Chain sequence(s) |
A: MSGPRSIRGVLATDTQLGAGNVIERLLDHGVEHDEPTLTFDTRTDAQPAWQTLSLGELDRCIARRAGWLHAHGIGRRDVVAVCSAHAPDYVLTFFAANRLGAIPAFVNNRLDEGTGVAYLRHIKPTAILADPAHRTVWSPYDLGASRLYAVEDLADEHPEAQIPPYRHRADDPVVLTHSSGTTGMPKAVISTHASLFAGLRHWLRRPRAQGSERMLSVLPMHNSMLAAVLSALCNRSQFLQLSSQSGRRALEAIERWRPSGVYGFPGTWVEILALSPSHDQLRSVRAWWNTGDSAHEAHIRRLIGFGRHDEATSRGRRTVDGSSFVDGFGSSEMGHSQFSIIHRPDTDHYNRCIGRPHSFAEVRVLGGDGIPVPDGSVGQLAVRSPTLFAGYWNDSARSYRSHHDGFYLTGDFGYRDGAGYYYHVDRTADAIQTATGTRIYTTLVEEQILARCPGLLDCTVVASDVDGEPHTEILLTLRPEAQCDPELDYETHILGLLDAAVARTVKNVRIAGSRIPTGATGKVRKFQLRV
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] (00:00:01) [WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow to prevent this behavior) (00:00:01) [INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:01) [INFO] runJob: Creating pdb object from: input.pdb (00:00:01) [INFO] FoldX: Starting FoldX energy minimalization (00:00:01) [INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:04:16) [INFO] Main: Simulation completed successfully. (00:04:20) |
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 | 0.7883 | |
2 | S | A | -0.3228 | |
3 | G | A | -0.9224 | |
4 | P | A | -1.2900 | |
5 | R | A | -2.1798 | |
6 | S | A | -1.2066 | |
7 | I | A | -0.5728 | |
8 | R | A | -1.3354 | |
9 | G | A | -1.3091 | |
10 | V | A | -0.6136 | |
11 | L | A | 0.0000 | |
12 | A | A | 0.0000 | |
13 | T | A | -0.5505 | |
14 | D | A | 0.0000 | |
15 | T | A | -0.6396 | |
16 | Q | A | -1.7961 | |
17 | L | A | 0.0000 | |
18 | G | A | -0.9677 | |
19 | A | A | 0.0000 | |
20 | G | A | 0.0000 | |
21 | N | A | -0.8548 | |
22 | V | A | 0.0000 | |
23 | I | A | 0.0000 | |
24 | E | A | -0.9077 | |
25 | R | A | -1.2627 | |
26 | L | A | 0.0000 | |
27 | L | A | -1.4970 | |
28 | D | A | -2.2385 | |
29 | H | A | -1.4700 | |
30 | G | A | -1.6240 | |
31 | V | A | -1.9342 | |
32 | E | A | -3.3358 | |
33 | H | A | -3.1298 | |
34 | D | A | -3.3656 | |
35 | E | A | -2.7466 | |
36 | P | A | -1.9240 | |
37 | T | A | 0.0000 | |
38 | L | A | 0.0000 | |
39 | T | A | 0.0000 | |
40 | F | A | 0.0000 | |
41 | D | A | 0.0000 | |
42 | T | A | -1.1610 | |
43 | R | A | -2.1516 | |
44 | T | A | 0.0000 | |
45 | D | A | 0.0000 | |
46 | A | A | -0.9945 | |
47 | Q | A | -1.0857 | |
48 | P | A | -1.2419 | |
49 | A | A | -1.1072 | |
50 | W | A | -0.5923 | |
51 | Q | A | -1.2840 | |
52 | T | A | -0.8804 | |
53 | L | A | 0.0000 | |
54 | S | A | -2.1053 | |
55 | L | A | 0.0000 | |
56 | G | A | 0.0000 | |
57 | E | A | -1.9979 | |
58 | L | A | 0.0000 | |
59 | D | A | -1.4860 | |
60 | R | A | -2.6425 | |
61 | C | A | -1.3300 | |
62 | I | A | 0.0000 | |
63 | A | A | -1.5679 | |
64 | R | A | 0.0000 | |
65 | R | A | 0.0000 | |
66 | A | A | 0.0000 | |
67 | G | A | 0.0000 | |
68 | W | A | 0.0000 | |
69 | L | A | 0.0000 | |
70 | H | A | -1.2681 | |
71 | A | A | -0.7030 | |
72 | H | A | -0.9231 | |
73 | G | A | -1.1770 | |
74 | I | A | 0.0000 | |
75 | G | A | -1.8695 | |
76 | R | A | -2.9018 | |
77 | R | A | -2.8132 | |
78 | D | A | -2.0546 | |
79 | V | A | 0.0000 | |
80 | V | A | 0.0000 | |
81 | A | A | 0.0000 | |
82 | V | A | 0.0000 | |
83 | C | A | 0.0000 | |
84 | S | A | 0.0000 | |
85 | A | A | -0.5565 | |
86 | H | A | -0.8303 | |
87 | A | A | 0.0000 | |
88 | P | A | 0.0000 | |
89 | D | A | 0.0000 | |
90 | Y | A | 0.0000 | |
91 | V | A | 0.0000 | |
92 | L | A | 0.0000 | |
93 | T | A | 0.0000 | |
94 | F | A | 0.0000 | |
95 | F | A | 0.0000 | |
96 | A | A | 0.0000 | |
97 | A | A | 0.0000 | |
98 | N | A | 0.0000 | |
99 | R | A | 0.0000 | |
100 | L | A | 0.0000 | |
101 | G | A | 0.0000 | |
102 | A | A | 0.0000 | |
103 | I | A | 0.0000 | |
104 | P | A | 0.0000 | |
105 | A | A | 0.0000 | |
106 | F | A | 0.0000 | |
107 | V | A | 0.0000 | |
108 | N | A | 0.0000 | |
109 | N | A | -1.4594 | |
110 | R | A | -2.5355 | |
111 | L | A | -2.0398 | |
112 | D | A | -2.9469 | |
113 | E | A | -2.3958 | |
114 | G | A | -1.5518 | |
115 | T | A | -1.3326 | |
116 | G | A | 0.0000 | |
117 | V | A | 0.0000 | |
118 | A | A | -1.0236 | |
119 | Y | A | 0.0000 | |
120 | L | A | 0.0000 | |
121 | R | A | -2.1885 | |
122 | H | A | -1.7635 | |
123 | I | A | 0.0000 | |
124 | K | A | -2.4524 | |
125 | P | A | 0.0000 | |
126 | T | A | -1.0074 | |
127 | A | A | 0.0000 | |
128 | I | A | 0.0000 | |
129 | L | A | 0.0000 | |
130 | A | A | 0.0000 | |
131 | D | A | 0.0000 | |
132 | P | A | -0.4717 | |
133 | A | A | -0.1164 | |
134 | H | A | -0.3636 | |
135 | R | A | -0.3132 | |
136 | T | A | -0.1373 | |
137 | V | A | 0.1516 | |
138 | W | A | 0.0000 | |
139 | S | A | -0.3548 | |
140 | P | A | -0.4229 | |
141 | Y | A | -0.6285 | |
142 | D | A | -1.8810 | |
143 | L | A | -1.5807 | |
144 | G | A | -1.5421 | |
145 | A | A | -0.9937 | |
146 | S | A | -1.1993 | |
147 | R | A | -0.6783 | |
148 | L | A | 0.0711 | |
149 | Y | A | -0.2701 | |
150 | A | A | -0.6635 | |
151 | V | A | 0.0000 | |
152 | E | A | -2.0651 | |
153 | D | A | -2.4432 | |
154 | L | A | 0.0000 | |
155 | A | A | -2.0089 | |
156 | D | A | -3.3239 | |
157 | E | A | -3.2626 | |
158 | H | A | -2.3693 | |
159 | P | A | -2.0783 | |
160 | E | A | -2.8989 | |
161 | A | A | -1.6165 | |
162 | Q | A | -1.8537 | |
163 | I | A | -0.7872 | |
164 | P | A | -0.6213 | |
165 | P | A | -0.7014 | |
166 | Y | A | -1.1812 | |
167 | R | A | -2.4103 | |
168 | H | A | -2.4114 | |
169 | R | A | -3.0347 | |
170 | A | A | -2.1453 | |
171 | D | A | -2.3848 | |
172 | D | A | 0.0000 | |
173 | P | A | -0.9114 | |
174 | V | A | 0.0000 | |
175 | V | A | 0.0000 | |
176 | L | A | 0.0000 | |
177 | T | A | 0.0000 | |
178 | H | A | 0.0000 | |
179 | S | A | -0.1347 | |
180 | S | A | 0.0000 | |
181 | G | A | 0.0000 | |
182 | T | A | -0.1354 | |
183 | T | A | -0.0148 | |
184 | G | A | -0.0047 | |
185 | M | A | 0.4297 | |
186 | P | A | 0.0000 | |
187 | K | A | -0.6511 | |
188 | A | A | 0.0000 | |
189 | V | A | 0.0000 | |
190 | I | A | 0.2558 | |
191 | S | A | 0.0000 | |
192 | T | A | 0.0000 | |
193 | H | A | 0.0000 | |
194 | A | A | -0.8981 | |
195 | S | A | 0.0000 | |
196 | L | A | 0.0000 | |
197 | F | A | 0.0000 | |
198 | A | A | -0.2143 | |
199 | G | A | 0.0000 | |
200 | L | A | 0.0000 | |
201 | R | A | -1.0632 | |
202 | H | A | -1.1194 | |
203 | W | A | -1.2830 | |
204 | L | A | 0.0000 | |
205 | R | A | -2.7730 | |
206 | R | A | -2.5769 | |
207 | P | A | -2.0818 | |
208 | R | A | -2.6918 | |
209 | A | A | -1.4184 | |
210 | Q | A | -1.3629 | |
211 | G | A | 0.0000 | |
212 | S | A | -1.2991 | |
213 | E | A | -1.5250 | |
214 | R | A | -1.5135 | |
215 | M | A | 0.0000 | |
216 | L | A | 0.0000 | |
217 | S | A | 0.0000 | |
218 | V | A | 0.0000 | |
219 | L | A | 0.0000 | |
220 | P | A | 0.0000 | |
221 | M | A | 0.0000 | |
222 | H | A | 0.0000 | |
223 | N | A | 0.0000 | |
224 | S | A | -0.0851 | |
225 | M | A | 0.0000 | |
226 | L | A | 0.0000 | |
227 | A | A | -0.0598 | |
228 | A | A | 0.0000 | |
229 | V | A | 0.0000 | |
230 | L | A | 0.0000 | |
231 | S | A | -0.1926 | |
232 | A | A | 0.0000 | |
233 | L | A | 0.0000 | |
234 | C | A | 0.0000 | |
235 | N | A | -1.0671 | |
236 | R | A | -1.0312 | |
237 | S | A | -1.3891 | |
238 | Q | A | -1.6081 | |
239 | F | A | 0.0000 | |
240 | L | A | 0.0000 | |
241 | Q | A | 0.0000 | |
242 | L | A | 0.0000 | |
243 | S | A | -0.4037 | |
244 | S | A | -0.8989 | |
245 | Q | A | -0.9731 | |
246 | S | A | -1.6800 | |
247 | G | A | 0.0000 | |
248 | R | A | -3.0706 | |
249 | R | A | -2.8749 | |
250 | A | A | 0.0000 | |
251 | L | A | 0.0000 | |
252 | E | A | -3.7114 | |
253 | A | A | 0.0000 | |
254 | I | A | 0.0000 | |
255 | E | A | -3.5935 | |
256 | R | A | -3.2854 | |
257 | W | A | -2.2219 | |
258 | R | A | -3.0770 | |
259 | P | A | 0.0000 | |
260 | S | A | -1.3726 | |
261 | G | A | 0.0000 | |
262 | V | A | 0.0000 | |
263 | Y | A | 0.3492 | |
264 | G | A | 0.0000 | |
265 | F | A | 0.0000 | |
266 | P | A | 0.0000 | |
267 | G | A | -0.7645 | |
268 | T | A | 0.0000 | |
269 | W | A | 0.0000 | |
270 | V | A | -0.6489 | |
271 | E | A | -1.7406 | |
272 | I | A | 0.0000 | |
273 | L | A | -0.7197 | |
274 | A | A | -0.8673 | |
275 | L | A | -0.6475 | |
276 | S | A | -0.6067 | |
277 | P | A | 0.0000 | |
278 | S | A | -1.2403 | |
279 | H | A | -2.2559 | |
280 | D | A | -2.7362 | |
281 | Q | A | -2.7714 | |
282 | L | A | 0.0000 | |
283 | R | A | -2.8231 | |
284 | S | A | -1.9823 | |
285 | V | A | 0.0000 | |
286 | R | A | -1.4273 | |
287 | A | A | 0.0000 | |
288 | W | A | 0.0000 | |
289 | W | A | 0.4536 | |
290 | N | A | 0.0000 | |
291 | T | A | -0.1689 | |
292 | G | A | -0.4389 | |
293 | D | A | -0.6943 | |
294 | S | A | -0.3590 | |
295 | A | A | 0.0000 | |
296 | H | A | 0.0000 | |
297 | E | A | -1.2798 | |
298 | A | A | -1.1946 | |
299 | H | A | 0.0000 | |
300 | I | A | 0.0000 | |
301 | R | A | -2.2380 | |
302 | R | A | -2.2717 | |
303 | L | A | 0.0000 | |
304 | I | A | 0.0000 | |
305 | G | A | -1.7173 | |
306 | F | A | 0.0000 | |
307 | G | A | 0.0000 | |
308 | R | A | -2.1017 | |
309 | H | A | -2.1192 | |
310 | D | A | -2.3270 | |
311 | E | A | -2.1096 | |
312 | A | A | -1.9796 | |
313 | T | A | -1.9730 | |
314 | S | A | -1.5414 | |
315 | R | A | -2.7393 | |
316 | G | A | -2.7134 | |
317 | R | A | -3.5895 | |
318 | R | A | -3.3320 | |
319 | T | A | -2.1567 | |
320 | V | A | -1.7386 | |
321 | D | A | -2.3342 | |
322 | G | A | 0.0000 | |
323 | S | A | 0.0000 | |
324 | S | A | -0.6076 | |
325 | F | A | 0.0000 | |
326 | V | A | 0.7730 | |
327 | D | A | 0.3224 | |
328 | G | A | 0.0000 | |
329 | F | A | -0.1902 | |
330 | G | A | -0.2183 | |
331 | S | A | -0.2230 | |
332 | S | A | 0.0000 | |
333 | E | A | 0.0000 | |
334 | M | A | 0.0000 | |
335 | G | A | 0.0000 | |
336 | H | A | -0.2547 | |
337 | S | A | -0.1917 | |
338 | Q | A | 0.0000 | |
339 | F | A | 0.0000 | |
340 | S | A | -0.1052 | |
341 | I | A | 0.0000 | |
342 | I | A | 1.4235 | |
343 | H | A | 0.0000 | |
344 | R | A | -1.5253 | |
345 | P | A | -2.3797 | |
346 | D | A | -2.5699 | |
347 | T | A | -2.0123 | |
348 | D | A | -2.7792 | |
349 | H | A | -1.5241 | |
350 | Y | A | 0.0000 | |
351 | N | A | -1.4653 | |
352 | R | A | 0.0000 | |
353 | C | A | 0.0000 | |
354 | I | A | 0.0000 | |
355 | G | A | 0.0000 | |
356 | R | A | -1.5502 | |
357 | P | A | -1.0513 | |
358 | H | A | -0.8197 | |
359 | S | A | -0.6518 | |
360 | F | A | -0.5883 | |
361 | A | A | -1.3028 | |
362 | E | A | -2.0018 | |
363 | V | A | 0.0000 | |
364 | R | A | -1.1530 | |
365 | V | A | 0.0000 | |
366 | L | A | 0.0000 | |
367 | G | A | -0.4085 | |
368 | G | A | -1.0579 | |
369 | D | A | -1.4336 | |
370 | G | A | -0.6033 | |
371 | I | A | 0.9807 | |
372 | P | A | 0.1376 | |
373 | V | A | -0.1742 | |
374 | P | A | -0.7999 | |
375 | D | A | -1.9330 | |
376 | G | A | -1.4236 | |
377 | S | A | -0.6900 | |
378 | V | A | -0.1684 | |
379 | G | A | 0.0000 | |
380 | Q | A | -0.4665 | |
381 | L | A | 0.0000 | |
382 | A | A | 0.0000 | |
383 | V | A | 0.0000 | |
384 | R | A | -2.5131 | |
385 | S | A | -1.2598 | |
386 | P | A | -0.6373 | |
387 | T | A | 0.0000 | |
388 | L | A | -0.2327 | |
389 | F | A | 0.0000 | |
390 | A | A | -0.0991 | |
391 | G | A | 0.0000 | |
392 | Y | A | 0.0000 | |
393 | W | A | -0.9439 | |
394 | N | A | -1.8850 | |
395 | D | A | -1.3188 | |
396 | S | A | -0.9771 | |
397 | A | A | -0.9895 | |
398 | R | A | -1.8592 | |
399 | S | A | -0.8822 | |
400 | Y | A | -0.2490 | |
401 | R | A | -1.8172 | |
402 | S | A | -1.0167 | |
403 | H | A | -1.4145 | |
404 | H | A | -1.4296 | |
405 | D | A | -2.0362 | |
406 | G | A | -1.4268 | |
407 | F | A | -1.5395 | |
408 | Y | A | 0.0000 | |
409 | L | A | -0.7320 | |
410 | T | A | -0.1155 | |
411 | G | A | -0.3099 | |
412 | D | A | -0.3232 | |
413 | F | A | 0.0863 | |
414 | G | A | 0.0000 | |
415 | Y | A | -0.6459 | |
416 | R | A | -1.7298 | |
417 | D | A | -1.4487 | |
418 | G | A | -1.2331 | |
419 | A | A | -0.6823 | |
420 | G | A | -0.9245 | |
421 | Y | A | -0.8354 | |
422 | Y | A | 0.0000 | |
423 | Y | A | 0.0000 | |
424 | H | A | 0.0000 | |
425 | V | A | 0.0000 | |
426 | D | A | 0.0000 | |
427 | R | A | -0.3757 | |
428 | T | A | -0.2202 | |
429 | A | A | 0.0245 | |
430 | D | A | 0.0000 | |
431 | A | A | -0.3616 | |
432 | I | A | -1.2535 | |
433 | Q | A | -2.0929 | |
434 | T | A | -1.5665 | |
435 | A | A | -0.8780 | |
436 | T | A | -0.5329 | |
437 | G | A | -0.9035 | |
438 | T | A | -0.9385 | |
439 | R | A | -1.3770 | |
440 | I | A | 0.0000 | |
441 | Y | A | -0.1265 | |
442 | T | A | 0.0000 | |
443 | T | A | 0.0000 | |
444 | L | A | 0.0087 | |
445 | V | A | 0.0000 | |
446 | E | A | 0.0000 | |
447 | E | A | 0.0000 | |
448 | Q | A | -1.1028 | |
449 | I | A | 0.0000 | |
450 | L | A | 0.0000 | |
451 | A | A | -1.3530 | |
452 | R | A | -1.9327 | |
453 | C | A | 0.0000 | |
454 | P | A | -0.8471 | |
455 | G | A | -1.1858 | |
456 | L | A | 0.0000 | |
457 | L | A | -0.5977 | |
458 | D | A | -0.5444 | |
459 | C | A | 0.0000 | |
460 | T | A | 0.0000 | |
461 | V | A | 0.0000 | |
462 | V | A | 0.0000 | |
463 | A | A | 0.0000 | |
464 | S | A | 0.0000 | |
465 | D | A | -2.6046 | |
466 | V | A | -1.7380 | |
467 | D | A | -2.7480 | |
468 | G | A | -2.6094 | |
469 | E | A | -2.8429 | |
470 | P | A | 0.0000 | |
471 | H | A | -1.4690 | |
472 | T | A | 0.0000 | |
473 | E | A | -0.7874 | |
474 | I | A | 0.0000 | |
475 | L | A | 0.0000 | |
476 | L | A | 0.0000 | |
477 | T | A | -0.3691 | |
478 | L | A | -0.4705 | |
479 | R | A | -1.4289 | |
480 | P | A | -1.5580 | |
481 | E | A | -2.4135 | |
482 | A | A | -1.9953 | |
483 | Q | A | -2.2901 | |
484 | C | A | -1.5767 | |
485 | D | A | -2.6176 | |
486 | P | A | -2.1330 | |
487 | E | A | -2.5632 | |
488 | L | A | -1.7785 | |
489 | D | A | -2.4821 | |
490 | Y | A | -1.5179 | |
491 | E | A | -1.6829 | |
492 | T | A | -0.9011 | |
493 | H | A | -0.9686 | |
494 | I | A | 0.0000 | |
495 | L | A | -0.3722 | |
496 | G | A | -0.4768 | |
497 | L | A | -0.3896 | |
498 | L | A | 0.0000 | |
499 | D | A | -1.8671 | |
500 | A | A | -1.1501 | |
501 | A | A | -1.0984 | |
502 | V | A | -0.9931 | |
503 | A | A | -1.1332 | |
504 | R | A | -2.0074 | |
505 | T | A | 0.0000 | |
506 | V | A | -0.9176 | |
507 | K | A | -1.2662 | |
508 | N | A | -1.3811 | |
509 | V | A | -1.1723 | |
510 | R | A | -1.3325 | |
511 | I | A | 0.2773 | |
512 | A | A | 0.0000 | |
513 | G | A | -0.8456 | |
514 | S | A | -1.0796 | |
515 | R | A | -1.7976 | |
516 | I | A | -0.8453 | |
517 | P | A | -0.5946 | |
518 | T | A | -0.5535 | |
519 | G | A | -0.8784 | |
520 | A | A | 0.0000 | |
521 | T | A | 0.0000 | |
522 | G | A | -0.8625 | |
523 | K | A | -0.4335 | |
524 | V | A | 0.0290 | |
525 | R | A | -0.2750 | |
526 | K | A | 0.0000 | |
527 | F | A | 0.4888 | |
528 | Q | A | -0.5347 | |
529 | L | A | 0.1458 | |
530 | R | A | 0.1238 | |
531 | V | A | 1.2449 |