Project name: 7522f788da18e01

Status: done

submitted: 2018-12-17 17:06:25, status changed: 2018-12-17 17:51:45
Settings
Chain sequence(s) A: RKYQVELLEAALDHNTIVCLNTGSGKTFIAVLLTKELSYQIRGDFSRNGKRTVFLVNSANQVAQQVSAVRTHSDLKVGEYSNLEVNASWTKERWNQEFTKHQVLIMTCYVALNVLKNGYLSLSDINLLVFDECHLAILDHPYREIMKLCENCPSCPRILGLTASILNGKCDPEELEEKIQKLEKILKSNAETATDLVVLDRYTSQPCEIVVDCGPFTDRSGLYERLLMELEEALNFINDCNISRDSTLISKQILSDCRAVLVVLGPWCADKVAGMMVRELQKYIKHEQEELHRKFLLFTDTFLRKIHALCEEHFSPASLDLKFVTPKVIKLLEILRKYKPFTNILCGIIFVERRYTAVVLNRLIKEAGKQDPELAYISSNFITGHGIGKNQPRNKQMEAEFRKQEEVLRKFRAHETNLLIATSIVEEGVDIPKCNLVVRFDLPTEYRSYVQSKGRARAPISNYIMLADTDKIKSFEEDLKTYKAIEKILRNKCSKSVVTINTAIGHINRYCARLPSDPFTHLAPKCRTRELPDGTFYSTLYLPINSPLRASIVGPPMSCVRLAERVVALICCEKLHKIGELDDHLMPVGKETVKYEEELDDQPCYLYVIGMVLTTPLPDELNFRRRKLYPPEDTTRCFGILTAKPIPQIPHFPVYTRSGEVTISIELKKSGFMLSLQMLELITRLHQYIFSHILRLEKPALEFKPTDADSAYCVLPLNVVNDSSTLDIDFKFMEDIEKSEARIGIPSTKYTKETPFVFKLEDYQDAVIIPRYRNFDQPHRFYVADVYTDLTPLSKFPSPEYETFAEYYKTKYNLDLTNLNQPLLDVDHTSSRLNLLTPRHLNQKGKALPLSSAEKRKAKWESLQNKQILVPELCAIHPIPASLWRKAVCLPSILYRLHCLLTAEELRAQTRTLGPNPGLILQALTLSNASDGFNLERLEMLGDSFLKHAITTYLFCTYPDAHEGRLSYMRSKKVSNCNLYRLGKKKGLPSRMVVSIFDPPVEQCIADKSIADCVEALLGCYLTSCGERAAQLFLCSLGLKVLPVIKRTDREKALCPTRENFNSQQKNLSVSCDADKTLNHLISGFENFEKKINYRFKNKAYLLQAFTHASYHYNTITDCYQRLEFLGDAILDYLITKHLYEDPRQHSPGVLTDLRSALVNNTIFASLAVKYDYHKYFKAVSPELFHVIDDFVQFQLEKNEMQGEVPKAMGDIFESLAGAIYMDSGMSLETVWQVYYPMMRPLIEKFSANVPRSPVRELLEMEPETAKFSPAERTYDGKVRVTVEVVGKGKFKGVGRSYRIAKSAAARRALRSLK
Distance of aggregation 10 Å
Dynamic mode No
Show buried residues

Minimal score value
-4.1496
Maximal score value
2.4582
Average score
-0.7286
Total score value
-957.3362

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
45 R A -1.5609
46 K A -1.1519
47 Y A 0.0000
48 Q A 0.0000
49 V A 0.0000
50 E A -1.9258
51 L A 0.0000
52 L A 0.0000
53 E A -0.8105
54 A A 0.0000
55 A A 0.0000
56 L A 0.3485
57 D A -1.3988
58 H A -1.4203
59 N A 0.0000
60 T A 0.0000
61 I A 0.0000
62 V A 0.0000
63 C A 0.4157
64 L A -0.0367
65 N A -0.9126
66 T A -0.7276
67 G A -1.0377
68 S A -1.1089
69 G A -0.8078
70 K A -0.4501
71 T A -0.3141
72 F A 0.0000
73 I A 0.0000
74 A A -0.0932
75 V A 0.0000
76 L A 0.0000
77 L A 0.0000
78 T A -0.1211
79 K A -0.4207
80 E A -0.1029
81 L A 0.0000
82 S A 0.0000
83 Y A -0.1258
84 Q A -0.3393
85 I A 0.9757
86 R A 0.0249
87 G A -0.1211
88 D A 0.2902
89 F A 0.9081
90 S A -0.1972
91 R A -1.6615
92 N A -0.9677
93 G A -0.5435
94 K A 0.0000
95 R A 0.0000
96 T A 0.0000
97 V A 0.3894
98 F A 0.0000
99 L A 0.0000
100 V A 0.0000
101 N A -0.4382
102 S A -0.8016
103 A A -0.8153
104 N A -1.7474
105 Q A -1.4276
106 V A 0.0000
107 A A -1.0642
108 Q A -1.5536
109 Q A 0.0000
110 V A -0.7673
111 S A -0.9934
112 A A -0.8046
113 V A -0.8190
114 R A -1.7740
115 T A 0.0000
116 H A 0.0000
117 S A -1.1008
118 D A -0.9990
119 L A -0.9727
120 K A -1.9316
121 V A 0.0000
122 G A 0.0000
123 E A -0.6283
124 Y A 0.2378
125 S A 0.1812
126 N A 0.0000
127 L A 0.8184
128 E A -0.8562
129 V A 0.2645
130 N A -0.7886
131 A A -0.4803
132 S A -0.7015
133 W A -0.8301
134 T A -1.4267
135 K A -1.8662
136 E A -1.3642
137 R A -1.6359
138 W A -0.7136
139 N A -1.0395
140 Q A -1.3878
141 E A 0.0000
142 F A -0.1431
143 T A -0.8625
144 K A -1.7172
145 H A -1.1651
146 Q A 0.0000
147 V A -0.1549
148 L A -0.0810
149 I A 0.0000
150 M A 0.2782
151 T A 0.0000
152 C A 0.0000
153 Y A 1.4828
154 V A 0.0000
155 A A 0.0000
156 L A 0.1220
157 N A -0.2041
158 V A 0.0409
159 L A -0.0949
160 K A -1.6557
161 N A -1.3706
162 G A 0.0000
163 Y A 0.3384
164 L A 0.9392
165 S A 0.7071
166 L A 1.1058
167 S A 0.2683
168 D A -0.8346
169 I A -0.4679
170 N A -0.8161
171 L A 0.0000
172 L A 0.0000
173 V A 0.0000
174 F A 0.0000
175 D A 0.0000
176 E A -0.5372
177 C A 0.0000
178 H A 0.1177
179 L A 0.8449
180 A A 0.7520
181 I A 2.2681
182 L A 1.5580
183 D A -0.5777
184 H A 0.2076
185 P A -0.1327
186 Y A 0.0000
187 R A -0.7608
188 E A -1.3383
189 I A 0.0000
190 M A -1.3996
191 K A -2.2700
192 L A -1.2934
193 C A -1.5702
194 E A -2.5540
195 N A -2.2159
196 C A -0.8648
197 P A -0.9413
198 S A -0.9842
199 C A 0.0000
200 P A -0.9802
201 R A -0.9568
202 I A 0.0000
203 L A 0.0000
204 G A 0.0000
205 L A 0.0000
206 T A 0.0000
207 A A -0.1051
208 S A 0.5514
209 I A 1.3484
210 L A 0.2562
211 N A -0.7155
212 G A -0.5549
213 K A -1.8339
214 C A -2.0893
215 D A -1.8987
216 P A -2.3423
217 E A -3.4196
218 E A -3.9496
219 L A -2.8439
220 E A -3.5667
221 E A -3.5198
222 K A -2.7374
223 I A -2.0343
224 Q A -3.0295
225 K A -3.0643
226 L A -1.8458
227 E A -2.8227
228 K A -2.9124
229 I A 0.0000
230 L A 0.0000
231 K A -2.6716
232 S A 0.0000
233 N A -0.8891
234 A A -0.2898
235 E A 0.0000
236 T A 0.0000
237 A A -0.0786
238 T A -0.1260
239 D A 0.0000
240 L A 0.0000
241 V A 0.0046
242 V A 0.0596
243 L A 0.1189
244 D A 0.0000
245 R A -0.9750
246 Y A 0.5852
247 T A -0.1887
248 S A -0.9071
249 Q A -1.4959
250 P A -0.7637
251 C A -0.2706
252 E A -0.6768
253 I A 1.6195
254 V A 0.5230
255 V A 0.0000
256 D A -2.6259
257 C A 0.0000
258 G A 0.0000
259 P A 0.0000
260 F A 0.9911
261 T A -0.0677
262 D A -1.5920
263 R A -1.1219
264 S A -0.7261
265 G A -1.0914
266 L A 0.2100
267 Y A 0.0000
268 E A -1.8826
269 R A -2.0713
270 L A -1.4826
271 L A -1.2626
272 M A -1.4647
273 E A -2.4583
274 L A 0.0000
275 E A -1.8528
276 E A -1.8526
277 A A -1.0586
278 L A 0.0000
279 N A -1.5338
280 F A -0.0407
281 I A 0.0000
282 N A -2.0210
283 D A -1.8368
284 C A -1.4270
285 N A -2.3460
286 I A -1.2413
287 S A -1.6945
293 R A -3.2930
294 D A -2.8038
295 S A -1.2492
296 T A 0.0000
297 L A 0.5374
298 I A 0.2302
299 S A 0.0000
300 K A -0.6599
301 Q A -0.9780
302 I A -0.4330
303 L A 0.0000
304 S A -0.9262
305 D A -0.8935
306 C A 0.0000
307 R A -0.8084
308 A A -0.1896
309 V A 0.0000
310 L A 0.0000
311 V A 1.7040
312 V A 0.0000
313 L A 0.0000
314 G A 0.0000
315 P A 0.0000
316 W A -0.1247
317 C A 0.0000
318 A A 0.0000
319 D A 0.0000
320 K A -0.5323
321 V A 0.0000
322 A A 0.0000
323 G A -1.3408
324 M A -1.1594
325 M A -1.3824
326 V A 0.0000
327 R A -2.9970
328 E A -3.0760
329 L A 0.0000
330 Q A -2.4966
331 K A -3.2168
332 Y A -1.8783
333 I A -1.7965
334 K A -2.8290
335 H A -2.7881
336 E A -2.8790
337 Q A -3.2315
338 E A -3.8997
339 E A -3.5414
340 L A -2.4894
341 H A -2.7108
342 R A -2.5678
343 K A -1.3147
344 F A 0.0000
345 L A 0.0000
346 L A 0.8042
347 F A 1.2369
348 T A 0.0000
349 D A 0.0000
350 T A -0.2312
351 F A -0.6334
352 L A 0.0000
353 R A -2.3112
354 K A -2.1498
355 I A 0.0000
356 H A -1.7192
357 A A -1.8094
358 L A -1.4600
359 C A 0.0000
360 E A -2.8850
361 E A -3.0099
362 H A -2.1585
363 F A 0.0000
364 S A -1.2945
365 P A -0.9255
366 A A -0.5037
367 S A 0.2021
368 L A 0.3500
369 D A -1.0022
370 L A 0.0070
371 K A -0.3570
372 F A 0.7535
373 V A 1.0380
374 T A 0.8159
375 P A 0.6720
376 K A 0.7797
377 V A 1.8703
378 I A 1.5176
379 K A -0.1519
380 L A 0.4265
381 L A 0.0458
382 E A -0.9223
383 I A -0.6190
384 L A -0.6283
385 R A -1.5638
386 K A -1.0900
387 Y A -0.2115
388 K A 0.0000
389 P A -0.6107
438 F A 1.6363
439 T A 0.5024
440 N A -0.5117
441 I A 0.0676
442 L A -0.2132
443 C A 0.0000
444 G A 0.0000
445 I A 0.1755
446 I A 0.0000
447 F A 0.0000
448 V A 0.0000
449 E A -1.2463
450 R A -1.2746
451 R A 0.0000
452 Y A 0.0000
453 T A 0.0000
454 A A 0.0000
455 V A -0.2835
456 V A 0.0000
457 L A -0.6980
458 N A -1.5773
459 R A -2.2134
460 L A -1.7156
461 I A -1.3717
462 K A -2.9280
463 E A -2.7264
464 A A -1.2499
465 G A -0.7308
466 K A 0.0000
467 Q A -1.6628
468 D A 0.0000
469 P A 0.0000
470 E A -0.8238
471 L A 0.0000
472 A A 0.0000
473 Y A 0.0000
474 I A 0.1463
475 S A 0.0000
476 S A 0.0134
477 N A 0.2739
478 F A 2.4066
479 I A 2.4582
480 T A 1.0653
481 G A 0.3394
482 H A -0.4213
483 G A -0.1080
484 I A 0.0000
485 G A 0.0000
486 K A -1.1949
487 N A -1.1643
488 Q A -1.7447
489 P A -2.1682
490 R A -3.2311
491 N A -3.1166
492 K A -2.6094
493 Q A -2.2195
494 M A -1.2103
495 E A -1.0630
496 A A -0.7089
497 E A -0.6140
498 F A -0.7839
499 R A -2.5833
500 K A -2.3212
501 Q A -1.8216
502 E A -2.5890
503 E A -3.1463
504 V A 0.0000
505 L A -2.4605
506 R A -4.0250
507 K A -3.7227
508 F A 0.0000
509 R A -3.6032
510 A A -2.8192
511 H A -2.8870
512 E A -3.0641
513 T A 0.0000
514 N A -1.4987
515 L A -0.7446
516 L A -0.7346
517 I A 0.0000
518 A A 0.0000
519 T A 0.0000
520 S A -0.3346
521 I A -0.3485
522 V A -0.7456
523 E A -1.2971
524 E A -2.3583
525 G A -1.5302
526 V A -1.2229
527 D A -1.7027
528 I A -0.9593
529 P A -0.8050
530 K A -0.8320
531 C A 0.0000
532 N A 0.0000
533 L A 0.0000
534 V A 0.0000
535 V A 0.0000
536 R A 0.0000
537 F A 0.0000
538 D A -0.1552
539 L A -0.3993
540 P A -0.5283
541 T A -0.6210
542 E A -1.4040
543 Y A 0.0000
544 R A -1.1394
545 S A -1.0722
546 Y A 0.0000
547 V A 0.0000
548 Q A -1.0432
549 S A 0.0000
550 K A -0.6658
551 G A 0.0000
552 R A -0.9623
553 A A 0.0000
554 R A 0.0000
555 A A 0.1181
556 P A 0.1746
557 I A 0.4019
558 S A 0.0000
559 N A -0.5717
560 Y A 0.0000
561 I A 0.0000
562 M A 0.0000
563 L A 0.0000
564 A A 0.0000
565 D A -1.6306
566 T A 0.0000
567 D A -3.7076
568 K A -2.7925
569 I A -1.9337
570 K A -3.5953
571 S A -3.1529
572 F A -2.8604
573 E A -4.1496
574 E A -4.0844
575 D A -3.5911
576 L A 0.0000
577 K A -3.6025
578 T A -2.7330
579 Y A -2.1183
580 K A -2.3678
581 A A -2.0580
582 I A 0.0000
583 E A 0.0000
584 K A -2.5630
585 I A -2.2199
586 L A -1.3447
587 R A -2.0984
588 N A -2.4688
589 K A -2.9087
590 C A -1.7449
591 S A -1.4360
592 K A -2.3076
593 S A -1.0887
594 V A -0.0693
625 V A 1.6792
626 T A 0.5293
627 I A -0.1075
628 N A -0.8759
629 T A -0.4615
630 A A -0.5804
631 I A 0.2146
632 G A -0.4783
633 H A 0.0000
634 I A 0.0000
635 N A -0.6060
636 R A -0.3850
637 Y A 0.0000
638 C A 0.2995
639 A A 0.2848
640 R A 0.0000
641 L A 0.7113
642 P A 0.0353
643 S A -0.1680
644 D A 0.0000
645 P A 0.1196
646 F A 0.6931
647 T A 0.2969
648 H A -0.2271
649 L A 0.0444
650 A A -0.0160
651 P A -0.3267
652 K A -0.4350
653 C A -0.0981
654 R A -0.6863
655 T A -0.9058
656 R A -1.3199
657 E A -1.6407
658 L A -0.0592
659 P A -0.7865
660 D A -1.9035
661 G A -1.1872
662 T A 0.0000
663 F A -0.2928
664 Y A -0.2163
665 S A 0.0000
666 T A 0.0202
667 L A -0.0397
668 Y A 0.0000
669 L A 0.0000
670 P A 0.3508
671 I A 0.4365
672 N A -0.5578
673 S A 0.0000
674 P A -0.1974
675 L A 0.0307
676 R A 0.2363
677 A A 1.0916
678 S A 1.2584
679 I A 2.1534
680 V A 0.0000
681 G A 0.1742
682 P A 0.0000
683 P A -0.3605
684 M A 0.2757
685 S A 0.0960
686 C A 1.0459
687 V A 1.3615
688 R A -0.5676
689 L A 0.8258
690 A A 0.0000
691 E A -0.2641
692 R A -0.5030
693 V A 0.1211
694 V A 0.0000
695 A A 0.0000
696 L A 0.4334
697 I A 0.4763
698 C A 0.0744
699 C A -0.8846
700 E A -2.3860
701 K A -2.1606
702 L A 0.0000
703 H A -2.0000
704 K A -2.6095
705 I A -1.3265
706 G A -1.7499
707 E A -2.4603
708 L A 0.0000
709 D A -1.9111
710 D A -2.7141
711 H A -1.6421
712 L A -0.3127
713 M A 0.1068
714 P A -0.9672
715 V A 0.0000
716 G A -1.9489
717 K A -2.7207
718 E A -3.0743
719 T A -2.5856
720 V A -2.3632
721 K A -3.7584
722 Y A -2.8083
723 E A -3.5129
724 E A -3.9393
725 E A -3.1316
726 L A -1.2667
727 D A -2.6518
765 D A -1.3183
766 Q A -0.7525
767 P A -0.0962
768 C A 0.0000
769 Y A -0.4896
770 L A 0.0000
771 Y A 0.0000
772 V A 0.0000
773 I A 0.0000
774 G A -0.4648
775 M A 0.0000
776 V A 0.4892
777 L A 0.1768
778 T A 0.1828
779 T A 0.0000
780 P A -0.3532
781 L A -1.1045
782 P A -1.5295
783 D A -2.9164
784 E A -2.5506
785 L A 0.0000
786 N A 0.0000
787 F A -0.9117
788 R A -2.3213
789 R A -3.0531
790 R A -2.2297
791 K A -2.3066
792 L A -0.6637
793 Y A -0.4597
794 P A -0.7343
795 P A -1.1145
796 E A -2.3881
797 D A -2.5560
798 T A -1.5856
799 T A -0.9455
800 R A -0.7479
801 C A 0.0000
802 F A 0.0000
803 G A 0.0000
804 I A 0.4017
805 L A 0.0000
806 T A 0.0000
807 A A -0.8185
808 K A -1.6804
809 P A -0.8528
810 I A -0.6696
811 P A -0.8848
812 Q A -1.4296
813 I A -0.5461
814 P A -0.7305
815 H A -1.0542
816 F A -0.4557
817 P A -0.1720
818 V A 0.0000
819 Y A -0.5160
820 T A -0.3843
821 R A -0.7859
822 S A 0.0000
823 G A 0.0000
824 E A -0.4591
825 V A 0.0000
826 T A 0.0795
827 I A 0.0000
828 S A -0.5971
829 I A -0.6062
830 E A -1.4789
831 L A -0.5557
832 K A -1.3855
833 K A -1.6606
834 S A -1.0093
835 G A -0.6490
836 F A 0.1320
837 M A 0.8834
838 L A 0.6374
839 S A 0.0882
840 L A -0.0178
841 Q A -1.1142
842 M A -0.6506
843 L A -1.0007
844 E A -2.0853
845 L A 0.0000
846 I A 0.0000
847 T A -1.2636
848 R A -1.6418
849 L A -0.7768
850 H A 0.0000
851 Q A -1.4463
852 Y A 0.0000
853 I A -0.0119
854 F A -0.3120
855 S A -0.8196
856 H A -0.3459
857 I A 0.0574
858 L A -0.0736
859 R A -1.6781
860 L A -1.0408
861 E A -2.3546
862 K A -1.3901
863 P A 0.0000
864 A A 0.0000
865 L A 0.0819
866 E A 1.4174
867 F A 1.3253
868 K A -0.6487
869 P A -1.1405
870 T A -1.8160
871 D A -2.0697
872 A A -1.0162
873 D A -0.4287
874 S A -0.2027
875 A A -0.0597
876 Y A 0.0462
877 C A 0.0000
878 V A 0.3945
879 L A 0.0000
880 P A 0.0949
881 L A 0.0000
882 N A -0.3395
883 V A -0.1637
884 V A -0.5085
885 N A -1.8660
886 D A -2.2878
887 S A -1.2555
888 S A -1.1806
889 T A -0.5432
890 L A -0.0611
891 D A -0.5267
892 I A 0.0188
893 D A 0.0000
894 F A -0.6892
895 K A -1.9782
896 F A -1.4883
897 M A 0.0000
898 E A -3.0538
899 D A -2.5602
900 I A 0.0000
901 E A -2.8315
902 K A -3.3209
903 S A -2.3878
904 E A -2.2275
905 A A -0.9263
906 R A -1.0677
907 I A 0.8911
908 G A 0.0762
909 I A 0.3527
910 P A -0.7084
911 S A -0.8482
912 T A -0.8201
913 K A -1.6115
914 Y A -0.9826
915 T A -1.7780
916 K A -2.6156
917 E A -2.6727
918 T A -1.4973
919 P A -0.8165
920 F A 0.0000
921 V A 1.5196
922 F A -0.1621
923 K A -2.0124
924 L A -1.6294
925 E A -3.2709
926 D A -3.3396
927 Y A 0.0000
928 Q A -2.6829
929 D A -1.8222
930 A A 0.0000
931 V A 0.0000
932 I A 0.0000
933 I A 0.0000
934 P A 0.0000
935 R A -0.1605
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1907 R A -3.3541
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1911 S A -2.4006
1912 L A -2.1528
1913 K A -2.3050

 

Laboratory of Theory of Biopolymers 2015