Chain sequence(s) |
A: MELEKFVDPMPIMKTAIPKKTSKDGDYYEIEMKEFSQKLHRDLNPTRLWGYDGQFPGPTIEVMRGKPARIKWMNNLPDTHFLPIDRSIHHVAHEPEVRTVVHLHGSETTPASDGYPEAWFTKDFAEVGSFFEQETYEYPNDQRAATLWYHDHAMGITRLNVYAGLSGLYIIRDPREEQLNLPKGEFDIPLLIQDRSFNDDGSLFYPAQPANPAPNLPNPSVLPFFVGDTILVNGKVWPYLQVEPRKYRFRILNGSNSRSYQLALDSEAPFYQIASDGGLLRRTVSLQAFDIRPAERIEAIIDFSKFEGQTITLKNNASTDATADVMQFQVVLPLSGEDTSIIPQNLSYIPSLQQNDVKRIRNLKISGTTDEYGRPLLLLNNKLWSDPVEEKPCLGTTEIWSFVNVTNVPHPMHIHLVQFQLLDHRAFNVELYNENGQIELVGPTIPPKINERGWKDTITAPAGQITRVIARFAPFSGYYVWHCHILEHEDYDMMRPFVVIDPKTEKERRLE
input PDB |
Selected Chain(s) | A |
Distance of aggregation | 10 Å |
FoldX usage | Yes |
Dynamic mode | No |
Automated mutations | No |
Downloads | Download all the data |
Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:01:27) [WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow to prevent this behavior) (00:01:27) [INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:01:28) [INFO] runJob: Creating pdb object from: input.pdb (00:01:28) [INFO] FoldX: Starting FoldX energy minimalization (00:01:28) [INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:20:47) [CRITICAL] pyMol: Pymol encountered an error: /bin/sh: pymol: command not found Movie creation failed. (00:20:47) [INFO] Main: Simulation completed successfully. (00:20:53) |
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 | |
1 | M | A | 0.0692 | |
2 | E | A | -1.8367 | |
3 | L | A | -1.5038 | |
4 | E | A | -2.8592 | |
5 | K | A | -1.8323 | |
6 | F | A | 0.0000 | |
7 | V | A | -0.8443 | |
8 | D | A | -1.3436 | |
9 | P | A | 0.0538 | |
10 | M | A | 0.5952 | |
11 | P | A | 0.5636 | |
12 | I | A | 1.4979 | |
13 | M | A | 0.0000 | |
14 | K | A | -0.9700 | |
15 | T | A | -0.2302 | |
16 | A | A | 0.0000 | |
17 | I | A | 0.7168 | |
18 | P | A | -0.8171 | |
19 | K | A | -2.1819 | |
20 | K | A | -2.6249 | |
21 | T | A | -1.8997 | |
22 | S | A | -2.0119 | |
23 | K | A | -2.9439 | |
24 | D | A | -2.8737 | |
25 | G | A | 0.0000 | |
26 | D | A | -1.7874 | |
27 | Y | A | -1.3320 | |
28 | Y | A | 0.0000 | |
29 | E | A | -1.2250 | |
30 | I | A | 0.0000 | |
31 | E | A | -1.0555 | |
32 | M | A | 0.0000 | |
33 | K | A | -0.7620 | |
34 | E | A | -0.9097 | |
35 | F | A | 0.2267 | |
36 | S | A | -0.6027 | |
37 | Q | A | 0.0000 | |
38 | K | A | -2.0010 | |
39 | L | A | 0.0000 | |
40 | H | A | 0.0000 | |
41 | R | A | -3.1365 | |
42 | D | A | -3.1558 | |
43 | L | A | -1.9532 | |
44 | N | A | -2.3270 | |
45 | P | A | -1.9185 | |
46 | T | A | 0.0000 | |
47 | R | A | -1.3349 | |
48 | L | A | 0.0000 | |
49 | W | A | 0.0000 | |
50 | G | A | 0.0000 | |
51 | Y | A | 0.0000 | |
52 | D | A | -1.0499 | |
53 | G | A | -0.5607 | |
54 | Q | A | -0.1339 | |
55 | F | A | 0.0000 | |
56 | P | A | 0.0000 | |
57 | G | A | 0.0000 | |
58 | P | A | 0.0000 | |
59 | T | A | 0.0000 | |
60 | I | A | 0.0000 | |
61 | E | A | -0.9266 | |
62 | V | A | 0.0000 | |
63 | M | A | -1.2462 | |
64 | R | A | -3.0309 | |
65 | G | A | -2.4080 | |
66 | K | A | -2.3963 | |
67 | P | A | -1.6935 | |
68 | A | A | 0.0000 | |
69 | R | A | -1.3977 | |
70 | I | A | 0.0000 | |
71 | K | A | -1.2415 | |
72 | W | A | 0.0000 | |
73 | M | A | -0.2774 | |
74 | N | A | 0.0000 | |
75 | N | A | -1.0936 | |
76 | L | A | 0.0000 | |
77 | P | A | -1.0945 | |
78 | D | A | -1.9327 | |
79 | T | A | -1.2107 | |
80 | H | A | -1.2772 | |
81 | F | A | 0.0000 | |
82 | L | A | 0.0000 | |
83 | P | A | -1.4041 | |
84 | I | A | 0.0000 | |
85 | D | A | -3.0552 | |
86 | R | A | -3.3726 | |
87 | S | A | -2.2078 | |
88 | I | A | 0.0000 | |
89 | H | A | -2.2685 | |
90 | H | A | 0.0000 | |
91 | V | A | 0.0000 | |
92 | A | A | -2.2403 | |
93 | H | A | -1.9733 | |
94 | E | A | -2.1267 | |
95 | P | A | -2.0915 | |
96 | E | A | -1.8709 | |
97 | V | A | 0.0000 | |
98 | R | A | 0.0000 | |
99 | T | A | 0.0000 | |
100 | V | A | 0.0000 | |
101 | V | A | 0.0000 | |
102 | H | A | 0.0000 | |
103 | L | A | 0.0000 | |
104 | H | A | 0.0000 | |
105 | G | A | -0.4239 | |
106 | S | A | 0.0000 | |
107 | E | A | -1.0947 | |
108 | T | A | 0.0000 | |
109 | T | A | -0.2556 | |
110 | P | A | 0.0000 | |
111 | A | A | 0.5661 | |
112 | S | A | 0.0000 | |
113 | D | A | 0.0000 | |
114 | G | A | 0.0000 | |
115 | Y | A | 0.0000 | |
116 | P | A | 0.3001 | |
117 | E | A | 0.0000 | |
118 | A | A | -0.0639 | |
119 | W | A | 0.6848 | |
120 | F | A | 1.0528 | |
121 | T | A | 0.0000 | |
122 | K | A | -1.3209 | |
123 | D | A | -2.3489 | |
124 | F | A | 0.0000 | |
125 | A | A | 0.0000 | |
126 | E | A | -1.3229 | |
127 | V | A | -0.7582 | |
128 | G | A | -0.7173 | |
129 | S | A | -0.2851 | |
130 | F | A | 0.4641 | |
131 | F | A | 0.0000 | |
132 | E | A | -1.4006 | |
133 | Q | A | -1.5188 | |
134 | E | A | -1.3596 | |
135 | T | A | -1.0803 | |
136 | Y | A | 0.0000 | |
137 | E | A | -1.0422 | |
138 | Y | A | 0.0000 | |
139 | P | A | -1.4119 | |
140 | N | A | 0.0000 | |
141 | D | A | -2.7712 | |
142 | Q | A | -2.2874 | |
143 | R | A | -2.5954 | |
144 | A | A | 0.0000 | |
145 | A | A | 0.0000 | |
146 | T | A | 0.0000 | |
147 | L | A | 0.0000 | |
148 | W | A | 0.0000 | |
149 | Y | A | 0.0000 | |
150 | H | A | 0.0000 | |
151 | D | A | 0.0000 | |
152 | H | A | 0.0000 | |
153 | A | A | 0.0000 | |
154 | M | A | 0.1237 | |
155 | G | A | -0.3891 | |
156 | I | A | 0.0000 | |
157 | T | A | 0.0000 | |
158 | R | A | 0.0000 | |
159 | L | A | 0.0000 | |
160 | N | A | 0.0000 | |
161 | V | A | 0.0000 | |
162 | Y | A | 0.0000 | |
163 | A | A | 0.0000 | |
164 | G | A | 0.0000 | |
165 | L | A | 0.0000 | |
166 | S | A | 0.0000 | |
167 | G | A | 0.0000 | |
168 | L | A | 0.0000 | |
169 | Y | A | 0.0000 | |
170 | I | A | 0.0000 | |
171 | I | A | 0.0000 | |
172 | R | A | -2.3185 | |
173 | D | A | -3.0563 | |
174 | P | A | -2.2221 | |
175 | R | A | -3.7333 | |
176 | E | A | -3.7546 | |
177 | E | A | -4.0506 | |
178 | Q | A | -2.9367 | |
179 | L | A | 0.0000 | |
180 | N | A | -2.2011 | |
181 | L | A | -1.6803 | |
182 | P | A | -1.5217 | |
183 | K | A | -2.6018 | |
184 | G | A | -1.4471 | |
185 | E | A | -1.2650 | |
186 | F | A | -0.8425 | |
187 | D | A | -1.0072 | |
188 | I | A | -0.1580 | |
189 | P | A | -0.1319 | |
190 | L | A | 0.0000 | |
191 | L | A | 0.0000 | |
192 | I | A | 0.0000 | |
193 | Q | A | 0.0000 | |
194 | D | A | 0.0000 | |
195 | R | A | 0.0000 | |
196 | S | A | 0.0000 | |
197 | F | A | -0.8130 | |
198 | N | A | -1.7619 | |
199 | D | A | -2.8903 | |
200 | D | A | -2.8485 | |
201 | G | A | -1.8068 | |
202 | S | A | -0.9560 | |
203 | L | A | 0.0192 | |
204 | F | A | 0.3980 | |
205 | Y | A | 0.0000 | |
206 | P | A | 0.0000 | |
207 | A | A | -0.8311 | |
208 | Q | A | -1.7079 | |
209 | P | A | -1.2254 | |
210 | A | A | -1.6427 | |
211 | N | A | -1.8568 | |
212 | P | A | -1.4676 | |
213 | A | A | -1.0562 | |
214 | P | A | -1.0555 | |
215 | N | A | -1.4374 | |
216 | L | A | -0.9235 | |
217 | P | A | -0.7067 | |
218 | N | A | -0.7381 | |
219 | P | A | -0.1865 | |
220 | S | A | 0.0000 | |
221 | V | A | 0.4851 | |
222 | L | A | 0.9169 | |
223 | P | A | 0.5668 | |
224 | F | A | 1.0039 | |
225 | F | A | 0.0000 | |
226 | V | A | 0.2629 | |
227 | G | A | 0.0000 | |
228 | D | A | -1.5696 | |
229 | T | A | 0.0000 | |
230 | I | A | 0.0000 | |
231 | L | A | 0.0000 | |
232 | V | A | 0.0000 | |
233 | N | A | 0.0000 | |
234 | G | A | 0.0000 | |
235 | K | A | 0.0000 | |
236 | V | A | 0.0000 | |
237 | W | A | 0.0000 | |
238 | P | A | 0.0000 | |
239 | Y | A | -0.3251 | |
240 | L | A | 0.0000 | |
241 | Q | A | -1.1427 | |
242 | V | A | 0.0000 | |
243 | E | A | -0.7881 | |
244 | P | A | 0.0000 | |
245 | R | A | -1.1170 | |
246 | K | A | 0.0000 | |
247 | Y | A | 0.0000 | |
248 | R | A | 0.0000 | |
249 | F | A | 0.0000 | |
250 | R | A | 0.0000 | |
251 | I | A | 0.0000 | |
252 | L | A | 0.0000 | |
253 | N | A | 0.0000 | |
254 | G | A | 0.0000 | |
255 | S | A | 0.0000 | |
256 | N | A | 0.0000 | |
257 | S | A | 0.2207 | |
258 | R | A | 0.0000 | |
259 | S | A | -0.9951 | |
260 | Y | A | 0.0000 | |
261 | Q | A | -1.8855 | |
262 | L | A | 0.0000 | |
263 | A | A | 0.0000 | |
264 | L | A | 0.0000 | |
265 | D | A | -1.5562 | |
266 | S | A | -1.5811 | |
267 | E | A | -2.5740 | |
268 | A | A | 0.0000 | |
269 | P | A | -1.0595 | |
270 | F | A | 0.0000 | |
271 | Y | A | -0.3547 | |
272 | Q | A | -0.3780 | |
273 | I | A | 0.0000 | |
274 | A | A | 0.0000 | |
275 | S | A | 0.0000 | |
276 | D | A | 0.0000 | |
277 | G | A | 0.0000 | |
278 | G | A | 0.0000 | |
279 | L | A | 0.0000 | |
280 | L | A | 0.0000 | |
281 | R | A | 0.0000 | |
282 | R | A | -1.9016 | |
283 | T | A | 0.0000 | |
284 | V | A | -0.9291 | |
285 | S | A | -0.5032 | |
286 | L | A | -0.4076 | |
287 | Q | A | -1.5123 | |
288 | A | A | -1.2945 | |
289 | F | A | 0.0000 | |
290 | D | A | -2.3424 | |
291 | I | A | 0.0000 | |
292 | R | A | -1.2410 | |
293 | P | A | 0.0000 | |
294 | A | A | 0.0000 | |
295 | E | A | -0.7257 | |
296 | R | A | 0.0000 | |
297 | I | A | 0.0000 | |
298 | E | A | 0.0000 | |
299 | A | A | 0.0000 | |
300 | I | A | 0.0000 | |
301 | I | A | 0.0000 | |
302 | D | A | -0.5879 | |
303 | F | A | 0.0000 | |
304 | S | A | -1.4912 | |
305 | K | A | -2.4857 | |
306 | F | A | 0.0000 | |
307 | E | A | -1.3977 | |
308 | G | A | -1.0930 | |
309 | Q | A | -1.5193 | |
310 | T | A | -1.0857 | |
311 | I | A | 0.0000 | |
312 | T | A | -0.7937 | |
313 | L | A | 0.0000 | |
314 | K | A | -1.2369 | |
315 | N | A | 0.0000 | |
316 | N | A | -1.4927 | |
317 | A | A | -1.2116 | |
318 | S | A | -1.0470 | |
319 | T | A | -0.9247 | |
320 | D | A | -1.8600 | |
321 | A | A | -0.9831 | |
322 | T | A | 0.0000 | |
323 | A | A | -0.7788 | |
324 | D | A | -0.9541 | |
325 | V | A | 0.0000 | |
326 | M | A | 0.0000 | |
327 | Q | A | -0.8005 | |
328 | F | A | 0.0000 | |
329 | Q | A | -1.1279 | |
330 | V | A | 0.0000 | |
331 | V | A | 0.8520 | |
332 | L | A | 1.1305 | |
333 | P | A | 0.3862 | |
334 | L | A | -0.4491 | |
335 | S | A | -0.7491 | |
336 | G | A | -1.4071 | |
337 | E | A | -1.8490 | |
338 | D | A | -1.2078 | |
339 | T | A | -0.7670 | |
340 | S | A | -0.0796 | |
341 | I | A | 1.2699 | |
342 | I | A | 0.0000 | |
343 | P | A | -0.7843 | |
344 | Q | A | -1.7525 | |
345 | N | A | -2.1682 | |
346 | L | A | 0.0000 | |
347 | S | A | -0.7447 | |
348 | Y | A | 0.4036 | |
349 | I | A | 0.0000 | |
350 | P | A | -0.1766 | |
351 | S | A | -0.6492 | |
352 | L | A | -1.4092 | |
353 | Q | A | -2.5538 | |
354 | Q | A | -2.8932 | |
355 | N | A | -3.0721 | |
356 | D | A | -3.3036 | |
357 | V | A | -2.5178 | |
358 | K | A | -2.7587 | |
359 | R | A | -1.7923 | |
360 | I | A | 0.4397 | |
361 | R | A | -0.4262 | |
362 | N | A | -1.3040 | |
363 | L | A | 0.0000 | |
364 | K | A | -1.9935 | |
365 | I | A | 0.0000 | |
366 | S | A | -0.8076 | |
367 | G | A | -0.4802 | |
368 | T | A | -0.6545 | |
369 | T | A | -0.9596 | |
370 | D | A | -1.3489 | |
371 | E | A | -1.2940 | |
372 | Y | A | -0.9606 | |
373 | G | A | -1.2181 | |
374 | R | A | -1.4566 | |
375 | P | A | -0.9467 | |
376 | L | A | 0.0000 | |
377 | L | A | 0.0000 | |
378 | L | A | 0.0000 | |
379 | L | A | 0.0000 | |
380 | N | A | -1.8685 | |
381 | N | A | -2.1152 | |
382 | K | A | -1.8930 | |
383 | L | A | -0.8363 | |
384 | W | A | -1.0224 | |
385 | S | A | -1.0098 | |
386 | D | A | -2.0054 | |
387 | P | A | -1.2287 | |
388 | V | A | -0.6397 | |
389 | E | A | -2.0397 | |
390 | E | A | -1.3072 | |
391 | K | A | -1.7946 | |
392 | P | A | 0.0000 | |
393 | C | A | -1.3939 | |
394 | L | A | -0.8298 | |
395 | G | A | -0.9086 | |
396 | T | A | 0.0000 | |
397 | T | A | 0.0000 | |
398 | E | A | 0.0000 | |
399 | I | A | -0.4970 | |
400 | W | A | 0.0000 | |
401 | S | A | -0.3984 | |
402 | F | A | 0.0000 | |
403 | V | A | -0.3505 | |
404 | N | A | 0.0000 | |
405 | V | A | -0.1743 | |
406 | T | A | -0.3530 | |
407 | N | A | -0.8485 | |
408 | V | A | 0.2112 | |
409 | P | A | 0.0413 | |
410 | H | A | 0.0000 | |
411 | P | A | 0.0000 | |
412 | M | A | 0.0000 | |
413 | H | A | 0.0000 | |
414 | I | A | 0.0000 | |
415 | H | A | 0.0000 | |
416 | L | A | 0.0000 | |
417 | V | A | 0.0000 | |
418 | Q | A | -0.7418 | |
419 | F | A | 0.0000 | |
420 | Q | A | 0.0000 | |
421 | L | A | 0.0000 | |
422 | L | A | -0.3671 | |
423 | D | A | -0.3594 | |
424 | H | A | 0.0027 | |
425 | R | A | 0.0000 | |
426 | A | A | 0.2451 | |
427 | F | A | 0.6225 | |
428 | N | A | 0.3570 | |
429 | V | A | 0.5725 | |
430 | E | A | -0.4454 | |
431 | L | A | 1.1327 | |
432 | Y | A | 0.4715 | |
433 | N | A | -1.7661 | |
434 | E | A | -2.5613 | |
435 | N | A | -2.5780 | |
436 | G | A | -1.7168 | |
437 | Q | A | -1.5817 | |
438 | I | A | 0.5165 | |
439 | E | A | 0.6952 | |
440 | L | A | 1.1968 | |
441 | V | A | 0.8852 | |
442 | G | A | 0.0671 | |
443 | P | A | 0.0816 | |
444 | T | A | 0.2824 | |
445 | I | A | 0.6632 | |
446 | P | A | -0.1769 | |
447 | P | A | 0.0000 | |
448 | K | A | -2.0769 | |
449 | I | A | -1.1689 | |
450 | N | A | -2.0633 | |
451 | E | A | -2.6020 | |
452 | R | A | -1.6901 | |
453 | G | A | 0.0000 | |
454 | W | A | -0.2087 | |
455 | K | A | -0.3100 | |
456 | D | A | 0.0000 | |
457 | T | A | 0.0000 | |
458 | I | A | 0.0000 | |
459 | T | A | -0.2388 | |
460 | A | A | 0.0000 | |
461 | P | A | -0.0472 | |
462 | A | A | -0.1281 | |
463 | G | A | 0.0471 | |
464 | Q | A | 0.0103 | |
465 | I | A | -0.1155 | |
466 | T | A | 0.0000 | |
467 | R | A | -0.1662 | |
468 | V | A | 0.0000 | |
469 | I | A | 0.0000 | |
470 | A | A | 0.0000 | |
471 | R | A | -1.3872 | |
472 | F | A | 0.0000 | |
473 | A | A | -0.6291 | |
474 | P | A | -0.5146 | |
475 | F | A | 0.0000 | |
476 | S | A | -0.5572 | |
477 | G | A | 0.0000 | |
478 | Y | A | -0.3096 | |
479 | Y | A | 0.0000 | |
480 | V | A | 0.0000 | |
481 | W | A | 0.0000 | |
482 | H | A | 0.0000 | |
483 | C | A | 0.0000 | |
484 | H | A | -0.1535 | |
485 | I | A | 0.0762 | |
486 | L | A | 0.0000 | |
487 | E | A | 0.0000 | |
488 | H | A | -0.4278 | |
489 | E | A | -0.5038 | |
490 | D | A | -0.7190 | |
491 | Y | A | 0.0000 | |
492 | D | A | -0.8320 | |
493 | M | A | 0.0000 | |
494 | M | A | 0.0000 | |
495 | R | A | 0.0000 | |
496 | P | A | 0.0000 | |
497 | F | A | 0.0000 | |
498 | V | A | 0.0000 | |
499 | V | A | 0.0000 | |
500 | I | A | 0.0000 | |
501 | D | A | -2.2555 | |
502 | P | A | -2.3260 | |
503 | K | A | -2.9728 | |
504 | T | A | -3.3329 | |
505 | E | A | -4.5249 | |
506 | K | A | -4.6572 | |
507 | E | A | -4.7565 | |
508 | R | A | -5.1371 | |
509 | R | A | -4.0336 | |
510 | L | A | -1.7577 | |
511 | E | A | -2.5817 |