Project name: 2p1q modified

Status: done

submitted: 2018-12-10 11:55:26, status changed: 2018-12-10 12:16:22
Settings
Chain sequence(s) C: QVVGWPPVRNYRK
B: FPEEVLEHVFSFIQLDKDRNSVSLVCKSWYEIERWCRRKVFIGNCYAVSPATVIRRFPKVRSVELKGKPHFADFNLVPDGWGGYVYPWIEAMSSSYTWLEEIRLKRMVVTDDCLELIAKSFKNFKVLVLSSCEGFSTDGLAAIAATCRNLKELDLRESDVDDVSGHWLSHFPDTYTSLVSLNISCLASEVSFSALERLVTRCPNLKSLKLNRAVPLEKLATLLQRAPQLEELGTGGYTAEVRPDVYSGLSVALSGCKELRCLSGFWDAVPAYLPAVYSVCSRLTTLNLSYATVQSYDLVKLLCQCPKLQRLWVLDYIEDAGLEVLASTCKDLRELRVFPSEPFVMEPNVALTEQGLVSVSMGCPKLESVLYFCRQMTNAALITIARNRPNMTRFRLCIIEPKAPDYLTLEPLDIGFGAIVEHCKDLRRLSLSGLLTDKVFEYIGTYAKKMEMLSVAFAGDSDLGMHHVLSGCDSLRKLEIRDCPFGDKALLANASKLETMRSLWMSSCSVSFGACKLLGQKMPKLNVEVIDERGAPDSRPESCPVERVFIYRTVAGPRFDMPGFVWNM
Distance of aggregation 10 Å
Dynamic mode No
Show buried residues

Minimal score value
-4.122
Maximal score value
2.4078
Average score
-0.616
Total score value
-357.8992

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
9 F B 1.1855
10 P B -0.5965
11 E B -2.3326
12 E B -2.5972
13 V B -0.7713
14 L B -0.7730
15 E B -1.5412
16 H B -1.1799
17 V B 0.3854
18 F B 0.0000
19 S B 0.2097
20 F B 1.8191
21 I B 0.5736
22 Q B -0.8911
23 L B -0.3298
24 D B -1.4573
25 K B -2.5362
26 D B -2.1507
27 R B 0.0000
28 N B -1.1828
29 S B -0.3549
30 V B 0.5239
31 S B 0.7229
32 L B 2.0959
33 V B 2.4078
34 C B 1.0093
35 K B -0.8052
36 S B -0.5124
37 W B 0.3877
38 Y B 0.2920
39 E B -0.3828
40 I B -0.6670
41 E B 0.0000
42 R B -0.6758
43 W B -0.1243
44 C B -0.4958
45 R B 0.0000
46 R B -2.2294
47 K B -1.7032
48 V B 0.0000
49 F B 1.1204
50 I B 0.8063
51 G B 0.1420
52 N B 0.0000
53 C B 0.0000
54 Y B 0.5250
55 A B 0.1464
56 V B 0.7174
57 S B 0.3810
58 P B -0.3723
59 A B -0.6421
60 T B -0.7049
61 V B 0.0000
62 I B -1.1491
63 R B -2.4388
64 R B -2.3027
65 F B -1.4006
66 P B -1.1005
67 K B -1.1821
68 V B 0.0000
69 R B -1.7419
70 S B 0.0000
71 V B 0.0000
72 E B 0.0000
73 L B 0.0000
74 K B -0.4776
75 G B 0.0000
76 K B -0.3676
77 P B 0.0000
78 H B -0.5165
79 F B 0.0000
80 A B -0.8832
81 D B -0.9828
82 F B -0.7305
83 N B -1.3775
84 L B 0.0000
85 V B 0.0000
86 P B -1.5356
87 D B -2.2120
88 G B -1.2689
89 W B 0.0000
90 G B 0.0000
91 G B 0.0000
92 Y B 0.7989
93 V B 0.0000
94 Y B 0.0504
95 P B -0.1350
96 W B 0.0000
97 I B 0.0000
98 E B -1.4846
99 A B -0.6506
100 M B 0.0000
101 S B -0.8071
102 S B -0.5564
103 S B -0.5650
104 Y B 0.0000
105 T B -0.6011
106 W B -0.5819
107 L B 0.0000
108 E B -1.7328
109 E B -1.5378
110 I B 0.0000
111 R B -0.8074
112 L B 0.0000
113 K B -1.3842
114 R B -0.9216
115 M B 0.0000
116 V B -0.1346
117 V B 0.0000
118 T B -1.1896
119 D B -2.1496
120 D B -2.7381
121 C B 0.0000
122 L B 0.0000
123 E B -2.8931
124 L B -1.8865
125 I B 0.0000
126 A B 0.0000
127 K B -2.4083
128 S B -1.7484
129 F B 0.0000
130 K B -2.9952
131 N B -2.5504
132 F B 0.0000
133 K B -1.9955
134 V B 0.0000
135 L B 0.0000
136 V B 0.0000
137 L B 0.0000
138 S B 0.0000
139 S B 0.0000
140 C B 0.0000
141 E B -1.8846
142 G B -1.3210
143 F B 0.0000
144 S B 0.0000
145 T B 0.0000
146 D B -2.3951
147 G B 0.0000
148 L B 0.0000
149 A B -1.2908
150 A B -1.4764
151 I B 0.0000
152 A B 0.0000
153 A B -0.5981
154 T B -1.5646
155 C B 0.0000
156 R B -2.8658
157 N B -2.6514
158 L B 0.0000
159 K B -1.8530
160 E B -1.1441
161 L B 0.0000
162 D B -0.9944
163 L B 0.0000
164 R B -2.1155
165 E B -2.9199
166 S B 0.0000
167 D B -2.9557
168 V B -1.9302
169 D B -2.3232
170 D B -1.3018
171 V B 0.4402
172 S B -0.6417
173 G B -1.1817
174 H B -1.5035
175 W B 0.0000
176 L B 0.0000
177 S B -1.1981
178 H B -1.1200
179 F B 0.0000
180 P B -1.4484
181 D B -2.2683
182 T B -1.3065
183 Y B 0.0000
184 T B -1.2592
185 S B -1.3530
186 L B 0.0000
187 V B 0.0000
188 S B -1.1512
189 L B 0.0000
190 N B -0.7851
191 I B 0.0000
192 S B -1.0106
193 C B -1.3399
194 L B 0.0000
195 A B -1.0774
196 S B -1.3192
197 E B -2.3088
198 V B 0.0000
199 S B -0.7320
200 F B -0.5707
201 S B -0.6152
202 A B -1.1394
203 L B 0.0000
204 E B -1.6265
205 R B -2.5023
206 L B 0.0000
207 V B 0.0000
208 T B -1.5450
209 R B -1.5678
210 C B 0.0000
211 P B -1.3708
212 N B -1.9095
213 L B 0.0000
214 K B -2.2510
215 S B 0.0000
216 L B 0.0000
217 K B -0.7737
218 L B 0.0000
219 N B 0.0000
220 R B -2.1967
221 A B -1.4259
222 V B 0.0000
223 P B -1.3229
224 L B 0.0000
225 E B -2.0592
226 K B -1.5478
227 L B 0.0000
228 A B -0.7774
229 T B -1.2641
230 L B 0.0000
231 L B 0.0000
232 Q B -1.7552
233 R B -2.2862
234 A B 0.0000
235 P B -2.0361
236 Q B -2.4546
237 L B 0.0000
238 E B -2.9257
239 E B -1.8999
240 L B 0.0000
241 G B 0.0000
242 T B 0.0000
243 G B 0.0000
244 G B 0.0000
245 Y B 0.0000
246 T B -0.8154
247 A B -0.8893
248 E B -1.3102
249 V B 0.2855
250 R B -1.1291
251 P B -1.2752
252 D B -1.8716
253 V B -1.3187
254 Y B -0.3366
255 S B -0.3345
256 G B -0.4330
257 L B 0.0000
258 S B 0.5875
259 V B 1.4351
260 A B 0.1248
261 L B 0.0000
262 S B -0.2216
263 G B -0.8994
264 C B 0.0000
265 K B -3.3392
266 E B -3.8999
267 L B 0.0000
268 R B -2.7911
269 C B -1.4313
270 L B 0.0000
271 S B 0.0000
272 G B -0.3252
273 F B 0.0000
274 W B 0.0000
275 D B -1.1145
276 A B 0.0000
277 V B -0.0514
278 P B -0.0951
279 A B 0.1317
280 Y B 0.0000
281 L B 0.0000
282 P B -0.2377
283 A B 0.0000
284 V B 0.0000
285 Y B -0.1960
286 S B -0.5522
287 V B 0.0000
288 C B 0.0000
289 S B -1.7662
290 R B -3.3054
291 L B 0.0000
292 T B -1.8014
293 T B -1.1684
294 L B 0.0000
295 N B -0.1256
296 L B 0.0000
297 S B 0.6022
298 Y B 1.0459
299 A B 0.0000
300 T B -0.2455
301 V B 0.0000
302 Q B -0.9366
303 S B -0.2768
304 Y B 0.4540
305 D B -0.5108
306 L B 0.0000
307 V B -0.3006
308 K B -0.8884
309 L B 0.0000
310 L B 0.0000
311 C B -0.1047
312 Q B -1.1210
313 C B 0.0000
314 P B -1.7355
315 K B -3.0034
316 L B 0.0000
317 Q B -1.9086
318 R B -1.5067
319 L B 0.0000
320 W B 0.0355
321 V B 0.0000
322 L B 0.0000
323 D B 0.0000
324 Y B -0.4003
325 I B 0.0000
326 E B -0.7032
327 D B -0.9587
328 A B -0.5104
329 G B 0.0000
330 L B 0.0000
331 E B -1.5047
332 V B -0.4149
333 L B 0.0000
334 A B 0.0000
335 S B -0.5129
336 T B -0.7545
337 C B 0.0000
338 K B -1.9919
339 D B -2.0750
340 L B 0.0000
341 R B -1.9760
342 E B 0.0000
343 L B 0.0000
344 R B -0.3401
345 V B 0.0000
346 F B 0.3603
347 P B 0.0000
348 S B -0.3362
349 E B -1.2828
350 P B 0.0000
351 F B -0.1472
352 V B 0.5012
353 M B 0.0646
354 E B -1.5796
355 P B -1.2234
356 N B -1.1106
357 V B -0.8290
358 A B -0.3569
359 L B 0.0000
360 T B -0.6101
361 E B -0.6828
362 Q B -1.1734
363 G B 0.0000
364 L B 0.0000
365 V B 0.0000
366 S B 0.0000
367 V B 0.0000
368 S B 0.0000
369 M B 0.4747
370 G B -0.2693
371 C B 0.0000
372 P B -1.0882
373 K B -1.9197
374 L B 0.0000
375 E B -1.8501
376 S B 0.0000
377 V B 0.0000
378 L B 0.0000
379 Y B 0.0000
380 F B 0.0000
381 C B 0.0000
382 R B -0.8524
383 Q B -0.4762
384 M B 0.0000
385 T B 0.0000
386 N B 0.0000
387 A B 0.7087
388 A B 0.0000
389 L B 0.0000
390 I B 0.5535
391 T B -0.1119
392 I B 0.0000
393 A B 0.0000
394 R B -1.9013
395 N B -0.9221
396 R B -1.3314
397 P B -2.1258
398 N B -2.2564
399 M B 0.0000
400 T B -2.4211
401 R B -1.9525
402 F B 0.0000
403 R B -0.8243
404 L B 0.0000
405 C B 0.0000
406 I B 0.0000
407 I B 0.0000
408 E B -2.0531
409 P B -1.5818
410 K B -1.8839
411 A B -1.1410
412 P B -0.1981
413 D B 0.0000
414 Y B 1.5275
415 L B 1.9969
416 T B 1.0602
417 L B 1.3493
418 E B -0.4265
419 P B -0.4937
420 L B 0.0000
421 D B 0.0000
422 I B 1.1886
423 G B 0.0000
424 F B 0.0000
425 G B 0.0000
426 A B 0.0000
427 I B 0.0000
428 V B 0.0000
429 E B -1.3817
430 H B -1.8768
431 C B 0.0000
432 K B -3.5840
433 D B -4.1220
434 L B 0.0000
435 R B -3.4754
436 R B -2.1804
437 L B 0.0000
438 S B -0.4535
439 L B 0.0000
440 S B 0.0000
441 G B 0.0000
442 L B -0.6855
443 L B 0.0000
444 T B -1.3806
445 D B -1.5497
446 K B -1.7210
447 V B 0.0000
448 F B 0.0000
449 E B -1.2196
450 Y B -0.4124
451 I B 0.0000
452 G B 0.0000
453 T B -0.5090
454 Y B -0.8180
455 A B 0.0000
456 K B -3.0067
457 K B -3.6284
458 M B 0.0000
459 E B -2.1281
460 M B -1.2228
461 L B 0.0000
462 S B -0.2044
463 V B 0.0000
464 A B 0.0000
465 F B -0.5149
466 A B 0.0000
467 G B -1.3162
468 D B -2.0058
469 S B -1.0981
470 D B -0.8846
471 L B -0.1167
472 G B 0.0000
473 M B 0.0000
474 H B -0.4238
475 H B -0.5733
476 V B 0.0000
477 L B 0.0000
478 S B -0.8368
479 G B -0.9765
480 C B 0.0000
481 D B -2.6951
482 S B -2.2284
483 L B 0.0000
484 R B -2.0396
485 K B 0.0000
486 L B 0.0000
487 E B 0.0000
488 I B 0.0000
489 R B 0.0000
490 D B -0.4101
491 C B 0.0000
492 P B -0.7287
493 F B 0.0000
494 G B 0.0000
495 D B -1.3307
496 K B -1.8412
497 A B 0.0000
498 L B 0.0000
499 L B -0.4826
500 A B -0.5624
501 N B 0.0000
502 A B 0.0000
503 S B -1.0035
504 K B -1.5195
505 L B 0.0000
506 E B -2.3256
507 T B -1.6676
508 M B 0.0000
509 R B -1.4913
510 S B 0.0000
511 L B 0.0000
512 W B 0.0000
513 M B 0.0000
514 S B 0.0000
515 S B -0.6353
516 C B -0.4915
517 S B -0.7592
518 V B 0.0000
519 S B 0.0000
520 F B 0.0000
521 G B -1.4081
522 A B 0.0000
523 C B 0.0000
524 K B -1.6536
525 L B -0.5190
526 L B 0.0000
527 G B -1.4712
528 Q B -2.0805
529 K B -2.1272
530 M B -1.7648
531 P B -1.8654
532 K B -2.2468
533 L B 0.0000
534 N B 0.0000
535 V B 0.0000
536 E B 0.0000
537 V B 0.0000
538 I B 0.0000
539 D B 0.0000
540 E B -2.6739
541 R B -2.4395
542 G B -1.8278
543 A B -1.3862
544 P B 0.0000
545 D B -2.4288
546 S B -1.7197
547 R B -1.7295
548 P B -1.7383
549 E B -2.6931
550 S B -1.2893
551 C B -0.9905
552 P B -0.8008
553 V B 0.0000
554 E B -1.3363
555 R B -0.8355
556 V B 0.0000
557 F B 0.0000
558 I B 0.0000
559 Y B 0.0000
560 R B -1.6916
561 T B 0.0000
562 V B 1.1890
563 A B 0.4831
564 G B -0.0461
565 P B 0.1204
566 R B 0.0000
567 F B 1.7291
568 D B 0.6111
569 M B 0.4208
570 P B -0.2351
571 G B -0.6647
572 F B -0.8176
573 V B 0.0000
574 W B 0.1746
575 N B -0.2458
576 M B -0.4579
1 Q C -0.6384
2 V C 0.8536
3 V C 1.5970
4 G C 0.3567
5 W C 0.2784
6 P C 0.0000
7 P C -0.2710
8 V C -0.6677
9 R C -2.1911
10 N C -1.9575
11 Y C -0.8973
12 R C -2.5045
13 K C -2.4350

 

Laboratory of Theory of Biopolymers 2015