Project name: 3ifq_modified_chains-AC.pdb_stat_DIBS

Status: done

submitted: 2018-04-18 14:33:36, status changed: 2018-04-20 13:32:54
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Chain sequence(s) A: AIVHLINYQDDAELATRALPELTKLLNDEDPVVVTKAAMIVNQLSKKEASRRALMGSPQLVAAVVRTMQNTSDLDTARCTTSILHNLSHHREGLLAIFKSGGIPALVRMLSSPVESVLFYAITTLHNLLLYQEGAKMAVRLADGLQKMVPLLNKNNPKFLAITTDCLQLLAYGNQESKLIILANGGPQALVQIMRNYSYEKLLWTTSRVLKVLSVCPSNKPAIVEAGGMQALGKHLTSNSPRLVQNCLWTLRNLSDVATKQEGLESVLKILVNQLSVDDVNVLTCATGTLSNLTCNNSKNKTLVTQNSGVEALIHAILRAGDKDDITEPAVCALRHLTSRHPEAEMAQNSVRLNYGIPAIVKLLNQPNQWPLVKATIGLIRNLALCPANHAPLQEAAVIPRLVQLLVKAHQDAQRHVAAGTQQPYTDGVRMEEIVEGCTGALHILARDPMNRMEIFRLNTIPLFVQLLYSSVENIQRVAAGVLCELAQDKEAADAIDAEGASAPLMELLHSRNEGTATYAAAVLFRISEDKNPRKRVSVELTNSLF
C: VTRNDVAPTLMSVPQYRPRPANPDEIGNFIDENLKAADSDPTAPPYDSLLVFDYEGGEAASLSLNSDQDYDYLNEWGNRFKKLADMYGGG
Distance of aggregation 10 Å
Dynamic mode No
Show buried residues

Minimal score value
-4.4248
Maximal score value
3.8341
Average score
-0.7294
Total score value
-463.8911

The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan3D score mutation
residue index residue name chain Aggrescan3D score
mutation
126 A A 2.1734
127 I A 3.8341
128 V A 3.7102
129 H A 2.0021
130 L A 2.9760
131 I A 3.0283
132 N A 0.3018
133 Y A -0.0838
134 Q A -2.0542
135 D A -2.7585
136 D A -2.0966
137 A A -2.7631
138 E A -3.2499
139 L A -1.9616
140 A A 0.0000
141 T A -1.9641
142 R A -2.2642
143 A A 0.0000
144 L A -0.8694
145 P A -1.1306
146 E A 0.0000
147 L A 0.0000
148 T A 0.0000
149 K A -2.5492
150 L A 0.0000
151 L A 0.0000
152 N A -2.6593
153 D A -2.1403
154 E A -2.4860
155 D A -1.1649
156 P A -0.5137
157 V A 0.9909
158 V A 0.0000
159 V A -0.5261
160 T A -0.1168
161 K A -0.0693
162 A A 0.0000
163 A A 0.0000
164 M A -0.2670
165 I A 0.0000
166 V A 0.0000
167 N A -0.7165
168 Q A -1.3216
169 L A 0.0000
170 S A 0.0000
171 K A -2.2477
172 K A -2.0389
173 E A -1.9298
174 A A 0.0000
175 S A 0.0000
176 R A -2.2426
177 R A -2.7144
178 A A 0.0000
179 L A 0.0000
180 M A 0.0000
181 G A -1.6122
182 S A 0.0000
183 P A -1.0978
184 Q A -1.5740
185 L A 0.0000
186 V A 0.0000
187 A A -1.0834
188 A A 0.0000
189 V A 0.0000
190 V A 0.0000
191 R A -1.8947
192 T A -1.4042
193 M A 0.0000
194 Q A -1.8097
195 N A -2.1594
196 T A -1.5538
197 S A -1.2740
198 D A -1.6629
199 L A -1.0237
200 D A -2.2156
201 T A 0.0000
202 A A 0.0000
203 R A -1.8902
204 C A -0.8992
205 T A 0.0000
206 T A 0.0000
207 S A 0.0000
208 I A 0.0000
209 L A 0.0000
210 H A -0.5147
211 N A -1.1294
212 L A 0.0000
213 S A 0.0000
214 H A -1.8188
215 H A -2.4203
216 R A -2.7453
217 E A -3.0371
218 G A 0.0000
219 L A 0.0000
220 L A -0.8850
221 A A -1.1687
222 I A 0.0000
223 F A -0.7370
224 K A -1.4531
225 S A -1.1387
226 G A -0.9312
227 G A 0.0000
228 I A 0.0000
229 P A -0.5154
230 A A 0.0000
231 L A 0.0000
232 V A 0.0000
233 R A -1.4141
234 M A 0.0000
235 L A 0.0000
236 S A -0.6009
237 S A -0.4955
238 P A -0.7297
239 V A -0.7776
240 E A -1.8996
241 S A -1.1036
242 V A 0.0000
243 L A 0.0000
244 F A -0.4528
245 Y A -0.1803
246 A A 0.0000
247 I A 0.0000
248 T A -0.0005
249 T A 0.0000
250 L A 0.0000
251 H A 0.0000
252 N A -0.2777
253 L A 0.0000
254 L A 0.0000
255 L A -0.0854
256 Y A 0.1332
257 Q A 0.0000
258 E A -1.4269
259 G A -0.8285
260 A A 0.0000
261 K A -0.2829
262 M A 0.6540
263 A A 0.2823
264 V A 0.0000
265 R A -0.1079
266 L A 1.0478
267 A A -0.1857
268 D A -1.3252
269 G A 0.0000
270 L A 0.0000
271 Q A -1.1796
272 K A -1.2718
273 M A 0.0000
274 V A 0.0000
275 P A -1.0320
276 L A 0.0000
277 L A 0.0000
278 N A -2.2148
279 K A -2.4334
280 N A -2.2947
281 N A -1.8394
282 P A -1.1988
283 K A -1.2241
284 F A 0.0000
285 L A 0.0000
286 A A 0.0000
287 I A 0.0000
288 T A 0.0000
289 T A 0.0000
290 D A 0.0000
291 C A 0.0000
292 L A 0.0000
293 Q A 0.0000
294 L A 0.0000
295 L A 0.0000
296 A A 0.0000
297 Y A -0.4603
298 G A -1.0109
299 N A -1.2250
300 Q A -1.8653
301 E A -2.1122
302 S A 0.0000
303 K A 0.0000
304 L A 0.0945
305 I A -0.1098
306 I A 0.0000
307 L A 0.3026
308 A A 0.1522
309 N A -0.6186
310 G A -0.5567
311 G A 0.0000
312 P A 0.0000
313 Q A -1.5515
314 A A -1.2827
315 L A 0.0000
316 V A 0.0000
317 Q A -2.1130
318 I A 0.0000
319 M A 0.0000
320 R A -2.0220
321 N A -1.8112
322 Y A -0.8476
323 S A -0.5522
324 Y A -0.4087
325 E A -0.8427
326 K A -0.8351
327 L A 0.0000
328 L A 0.0000
329 W A -0.4033
330 T A 0.0000
331 T A 0.0000
332 S A 0.0000
333 R A 0.0000
334 V A 0.0000
335 L A 0.0000
336 K A -0.3667
337 V A 0.0000
338 L A 0.0000
339 S A 0.0000
340 V A -0.7576
341 C A 0.0000
342 P A -0.4551
343 S A -0.0354
344 N A 0.0000
345 K A 0.0000
346 P A -0.6345
347 A A -0.8708
348 I A 0.0000
349 V A 0.0000
350 E A -1.9870
351 A A -1.4325
352 G A -1.4299
353 G A 0.0000
354 M A 0.0000
355 Q A -1.4451
356 A A 0.0000
357 L A 0.0000
358 G A 0.0000
359 K A -1.9012
360 H A 0.0000
361 L A 0.0000
362 T A -0.7509
363 S A -1.1627
364 N A -1.5152
365 S A -1.1934
366 P A -1.0386
367 R A -1.1951
368 L A 0.0000
369 V A -0.8170
370 Q A -0.8559
371 N A 0.0000
372 C A 0.0000
373 L A 0.0000
374 W A 0.0000
375 T A 0.0000
376 L A 0.0000
377 R A 0.0000
378 N A 0.0000
379 L A 0.0000
380 S A 0.0000
381 D A -0.3079
382 V A -0.3535
383 A A 0.0000
384 T A -1.1743
385 K A -2.4554
386 Q A -2.3193
387 E A -3.0964
388 G A -2.0757
389 L A 0.0000
390 E A -2.8077
391 S A -1.8272
392 V A 0.0000
393 L A 0.0000
394 K A -2.1245
395 I A -1.3681
396 L A 0.0000
397 V A 0.0000
398 N A -1.6083
399 Q A -1.0481
400 L A 0.0000
401 S A -1.2628
402 V A -0.9434
403 D A -1.9436
404 D A -1.2695
405 V A -0.5653
406 N A -0.8552
407 V A -0.4877
408 L A 0.0000
409 T A 0.0000
410 C A 0.0000
411 A A 0.0000
412 T A 0.0000
413 G A 0.0000
414 T A 0.0000
415 L A 0.0000
416 S A 0.0000
417 N A 0.0000
418 L A 0.0000
419 T A 0.0000
420 C A 0.0000
421 N A -0.3781
422 N A -1.0283
423 S A -0.9752
424 K A -2.4487
425 N A 0.0000
426 K A 0.0000
427 T A -1.1521
428 L A -1.5473
429 V A 0.0000
430 T A 0.0000
431 Q A -1.6965
432 N A -1.9297
433 S A -1.6796
434 G A 0.0000
435 V A 0.0000
436 E A -1.6091
437 A A -1.3285
438 L A 0.0000
439 I A 0.0000
440 H A -1.0313
441 A A 0.0000
442 I A 0.0000
443 L A 0.1728
444 R A -1.0561
445 A A -1.5218
446 G A -1.5908
447 D A -2.9772
448 K A -2.6774
449 D A -2.7025
450 D A -2.6252
451 I A 0.0000
452 T A 0.0000
453 E A 0.0000
454 P A 0.0000
455 A A 0.0000
456 V A 0.0000
457 C A 0.0000
458 A A 0.0000
459 L A 0.0000
460 R A 0.0000
461 H A 0.0000
462 L A 0.0000
463 T A 0.0000
464 S A 0.0000
465 R A -0.3983
466 H A 0.0000
467 P A -1.0318
468 E A -1.4315
469 A A 0.0000
470 E A -1.9246
471 M A -1.0719
472 A A 0.0000
473 Q A 0.0000
474 N A -0.5789
475 S A -0.1736
476 V A 0.0000
477 R A 0.3736
478 L A 1.2661
479 N A 0.3591
480 Y A 1.2941
481 G A 0.0000
482 I A 0.0000
483 P A -0.6296
484 A A 0.0000
485 I A 0.0000
486 V A 0.0000
487 K A -2.4380
488 L A 0.0000
489 L A 0.0000
490 N A -2.2012
491 Q A -2.0028
492 P A -1.5263
493 N A -1.7150
494 Q A -1.5258
495 W A -1.1914
496 P A 0.0000
497 L A 0.0000
498 V A 0.0000
499 K A -0.9725
500 A A 0.0000
501 T A 0.0000
502 I A 0.0000
503 G A 0.0000
504 L A 0.0000
505 I A 0.0000
506 R A -0.1369
507 N A 0.0000
508 L A 0.0000
509 A A 0.0000
510 L A -0.3063
511 C A 0.0000
512 P A -0.3169
513 A A -0.1610
514 N A 0.0000
515 H A 0.0000
516 A A -0.5824
517 P A -0.7749
518 L A 0.0000
519 Q A -1.3646
520 E A -2.0973
521 A A -1.4534
522 A A -1.3099
523 V A 0.0000
524 I A 0.0000
525 P A -0.9042
526 R A -1.6853
527 L A 0.0000
528 V A 0.0000
529 Q A -1.3762
530 L A -0.9365
531 L A 0.0000
532 V A -0.0797
533 K A -1.0975
534 A A 0.0000
535 H A -1.3984
536 Q A -1.8050
537 D A -1.6884
538 A A -1.7617
539 Q A -1.9955
540 R A -2.4331
541 H A -1.2063
542 V A 0.3017
543 A A -0.1587
544 A A -0.4209
545 G A -0.4909
546 T A -0.8201
547 Q A -1.4822
548 Q A -1.2815
549 P A -0.4676
550 Y A 0.3226
551 T A -1.1744
552 D A -2.0373
553 G A -1.9144
554 V A 0.0000
555 R A -2.7587
556 M A 0.0000
557 E A -1.3913
558 E A -1.5515
559 I A 0.0000
560 V A 0.0000
561 E A -0.7647
562 G A -0.6096
563 C A 0.0000
564 T A 0.0000
565 G A 0.0000
566 A A 0.0000
567 L A 0.0000
568 H A 0.0000
569 I A 0.0000
570 L A 0.0000
571 A A 0.0000
572 R A -0.9501
573 D A 0.0000
574 P A -0.1687
575 M A 0.6539
576 N A 0.0000
577 R A 0.0000
578 M A -0.2408
579 E A -1.0004
580 I A 0.0000
581 F A -1.1150
582 R A -1.9663
583 L A -0.9595
584 N A -1.5312
585 T A 0.0000
586 I A 0.0000
587 P A -0.8947
588 L A -0.4681
589 F A 0.0000
590 V A 0.0000
591 Q A -0.9430
592 L A 0.0000
593 L A 0.0000
594 Y A 0.6688
595 S A 0.2212
596 S A 0.1557
597 V A 0.0927
598 E A -0.8515
599 N A -0.9008
600 I A 0.0000
601 Q A -0.3981
602 R A 0.0000
603 V A 0.0000
604 A A 0.0000
605 A A 0.0000
606 G A 0.0000
607 V A 0.0000
608 L A 0.0000
609 C A 0.0000
610 E A -0.9115
611 L A 0.0000
612 A A 0.0000
613 Q A -2.1620
614 D A -2.6147
615 K A -4.2503
616 E A -3.5368
617 A A 0.0000
618 A A 0.0000
619 D A -3.5952
620 A A -2.0448
621 I A 0.0000
622 D A -1.4567
623 A A -1.2921
624 E A -1.8151
625 G A -1.1476
626 A A 0.0000
627 S A -0.5348
628 A A -0.5068
629 P A 0.0000
630 L A 0.0000
631 M A -1.0113
632 E A -1.7671
633 L A 0.0000
634 L A -1.5649
635 H A -1.8544
636 S A -2.3675
637 R A -2.8109
638 N A -2.4356
639 E A -2.4218
640 G A 0.0000
641 T A 0.0000
642 A A -1.4896
643 T A 0.0000
644 Y A 0.0000
645 A A 0.0000
646 A A 0.0000
647 A A 0.0000
648 V A 0.0000
649 L A 0.0000
650 F A -1.2860
651 R A -2.2638
652 I A 0.0000
653 S A -3.6320
654 E A -4.1093
655 D A -4.2972
656 K A -4.0255
657 N A -3.2753
658 P A -1.7818
661 R A -3.8566
662 K A -3.8787
663 R A -3.3124
664 V A 0.0000
665 S A 0.0000
666 V A -2.0849
667 E A -2.4982
668 L A -1.3335
669 T A -1.1954
670 N A -1.5123
671 S A 0.0925
672 L A 2.1807
673 F A 2.5270
628 V C 1.1222
629 T C -0.1372
630 R C -1.4026
631 N C -2.1180
632 D C -2.2051
633 V C -0.7153
634 A C -0.0570
635 P C 0.0000
636 T C 0.9566
637 L C 1.6836
638 M C 1.1832
639 S C 0.9130
640 V C 1.3473
641 P C -0.4197
642 Q C -1.5669
643 Y C -2.0270
644 R C -2.6687
645 P C -1.6537
646 R C -1.6833
647 P C -1.8470
648 A C -1.4527
649 N C -2.4380
650 P C -2.7641
651 D C -3.1995
652 E C -3.0020
653 I C 0.0000
654 G C -2.2429
655 N C -2.8491
656 F C -2.5978
657 I C 0.0000
658 D C -2.9870
659 E C -3.5637
660 N C 0.0000
661 L C 0.0000
662 K C -3.1908
663 A C -2.4002
664 A C 0.0000
665 D C -2.1464
666 S C -1.2894
667 D C -0.6979
668 P C 0.1090
669 T C 0.5573
670 A C 0.0000
671 P C -0.1688
672 P C -0.3346
673 Y C -0.2985
674 D C 0.0000
675 S C -1.0986
676 L C -0.6132
677 L C 0.0000
678 V C 0.1745
679 F C 0.0000
680 D C -1.2305
681 Y C -0.3305
682 E C -0.7914
683 G C -0.7288
685 G C -1.0584
687 E C -1.9091
688 A C 0.0000
689 A C -0.4403
690 S C -0.3545
691 L C -0.0688
693 S C -0.6491
694 L C -0.6889
695 N C -1.2594
696 S C -0.8165
702 D C -2.8577
703 Q C -3.1814
704 D C -3.4131
705 Y C 0.0000
706 D C -3.3698
707 Y C -1.9491
708 L C 0.0000
709 N C -3.7772
710 E C -3.0941
711 W C -2.3141
712 G C -2.6334
713 N C -3.4148
714 R C -2.8357
715 F C 0.0000
716 K C -4.4248
717 K C -3.5693
718 L C 0.0000
719 A C 0.0000
720 D C -3.2376
721 M C -1.6971
722 Y C -1.3257
723 G C -2.1689
724 G C -2.3552
725 G C -1.4551

 

Laboratory of Theory of Biopolymers 2015