Chain sequence(s) |
A: MNNNDIEYNAPSEIKYIDVVNTYDLEEEASKVVPHGGFNYIAGASGDEWTKRANDRAWKHKLLYPRLAQDVEAPDTSTEILGHKIKAPFIMAPIAAHGLAHTTKEAGTARAVSEFGTIMSISAYSGATFEEISEGLNGGPRWFQIYMAKDDQQNRDILDEAKSDGATAIILTADSTVSGNRDRDVKNKFVYPFGMPIVQRYLRGTAEGMSLNNIYGASKQKISPRDIEEIAAHSGLPVFVKGIQHPEDADMAIKAGASGIWVSNHGARQLYEAPGSFDTLPAIAERVNKRVPIVFDSGVRRGEHVAKALASGADVVALGRPVLFGLALGGWQGAYSVLDYFQKDLTRVMQLTGSQNVEDLKGLDLFDNPYGYEYLGGDSSGGGPGEPGGPGGPGEPGGPGGPGEPGGPGDGTCAVNYTVVNDWGHGMQGAITVSNTGSSPINNWTLQFSFSGVNISNGWNGEWSQSGSQITVRAPAWNSTLQPGQSVELGFVADKTGNVSPPSQFTLNGATCS
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 (00:04:08) [INFO] Main: Simulation completed successfully. (00:04:11) |
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 | -0.2946 | |
2 | N | A | -1.9213 | |
3 | N | A | -2.3290 | |
4 | N | A | -2.8264 | |
5 | D | A | -2.4100 | |
6 | I | A | -0.6136 | |
7 | E | A | -1.8075 | |
8 | Y | A | -0.9557 | |
9 | N | A | -1.3327 | |
10 | A | A | 0.0000 | |
11 | P | A | 0.0000 | |
12 | S | A | -1.1160 | |
13 | E | A | -1.6370 | |
14 | I | A | -0.3165 | |
15 | K | A | -0.9321 | |
16 | Y | A | 0.3432 | |
17 | I | A | 0.0194 | |
18 | D | A | -1.0249 | |
19 | V | A | 0.3369 | |
20 | V | A | 1.3758 | |
21 | N | A | 0.4120 | |
22 | T | A | 0.0000 | |
23 | Y | A | 0.4096 | |
24 | D | A | -0.7721 | |
25 | L | A | 0.0000 | |
26 | E | A | -1.6432 | |
27 | E | A | -2.8278 | |
28 | E | A | -2.5575 | |
29 | A | A | 0.0000 | |
30 | S | A | -1.9278 | |
31 | K | A | -2.2239 | |
32 | V | A | -0.6102 | |
33 | V | A | 0.0000 | |
34 | P | A | -0.8273 | |
35 | H | A | -1.2658 | |
36 | G | A | -1.1868 | |
37 | G | A | 0.0000 | |
38 | F | A | -0.5010 | |
39 | N | A | -1.0053 | |
40 | Y | A | 0.0000 | |
41 | I | A | 0.0000 | |
42 | A | A | 0.0000 | |
43 | G | A | 0.0000 | |
44 | A | A | 0.0000 | |
45 | S | A | 0.0000 | |
46 | G | A | -1.5942 | |
47 | D | A | -2.4309 | |
48 | E | A | -1.6319 | |
49 | W | A | -0.8111 | |
50 | T | A | 0.0000 | |
51 | K | A | -1.5441 | |
52 | R | A | -1.9264 | |
53 | A | A | -1.6517 | |
54 | N | A | 0.0000 | |
55 | D | A | -2.4077 | |
56 | R | A | -2.0084 | |
57 | A | A | 0.0000 | |
58 | W | A | 0.0000 | |
59 | K | A | -1.3625 | |
60 | H | A | -1.5072 | |
61 | K | A | -1.3364 | |
62 | L | A | -0.3130 | |
63 | L | A | 0.3845 | |
64 | Y | A | 1.0684 | |
65 | P | A | 0.5917 | |
66 | R | A | 0.0912 | |
67 | L | A | 0.9219 | |
68 | A | A | -0.0175 | |
69 | Q | A | -1.3539 | |
70 | D | A | -2.3609 | |
71 | V | A | -1.9052 | |
72 | E | A | -2.6233 | |
73 | A | A | -1.8583 | |
74 | P | A | -2.1798 | |
75 | D | A | -2.0346 | |
76 | T | A | 0.0000 | |
77 | S | A | -1.5965 | |
78 | T | A | -2.2288 | |
79 | E | A | -2.7556 | |
80 | I | A | 0.0000 | |
81 | L | A | -0.3036 | |
82 | G | A | -1.1605 | |
83 | H | A | -1.7318 | |
84 | K | A | -2.7772 | |
85 | I | A | 0.0000 | |
86 | K | A | -1.6899 | |
87 | A | A | 0.0000 | |
88 | P | A | 0.0000 | |
89 | F | A | 0.0000 | |
90 | I | A | 0.0000 | |
91 | M | A | 0.0000 | |
92 | A | A | 0.0000 | |
93 | P | A | 0.1056 | |
94 | I | A | 0.2953 | |
95 | A | A | 0.1178 | |
96 | A | A | 0.0000 | |
97 | H | A | 0.0000 | |
98 | G | A | 0.0000 | |
99 | L | A | 0.0000 | |
100 | A | A | 0.0000 | |
101 | H | A | 0.0000 | |
102 | T | A | -0.6819 | |
103 | T | A | -0.5743 | |
104 | K | A | -0.5517 | |
105 | E | A | 0.0000 | |
106 | A | A | -1.3334 | |
107 | G | A | 0.0000 | |
108 | T | A | 0.0000 | |
109 | A | A | 0.0000 | |
110 | R | A | -2.3181 | |
111 | A | A | 0.0000 | |
112 | V | A | 0.0000 | |
113 | S | A | -1.7901 | |
114 | E | A | -2.3927 | |
115 | F | A | 0.0000 | |
116 | G | A | -1.4551 | |
117 | T | A | 0.0000 | |
118 | I | A | 0.0000 | |
119 | M | A | 0.0000 | |
120 | S | A | 0.0000 | |
121 | I | A | 0.0000 | |
122 | S | A | 0.0000 | |
123 | A | A | 0.0000 | |
124 | Y | A | 0.0000 | |
125 | S | A | 0.0000 | |
126 | G | A | 0.0000 | |
127 | A | A | 0.0000 | |
128 | T | A | -0.9530 | |
129 | F | A | 0.0000 | |
130 | E | A | -2.7339 | |
131 | E | A | -2.3061 | |
132 | I | A | 0.0000 | |
133 | S | A | -2.5432 | |
134 | E | A | -3.2750 | |
135 | G | A | 0.0000 | |
136 | L | A | 0.0000 | |
137 | N | A | -2.6213 | |
138 | G | A | -1.4650 | |
139 | G | A | -1.4389 | |
140 | P | A | -0.6787 | |
141 | R | A | 0.0000 | |
142 | W | A | 0.0000 | |
143 | F | A | 0.0000 | |
144 | Q | A | 0.0000 | |
145 | I | A | 0.0000 | |
146 | Y | A | -0.1794 | |
147 | M | A | 0.0000 | |
148 | A | A | -2.0440 | |
149 | K | A | -3.4000 | |
150 | D | A | -3.2533 | |
151 | D | A | -3.5888 | |
152 | Q | A | -2.8666 | |
153 | Q | A | -2.6731 | |
154 | N | A | 0.0000 | |
155 | R | A | -2.4311 | |
156 | D | A | -2.4012 | |
157 | I | A | 0.0000 | |
158 | L | A | 0.0000 | |
159 | D | A | -2.6356 | |
160 | E | A | -1.9888 | |
161 | A | A | 0.0000 | |
162 | K | A | -2.3433 | |
163 | S | A | -1.6355 | |
164 | D | A | -1.6047 | |
165 | G | A | -1.2469 | |
166 | A | A | 0.0000 | |
167 | T | A | -0.3910 | |
168 | A | A | 0.0000 | |
169 | I | A | 0.0000 | |
170 | I | A | 0.0000 | |
171 | L | A | 0.0000 | |
172 | T | A | 0.0000 | |
173 | A | A | -0.4900 | |
174 | D | A | -0.1126 | |
175 | S | A | 0.0000 | |
176 | T | A | -0.1866 | |
177 | V | A | 1.0366 | |
178 | S | A | 0.0244 | |
179 | G | A | -0.1298 | |
180 | N | A | -1.2369 | |
181 | R | A | 0.0000 | |
182 | D | A | -2.2835 | |
183 | R | A | -2.1127 | |
184 | D | A | -1.2880 | |
185 | V | A | -0.6152 | |
186 | K | A | -2.2694 | |
187 | N | A | -2.2171 | |
188 | K | A | -1.9894 | |
189 | F | A | 0.0000 | |
190 | V | A | -0.2541 | |
191 | Y | A | 0.0000 | |
192 | P | A | -0.6554 | |
193 | F | A | -0.4580 | |
194 | G | A | -0.9661 | |
195 | M | A | 0.0000 | |
196 | P | A | -0.6046 | |
197 | I | A | 0.0000 | |
198 | V | A | 0.0000 | |
199 | Q | A | -2.0673 | |
200 | R | A | -2.4730 | |
201 | Y | A | -1.7256 | |
202 | L | A | -1.4879 | |
203 | R | A | -2.2894 | |
204 | G | A | -1.9801 | |
205 | T | A | -1.6959 | |
206 | A | A | 0.0000 | |
207 | E | A | -1.9292 | |
208 | G | A | -1.4313 | |
209 | M | A | -0.9786 | |
210 | S | A | -0.9578 | |
211 | L | A | 0.0000 | |
212 | N | A | -1.7309 | |
213 | N | A | -1.9056 | |
214 | I | A | 0.0000 | |
215 | Y | A | 0.0000 | |
216 | G | A | -1.3299 | |
217 | A | A | -1.4077 | |
218 | S | A | 0.0000 | |
219 | K | A | -2.2148 | |
220 | Q | A | -2.0643 | |
221 | K | A | -2.4473 | |
222 | I | A | -1.4367 | |
223 | S | A | -1.3323 | |
224 | P | A | -1.8707 | |
225 | R | A | -2.7713 | |
226 | D | A | 0.0000 | |
227 | I | A | 0.0000 | |
228 | E | A | -3.1980 | |
229 | E | A | -2.5937 | |
230 | I | A | 0.0000 | |
231 | A | A | -1.3121 | |
232 | A | A | -1.0588 | |
233 | H | A | -1.2586 | |
234 | S | A | 0.0000 | |
235 | G | A | -0.7084 | |
236 | L | A | -0.2960 | |
237 | P | A | -0.0143 | |
238 | V | A | 0.0000 | |
239 | F | A | 0.0000 | |
240 | V | A | 0.0000 | |
241 | K | A | 0.0000 | |
242 | G | A | -0.5749 | |
243 | I | A | 0.0000 | |
244 | Q | A | -1.4067 | |
245 | H | A | -2.0939 | |
246 | P | A | -2.2579 | |
247 | E | A | -2.6125 | |
248 | D | A | -2.4632 | |
249 | A | A | 0.0000 | |
250 | D | A | 0.0000 | |
251 | M | A | -1.1464 | |
252 | A | A | 0.0000 | |
253 | I | A | -1.2681 | |
254 | K | A | -1.9429 | |
255 | A | A | 0.0000 | |
256 | G | A | -1.6362 | |
257 | A | A | 0.0000 | |
258 | S | A | -0.2937 | |
259 | G | A | 0.0000 | |
260 | I | A | 0.0000 | |
261 | W | A | 0.0000 | |
262 | V | A | 0.0000 | |
263 | S | A | 0.0000 | |
264 | N | A | 0.0000 | |
265 | H | A | -0.1165 | |
266 | G | A | -0.2697 | |
267 | A | A | 0.0000 | |
268 | R | A | -0.1616 | |
269 | Q | A | 0.0000 | |
270 | L | A | 1.1834 | |
271 | Y | A | -0.0690 | |
272 | E | A | -1.2879 | |
273 | A | A | 0.0000 | |
274 | P | A | -0.6665 | |
275 | G | A | 0.0000 | |
276 | S | A | 0.0000 | |
277 | F | A | 0.0000 | |
278 | D | A | -1.8030 | |
279 | T | A | -1.0864 | |
280 | L | A | 0.0000 | |
281 | P | A | -1.0763 | |
282 | A | A | -1.6483 | |
283 | I | A | 0.0000 | |
284 | A | A | -2.1179 | |
285 | E | A | -3.0478 | |
286 | R | A | -3.1697 | |
287 | V | A | 0.0000 | |
288 | N | A | -3.3719 | |
289 | K | A | -3.3102 | |
290 | R | A | -2.3152 | |
291 | V | A | -1.1340 | |
292 | P | A | -0.8176 | |
293 | I | A | 0.0000 | |
294 | V | A | 0.0000 | |
295 | F | A | 0.0000 | |
296 | D | A | 0.0000 | |
297 | S | A | 0.0000 | |
298 | G | A | -1.0204 | |
299 | V | A | 0.0000 | |
300 | R | A | -0.6962 | |
301 | R | A | -1.0129 | |
302 | G | A | 0.0000 | |
303 | E | A | -0.9066 | |
304 | H | A | -0.8343 | |
305 | V | A | 0.0000 | |
306 | A | A | 0.0000 | |
307 | K | A | 0.0000 | |
308 | A | A | 0.0000 | |
309 | L | A | 0.0000 | |
310 | A | A | -1.1014 | |
311 | S | A | 0.0000 | |
312 | G | A | -1.2580 | |
313 | A | A | 0.0000 | |
314 | D | A | -1.3390 | |
315 | V | A | 0.0000 | |
316 | V | A | 0.0000 | |
317 | A | A | 0.0000 | |
318 | L | A | 0.0000 | |
319 | G | A | -0.0715 | |
320 | R | A | 0.0000 | |
321 | P | A | 0.0000 | |
322 | V | A | 0.0000 | |
323 | L | A | 0.0000 | |
324 | F | A | 0.0000 | |
325 | G | A | 0.0000 | |
326 | L | A | 0.0000 | |
327 | A | A | 0.0000 | |
328 | L | A | -0.3778 | |
329 | G | A | 0.0000 | |
330 | G | A | 0.0000 | |
331 | W | A | -0.5293 | |
332 | Q | A | -0.2984 | |
333 | G | A | 0.0000 | |
334 | A | A | 0.0000 | |
335 | Y | A | -0.3216 | |
336 | S | A | -0.1272 | |
337 | V | A | 0.0000 | |
338 | L | A | 0.0000 | |
339 | D | A | -0.6205 | |
340 | Y | A | -0.4928 | |
341 | F | A | 0.0000 | |
342 | Q | A | -1.2119 | |
343 | K | A | -1.7603 | |
344 | D | A | 0.0000 | |
345 | L | A | 0.0000 | |
346 | T | A | -1.9286 | |
347 | R | A | -2.0485 | |
348 | V | A | 0.0000 | |
349 | M | A | 0.0000 | |
350 | Q | A | -1.4782 | |
351 | L | A | 0.7989 | |
352 | T | A | 0.0000 | |
353 | G | A | 0.0000 | |
354 | S | A | 0.0000 | |
355 | Q | A | -2.7131 | |
356 | N | A | -2.2897 | |
357 | V | A | 0.0000 | |
358 | E | A | -2.7786 | |
359 | D | A | -2.2438 | |
360 | L | A | 0.0000 | |
361 | K | A | -1.9726 | |
362 | G | A | -1.7570 | |
363 | L | A | -1.1589 | |
364 | D | A | -1.5868 | |
365 | L | A | -0.5881 | |
366 | F | A | -0.4067 | |
367 | D | A | -1.8721 | |
368 | N | A | -0.9283 | |
369 | P | A | -0.1451 | |
370 | Y | A | 0.6556 | |
371 | G | A | 0.1066 | |
372 | Y | A | -0.4148 | |
373 | E | A | -1.1315 | |
374 | Y | A | 0.7454 | |
375 | L | A | 0.3473 | |
376 | G | A | -0.7708 | |
377 | G | A | -1.5877 | |
378 | D | A | -2.3522 | |
379 | S | A | -1.7470 | |
380 | S | A | -1.2939 | |
381 | G | A | -1.2237 | |
382 | G | A | -1.1244 | |
383 | G | A | -1.3008 | |
384 | P | A | -1.3364 | |
385 | G | A | -1.7852 | |
386 | E | A | -2.4584 | |
387 | P | A | -1.6442 | |
388 | G | A | -1.4736 | |
389 | G | A | -1.1857 | |
390 | P | A | -0.9792 | |
391 | G | A | -1.0910 | |
392 | G | A | -0.9780 | |
393 | P | A | -1.2789 | |
394 | G | A | -1.7308 | |
395 | E | A | -2.3792 | |
396 | P | A | -1.6306 | |
397 | G | A | -1.3986 | |
398 | G | A | -1.2228 | |
399 | P | A | -0.9879 | |
400 | G | A | -1.1032 | |
401 | G | A | -1.2698 | |
402 | P | A | -1.3308 | |
403 | G | A | -1.7719 | |
404 | E | A | -2.4709 | |
405 | P | A | -1.6516 | |
406 | G | A | -1.4721 | |
407 | G | A | -1.4324 | |
408 | P | A | -1.5536 | |
409 | G | A | -1.8886 | |
410 | D | A | -2.2762 | |
411 | G | A | -1.5701 | |
412 | T | A | -0.8203 | |
413 | C | A | 0.0000 | |
414 | A | A | -0.2839 | |
415 | V | A | -0.5874 | |
416 | N | A | -1.2779 | |
417 | Y | A | -0.1520 | |
418 | T | A | 0.5784 | |
419 | V | A | 1.1458 | |
420 | V | A | 1.3565 | |
421 | N | A | -0.7311 | |
422 | D | A | -1.8005 | |
423 | W | A | -1.3296 | |
424 | G | A | -1.8771 | |
425 | H | A | -2.1062 | |
426 | G | A | 0.0000 | |
427 | M | A | 0.0000 | |
428 | Q | A | -0.4481 | |
429 | G | A | 0.0000 | |
430 | A | A | 0.0854 | |
431 | I | A | 0.0000 | |
432 | T | A | -1.1268 | |
433 | V | A | 0.0000 | |
434 | S | A | -0.9640 | |
435 | N | A | 0.0000 | |
436 | T | A | -0.8441 | |
437 | G | A | -1.1351 | |
438 | S | A | -1.0054 | |
439 | S | A | -1.2716 | |
440 | P | A | -1.4483 | |
441 | I | A | 0.0000 | |
442 | N | A | -2.3736 | |
443 | N | A | -2.5747 | |
444 | W | A | 0.0000 | |
445 | T | A | -2.0811 | |
446 | L | A | 0.0000 | |
447 | Q | A | -1.3874 | |
448 | F | A | 0.0000 | |
449 | S | A | -1.0705 | |
450 | F | A | 0.0000 | |
451 | S | A | -0.9850 | |
452 | G | A | -1.4442 | |
453 | V | A | 0.0000 | |
454 | N | A | -2.1738 | |
455 | I | A | -1.3032 | |
456 | S | A | -1.3475 | |
457 | N | A | -1.4446 | |
458 | G | A | -0.8147 | |
459 | W | A | -0.5460 | |
460 | N | A | -1.3992 | |
461 | G | A | -1.8327 | |
462 | E | A | -2.5019 | |
463 | W | A | -1.5890 | |
464 | S | A | -1.3596 | |
465 | Q | A | -1.2079 | |
466 | S | A | -1.1384 | |
467 | G | A | -1.2860 | |
468 | S | A | -1.2387 | |
469 | Q | A | -1.5201 | |
470 | I | A | 0.0000 | |
471 | T | A | 0.0000 | |
472 | V | A | 0.0000 | |
473 | R | A | -3.1247 | |
474 | A | A | -2.0156 | |
475 | P | A | 0.0000 | |
476 | A | A | -0.2245 | |
477 | W | A | 0.7881 | |
478 | N | A | -0.7857 | |
479 | S | A | -1.1852 | |
480 | T | A | -1.3784 | |
481 | L | A | 0.0000 | |
482 | Q | A | -1.7966 | |
483 | P | A | -1.3056 | |
484 | G | A | -1.2676 | |
485 | Q | A | -1.3894 | |
486 | S | A | -1.1453 | |
487 | V | A | 0.0000 | |
488 | E | A | -2.0148 | |
489 | L | A | 0.0000 | |
490 | G | A | 0.0000 | |
491 | F | A | 0.0000 | |
492 | V | A | -0.7837 | |
493 | A | A | 0.0000 | |
494 | D | A | -2.4531 | |
495 | K | A | -2.1575 | |
496 | T | A | -1.5765 | |
497 | G | A | -1.6527 | |
498 | N | A | -1.7830 | |
499 | V | A | -0.8912 | |
500 | S | A | -0.6484 | |
501 | P | A | -0.3375 | |
502 | P | A | 0.0000 | |
503 | S | A | -0.8977 | |
504 | Q | A | -1.3829 | |
505 | F | A | -0.8561 | |
506 | T | A | -0.8617 | |
507 | L | A | 0.0000 | |
508 | N | A | -2.2224 | |
509 | G | A | -1.1713 | |
510 | A | A | -1.0741 | |
511 | T | A | -0.5946 | |
512 | C | A | -0.5460 | |
513 | S | A | -0.4228 |