 P A -0.4124
573 G A -0.4685
574 Y A -0.1892
575 T A -1.0337
576 G A -1.1414
577 T A -1.5596
578 R A -2.5182
579 C A 0.0000
580 E A -2.5716
581 S A -1.4298
582 Q A -1.3558
583 V A -0.6286
584 D A -2.3100
585 E A -2.6340
586 C A -1.3053
587 R A -2.1088
588 S A -1.7406
589 Q A -2.0870
590 P A -1.7390
591 C A 0.0000
592 R A -3.1442
593 H A -2.6596
594 G A -1.9219
595 G A -1.9926
596 K A -2.1924
597 C A -1.4196
598 L A -0.3249
599 D A -1.2651
600 L A -0.6307
601 V A -1.2551
602 D A -2.6681
603 K A -2.6805
604 Y A 0.0000
605 L A -0.7919
606 C A 0.0000
607 R A -2.6310
608 C A 0.0000
609 P A -1.2928
610 S A -1.0175
611 G A -0.9274
612 T A -0.6287
613 T A -1.1280
614 G A -1.2755
615 V A -0.7551
616 N A -1.3530
617 C A -1.3817
618 E A -1.2079
619 V A -0.8520
620 N A -0.5869
621 I A 0.0152
622 D A -2.3649
623 D A -2.9967
624 C A 0.0000
625 A A -1.0345
626 S A -1.3227
627 N A -1.6909
628 P A -0.9564
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1997 N A -2.0191
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2242 H A -1.6310
2243 P A -0.7216
2244 Y A 0.0000
2245 L A 1.4130
2246 T A 0.5884
2247 P A -0.0007
2248 S A 0.0000
2249 P A -0.7717
2250 E A -1.2867
2251 S A -1.2733
2252 P A 0.0000
2253 E A 0.0000
2254 H A -0.7732
2255 W A 0.0380
2256 A A -0.1798
2257 S A -0.5818
2258 P A -0.2246
2259 S A -0.0990
2260 P A 0.2186
2261 P A 0.4868
2262 S A 0.6044
2263 L A 1.0636
2264 S A -0.1426
2265 D A -1.0474
2266 W A 0.2660
2267 S A -0.5332
2268 E A -0.9046
2269 S A -0.3813
2270 T A -0.2191
2271 P A 0.0394
2272 S A 0.1580
2273 P A 0.0010
2274 A A 0.1044
2275 T A -0.0755
2276 A A 0.1169
2277 T A -0.7066
2278 G A -0.8200
2279 A A -0.6303
2280 M A -0.8185
2281 A A -0.8233
2282 T A 0.0000
2283 T A -0.8543
2284 T A 0.0000
2285 G A -0.8039
2286 A A 0.0000
2287 L A 0.0000
2288 P A -0.6644
2289 A A -0.5978
2290 Q A -1.4324
2291 P A -1.1595
2292 L A -1.2876
2293 P A -0.7402
2294 L A -0.7739
2295 S A 0.2412
2296 V A 1.5133
2297 P A 0.6122
2298 S A 0.1497
2299 S A 0.7796
2300 L A 1.4976
2301 A A -0.0642
2302 Q A -1.0138
2303 A A 0.0000
2304 Q A -0.4857
2305 T A -1.0365
2306 Q A -1.3514
2307 L A -0.4644
2308 G A -0.4427
2309 P A 0.0783
2310 Q A -0.5255
2311 P A -0.8765
2312 E A 0.0000
2313 V A -0.4820
2314 T A -0.9145
2315 P A -0.7815
2316 K A -1.8902
2317 R A -1.4694
2318 Q A -1.1165
2319 V A -0.1431
2320 L A 0.4679
2321 A A 0.0328
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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, -0.5693 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_1 -0.5693 View CSV PDB
model_6 -0.5883 View CSV PDB
model_10 -0.5999 View CSV PDB
model_8 -0.6075 View CSV PDB
model_0 -0.6237 View CSV PDB
model_7 -0.6268 View CSV PDB
CABS_average -0.6272 View CSV PDB
model_4 -0.6359 View CSV PDB
model_3 -0.6469 View CSV PDB
model_11 -0.6525 View CSV PDB
model_2 -0.6528 View CSV PDB
model_9 -0.6599 View CSV PDB
model_5 -0.6629 View CSV PDB
input -0.7517 View CSV PDB