Chain sequence(s) |
B: SFAHPGRGRNVARAVPKGRQVDPHAKVEIEELLGTRPRQRDLLIEHLHLIQDTYGQISADHLAALADEMSLAFAEVFETATFYAHFDVVKEGEADIPRLTIRVCDSITCAMFGADELLETLQRELASDAVRVVRAPCVGLCDHAPAVEVGHNFLHRADLASVRAAVEAEDTHAHIPTYVDYDAYRAGGGYATLERLRSGELPVDDVLKVLDDGGLRGLGGAGFPTGRKWRSVRGEPGPRLMAVNGDEGEPGTFKDQLYLNTDPHRFLEGMLIGAHVVEAADVYIYLRDEYPISREILAREIAKLPEGTRIHLRRGAGAYICGEESSLIESLEGKRGLPRHKPPFPFQVGLFNRPTLINNIETLFWVRDLIERGAEWWKSHGRNGRVGLRSYSVSGRVKEPGVKLAPAGLTIQELIDEYCGGISDGHSFAAYLPGGASGGILPASMNDIPLDFGTLEKYGCFIGSAAVVILSDQDDVRGAALNLMKFFEDESCGQCTPCRSGTQKARMLMENGVWDTDLLGELAQCMRDASICGLGQAASNPVSTVIKYFPDLFPEPR
input PDB |
Selected Chain(s) | B |
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] (00:00:00) [WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow to prevent this behavior) (00:00:00) [INFO] runJob: Starting aggrescan3d job on: input.pdb with B chain(s) selected (00:00:00) [INFO] runJob: Creating pdb object from: input.pdb (00:00:00) [INFO] FoldX: Starting FoldX energy minimalization (00:00:00) [INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:05:13) [INFO] Main: Simulation completed successfully. (00:05:17) |
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 | |
10 | S | B | 0.7456 | |
11 | F | B | 1.6327 | |
12 | A | B | 0.3024 | |
13 | H | B | -1.1306 | |
14 | P | B | -1.4413 | |
15 | G | B | -2.3350 | |
16 | R | B | -3.3148 | |
17 | G | B | -2.6352 | |
18 | R | B | -2.9604 | |
19 | N | B | -1.9896 | |
20 | V | B | 0.3143 | |
21 | A | B | -0.1275 | |
22 | R | B | -1.5716 | |
23 | A | B | -0.3112 | |
24 | V | B | -0.2890 | |
25 | P | B | -1.3294 | |
26 | K | B | -2.4124 | |
27 | G | B | -1.7720 | |
28 | R | B | -1.6120 | |
29 | Q | B | -1.6122 | |
30 | V | B | -1.2836 | |
31 | D | B | -1.4204 | |
32 | P | B | -1.0845 | |
33 | H | B | -1.5757 | |
34 | A | B | 0.0000 | |
35 | K | B | -1.9663 | |
36 | V | B | -1.0023 | |
37 | E | B | -2.0615 | |
38 | I | B | 0.0000 | |
39 | E | B | -3.0030 | |
40 | E | B | -2.7895 | |
41 | L | B | -1.5852 | |
42 | L | B | 0.0000 | |
43 | G | B | -1.7215 | |
44 | T | B | -1.3446 | |
45 | R | B | -1.7091 | |
46 | P | B | -1.5088 | |
47 | R | B | -1.7640 | |
48 | Q | B | -2.0614 | |
49 | R | B | -1.8299 | |
50 | D | B | -1.2084 | |
51 | L | B | -1.0150 | |
52 | L | B | 0.0000 | |
53 | I | B | 0.0000 | |
54 | E | B | -0.3076 | |
55 | H | B | 0.0000 | |
56 | L | B | 0.0000 | |
57 | H | B | 0.0000 | |
58 | L | B | -0.3087 | |
59 | I | B | 0.0000 | |
60 | Q | B | -0.8917 | |
61 | D | B | -1.5008 | |
62 | T | B | -0.5703 | |
63 | Y | B | -0.2801 | |
64 | G | B | -1.2360 | |
65 | Q | B | -0.9332 | |
66 | I | B | 0.0000 | |
67 | S | B | -1.3898 | |
68 | A | B | 0.0000 | |
69 | D | B | -2.4302 | |
70 | H | B | -1.2309 | |
71 | L | B | 0.0000 | |
72 | A | B | 0.0000 | |
73 | A | B | 0.0000 | |
74 | L | B | 0.0000 | |
75 | A | B | 0.0000 | |
76 | D | B | -1.9139 | |
77 | E | B | -1.9040 | |
78 | M | B | 0.0000 | |
79 | S | B | -1.1100 | |
80 | L | B | -0.5209 | |
81 | A | B | -0.0194 | |
82 | F | B | 0.2254 | |
83 | A | B | 0.1084 | |
84 | E | B | -0.5596 | |
85 | V | B | 0.0000 | |
86 | F | B | 0.0571 | |
87 | E | B | -1.0138 | |
88 | T | B | 0.0000 | |
89 | A | B | 0.0000 | |
90 | T | B | -0.2008 | |
91 | F | B | -0.1869 | |
92 | Y | B | 0.0000 | |
93 | A | B | -0.1874 | |
94 | H | B | -0.1688 | |
95 | F | B | 0.0000 | |
96 | D | B | -0.5040 | |
97 | V | B | -0.4324 | |
98 | V | B | 0.0000 | |
99 | K | B | -2.7487 | |
100 | E | B | -3.0392 | |
101 | G | B | -2.3065 | |
102 | E | B | -2.4769 | |
103 | A | B | -1.9462 | |
104 | D | B | -2.5366 | |
105 | I | B | -1.4407 | |
106 | P | B | -1.9486 | |
107 | R | B | -2.4162 | |
108 | L | B | 0.0000 | |
109 | T | B | -0.5995 | |
110 | I | B | 0.0000 | |
111 | R | B | -0.8552 | |
112 | V | B | 0.0000 | |
113 | C | B | 0.0000 | |
114 | D | B | -1.6685 | |
115 | S | B | 0.0000 | |
116 | I | B | 0.0000 | |
117 | T | B | 0.0000 | |
118 | C | B | 0.0000 | |
119 | A | B | -0.7559 | |
120 | M | B | -0.3829 | |
121 | F | B | -0.2032 | |
122 | G | B | -1.1369 | |
123 | A | B | 0.0000 | |
124 | D | B | -3.4006 | |
125 | E | B | -3.3754 | |
126 | L | B | 0.0000 | |
127 | L | B | -2.9055 | |
128 | E | B | -3.8882 | |
129 | T | B | -2.9699 | |
130 | L | B | 0.0000 | |
131 | Q | B | -2.9183 | |
132 | R | B | -3.4716 | |
133 | E | B | -3.3212 | |
134 | L | B | -1.9610 | |
135 | A | B | -1.5876 | |
136 | S | B | -1.8541 | |
137 | D | B | -2.4041 | |
138 | A | B | -1.5592 | |
139 | V | B | 0.0000 | |
140 | R | B | -1.0222 | |
141 | V | B | 0.0000 | |
142 | V | B | -1.0171 | |
143 | R | B | -2.2897 | |
144 | A | B | 0.0000 | |
145 | P | B | -1.0314 | |
146 | C | B | 0.0000 | |
147 | V | B | 0.0000 | |
148 | G | B | 0.0000 | |
149 | L | B | 0.0000 | |
150 | C | B | 0.0000 | |
151 | D | B | -1.1644 | |
152 | H | B | -1.3011 | |
153 | A | B | 0.0000 | |
154 | P | B | 0.0000 | |
155 | A | B | 0.0000 | |
156 | V | B | 0.0000 | |
157 | E | B | 0.0000 | |
158 | V | B | 0.0000 | |
159 | G | B | -1.1108 | |
160 | H | B | -1.0263 | |
161 | N | B | 0.0000 | |
162 | F | B | -0.5347 | |
163 | L | B | -0.7820 | |
164 | H | B | -1.8037 | |
165 | R | B | -2.5301 | |
166 | A | B | 0.0000 | |
167 | D | B | -2.1067 | |
168 | L | B | -1.2083 | |
169 | A | B | -0.9458 | |
170 | S | B | -1.4506 | |
171 | V | B | 0.0000 | |
172 | R | B | -2.7520 | |
173 | A | B | -1.9031 | |
174 | A | B | 0.0000 | |
175 | V | B | -2.0938 | |
176 | E | B | -2.8794 | |
177 | A | B | -2.1903 | |
178 | E | B | -3.0338 | |
179 | D | B | -2.4316 | |
180 | T | B | -1.6855 | |
181 | H | B | -1.7570 | |
182 | A | B | -1.0343 | |
183 | H | B | -1.0097 | |
184 | I | B | 0.0784 | |
185 | P | B | 0.0389 | |
186 | T | B | 0.0368 | |
187 | Y | B | 0.2993 | |
188 | V | B | -0.1591 | |
189 | D | B | -1.3553 | |
190 | Y | B | -1.7523 | |
191 | D | B | -2.5713 | |
192 | A | B | -1.4853 | |
193 | Y | B | 0.0000 | |
194 | R | B | -2.6170 | |
195 | A | B | -1.6555 | |
196 | G | B | -1.3457 | |
197 | G | B | -1.1319 | |
198 | G | B | 0.0000 | |
199 | Y | B | 0.0000 | |
200 | A | B | -1.8103 | |
201 | T | B | 0.0000 | |
202 | L | B | 0.0000 | |
203 | E | B | -3.6640 | |
204 | R | B | -3.9216 | |
205 | L | B | 0.0000 | |
206 | R | B | -3.5918 | |
207 | S | B | -2.9188 | |
208 | G | B | -2.7176 | |
209 | E | B | -3.1024 | |
210 | L | B | -2.6132 | |
211 | P | B | -2.2895 | |
212 | V | B | -2.0546 | |
213 | D | B | -2.8014 | |
214 | D | B | -2.5563 | |
215 | V | B | 0.0000 | |
216 | L | B | 0.0000 | |
217 | K | B | -3.1977 | |
218 | V | B | -2.1725 | |
219 | L | B | 0.0000 | |
220 | D | B | -2.4648 | |
221 | D | B | -2.0849 | |
222 | G | B | 0.0000 | |
223 | G | B | -1.3587 | |
224 | L | B | 0.0000 | |
225 | R | B | -1.2792 | |
226 | G | B | -0.4505 | |
227 | L | B | 0.0000 | |
228 | G | B | -0.6771 | |
229 | G | B | -0.2313 | |
230 | A | B | 0.1206 | |
231 | G | B | 0.0000 | |
232 | F | B | 0.2207 | |
233 | P | B | -0.9833 | |
234 | T | B | 0.0000 | |
235 | G | B | 0.0000 | |
236 | R | B | -2.6230 | |
237 | K | B | -1.4585 | |
238 | W | B | 0.0000 | |
239 | R | B | -2.1113 | |
240 | S | B | -1.5115 | |
241 | V | B | 0.0000 | |
242 | R | B | -2.2556 | |
243 | G | B | -1.5628 | |
244 | E | B | -1.5452 | |
245 | P | B | -1.3140 | |
246 | G | B | -1.6652 | |
247 | P | B | -1.3893 | |
248 | R | B | -1.5424 | |
249 | L | B | 0.0000 | |
250 | M | B | 0.0000 | |
251 | A | B | 0.0000 | |
252 | V | B | 0.0000 | |
253 | N | B | -0.5617 | |
254 | G | B | 0.0000 | |
255 | D | B | 0.0000 | |
256 | E | B | 0.0000 | |
257 | G | B | -0.1368 | |
258 | E | B | -0.2830 | |
259 | P | B | 0.0000 | |
260 | G | B | 0.0000 | |
261 | T | B | 0.0000 | |
262 | F | B | 0.0000 | |
263 | K | B | 0.0000 | |
264 | D | B | 0.0000 | |
265 | Q | B | 0.2797 | |
266 | L | B | 0.6857 | |
267 | Y | B | 0.0000 | |
268 | L | B | 0.0000 | |
269 | N | B | 0.1814 | |
270 | T | B | 0.0807 | |
271 | D | B | -0.0527 | |
272 | P | B | 0.0000 | |
273 | H | B | 0.0000 | |
274 | R | B | -0.2887 | |
275 | F | B | 0.0000 | |
276 | L | B | 0.0000 | |
277 | E | B | 0.0000 | |
278 | G | B | 0.0000 | |
279 | M | B | 0.0000 | |
280 | L | B | -0.7342 | |
281 | I | B | 0.0000 | |
282 | G | B | 0.0000 | |
283 | A | B | 0.0000 | |
284 | H | B | -1.3996 | |
285 | V | B | 0.0000 | |
286 | V | B | 0.0000 | |
287 | E | B | -2.2911 | |
288 | A | B | 0.0000 | |
289 | A | B | -1.1689 | |
290 | D | B | -1.2505 | |
291 | V | B | 0.0000 | |
292 | Y | B | 0.0000 | |
293 | I | B | 0.0000 | |
294 | Y | B | 0.0000 | |
295 | L | B | 0.0000 | |
296 | R | B | 0.0000 | |
297 | D | B | -0.3347 | |
298 | E | B | 0.0000 | |
299 | Y | B | 0.0000 | |
300 | P | B | 0.0000 | |
301 | I | B | -0.2364 | |
302 | S | B | 0.0000 | |
303 | R | B | -0.7132 | |
304 | E | B | -1.2845 | |
305 | I | B | 0.0000 | |
306 | L | B | 0.0000 | |
307 | A | B | -1.1389 | |
308 | R | B | -2.1488 | |
309 | E | B | 0.0000 | |
310 | I | B | -0.3939 | |
311 | A | B | -1.0145 | |
312 | K | B | -1.8593 | |
313 | L | B | -1.0000 | |
314 | P | B | -1.3453 | |
315 | E | B | -2.4304 | |
317 | G | B | -1.5140 | |
318 | T | B | -1.7127 | |
319 | R | B | -2.2011 | |
320 | I | B | -0.7276 | |
321 | H | B | -0.5628 | |
322 | L | B | 0.0180 | |
323 | R | B | 0.0000 | |
324 | R | B | -0.3684 | |
325 | G | B | 0.0000 | |
326 | A | B | 0.0000 | |
327 | G | B | -0.1012 | |
328 | A | B | -0.2017 | |
329 | Y | B | -0.2368 | |
330 | I | B | 0.0000 | |
331 | C | B | 0.0000 | |
332 | G | B | -0.7470 | |
333 | E | B | -1.1066 | |
334 | E | B | -1.3564 | |
335 | S | B | 0.0000 | |
336 | S | B | 0.0000 | |
337 | L | B | 0.0000 | |
338 | I | B | 0.0000 | |
339 | E | B | -0.7712 | |
340 | S | B | 0.0000 | |
341 | L | B | 0.0000 | |
342 | E | B | -0.8160 | |
343 | G | B | 0.0000 | |
344 | K | B | -1.3570 | |
345 | R | B | -1.2851 | |
346 | G | B | 0.0000 | |
347 | L | B | -0.3175 | |
348 | P | B | 0.0000 | |
349 | R | B | -1.0468 | |
350 | H | B | -1.3398 | |
351 | K | B | -1.1774 | |
352 | P | B | -0.8406 | |
353 | P | B | -0.2933 | |
354 | F | B | 0.2970 | |
355 | P | B | -0.0467 | |
356 | F | B | 0.0158 | |
357 | Q | B | -0.4794 | |
358 | V | B | -0.2388 | |
359 | G | B | 0.0000 | |
360 | L | B | 0.0000 | |
361 | F | B | -0.4081 | |
362 | N | B | -1.2855 | |
363 | R | B | -1.4821 | |
364 | P | B | 0.0000 | |
365 | T | B | 0.0000 | |
366 | L | B | 0.0000 | |
367 | I | B | 0.0000 | |
368 | N | B | 0.0000 | |
369 | N | B | -0.4115 | |
370 | I | B | 0.0000 | |
371 | E | B | 0.0000 | |
372 | T | B | 0.0000 | |
373 | L | B | 0.0000 | |
374 | F | B | 0.0000 | |
375 | W | B | 0.0000 | |
376 | V | B | 0.0000 | |
377 | R | B | 0.0000 | |
378 | D | B | -1.1611 | |
379 | L | B | 0.0000 | |
380 | I | B | -1.2006 | |
381 | E | B | -1.8266 | |
382 | R | B | -2.5783 | |
383 | G | B | -1.8591 | |
384 | A | B | -2.1930 | |
385 | E | B | -2.4459 | |
386 | W | B | -1.7321 | |
387 | W | B | 0.0000 | |
388 | K | B | -1.5796 | |
389 | S | B | -1.1809 | |
390 | H | B | -0.8300 | |
391 | G | B | -0.9857 | |
392 | R | B | -1.9125 | |
393 | N | B | -2.0533 | |
394 | G | B | -1.4381 | |
395 | R | B | -1.0853 | |
396 | V | B | -0.2093 | |
397 | G | B | 0.0000 | |
398 | L | B | 0.1619 | |
399 | R | B | 0.0000 | |
400 | S | B | 0.0000 | |
401 | Y | B | 0.0000 | |
402 | S | B | 0.0000 | |
403 | V | B | 0.0000 | |
404 | S | B | 0.0000 | |
405 | G | B | 0.0000 | |
406 | R | B | 0.0000 | |
407 | V | B | 0.0000 | |
408 | K | B | -2.6058 | |
409 | E | B | -2.6768 | |
410 | P | B | -1.4727 | |
411 | G | B | -0.4969 | |
412 | V | B | 0.3049 | |
413 | K | B | 0.2322 | |
414 | L | B | 0.9315 | |
415 | A | B | 0.0000 | |
416 | P | B | -0.3096 | |
417 | A | B | 0.0000 | |
418 | G | B | 0.0000 | |
419 | L | B | 0.0000 | |
420 | T | B | 0.0000 | |
421 | I | B | 0.0000 | |
422 | Q | B | -2.2122 | |
423 | E | B | -2.3360 | |
424 | L | B | 0.0000 | |
425 | I | B | 0.0000 | |
426 | D | B | -3.3139 | |
427 | E | B | -2.8728 | |
428 | Y | B | -1.7163 | |
429 | C | B | 0.0000 | |
430 | G | B | -2.1448 | |
431 | G | B | -2.0620 | |
432 | I | B | -1.2945 | |
433 | S | B | -1.7169 | |
434 | D | B | -2.2798 | |
435 | G | B | -1.8032 | |
436 | H | B | -1.6609 | |
437 | S | B | -1.1853 | |
438 | F | B | -0.4320 | |
439 | A | B | -0.8909 | |
440 | A | B | 0.0000 | |
441 | Y | B | 0.0000 | |
442 | L | B | 0.0000 | |
443 | P | B | 0.0000 | |
444 | G | B | 0.0000 | |
445 | G | B | 0.0000 | |
446 | A | B | 0.0000 | |
447 | S | B | -0.1632 | |
448 | G | B | 0.0000 | |
449 | G | B | 0.0000 | |
450 | I | B | 0.0000 | |
451 | L | B | 0.0000 | |
452 | P | B | 0.0538 | |
453 | A | B | -0.3810 | |
454 | S | B | -0.5507 | |
455 | M | B | -0.6974 | |
456 | N | B | -1.5276 | |
457 | D | B | -2.2151 | |
458 | I | B | 0.0000 | |
459 | P | B | -1.3709 | |
460 | L | B | 0.0000 | |
461 | D | B | 0.0000 | |
462 | F | B | -0.2539 | |
463 | G | B | -1.0600 | |
464 | T | B | -1.0244 | |
465 | L | B | 0.0000 | |
466 | E | B | -2.6577 | |
467 | K | B | -2.6004 | |
468 | Y | B | -1.4456 | |
469 | G | B | -1.5079 | |
470 | C | B | 0.0000 | |
471 | F | B | -0.4139 | |
472 | I | B | 0.0000 | |
473 | G | B | 0.0000 | |
474 | S | B | 0.0000 | |
475 | A | B | 0.0000 | |
476 | A | B | 0.0000 | |
477 | V | B | 0.0000 | |
478 | V | B | 0.0000 | |
479 | I | B | 0.0000 | |
480 | L | B | 0.0000 | |
481 | S | B | 0.0000 | |
482 | D | B | -2.8688 | |
483 | Q | B | -2.6635 | |
484 | D | B | -2.2561 | |
485 | D | B | -2.5949 | |
486 | V | B | 0.0000 | |
487 | R | B | -0.9256 | |
488 | G | B | -1.1979 | |
489 | A | B | 0.0000 | |
490 | A | B | 0.0000 | |
491 | L | B | -0.8316 | |
492 | N | B | -0.6720 | |
493 | L | B | 0.0000 | |
494 | M | B | 0.0000 | |
495 | K | B | -1.8267 | |
496 | F | B | 0.0000 | |
497 | F | B | 0.0000 | |
498 | E | B | -2.4739 | |
499 | D | B | -2.6126 | |
500 | E | B | -1.4136 | |
501 | S | B | -1.2504 | |
502 | C | B | -0.6802 | |
503 | G | B | -1.0276 | |
504 | Q | B | -0.5825 | |
505 | C | B | -0.3864 | |
506 | T | B | -0.5471 | |
507 | P | B | -1.1448 | |
508 | C | B | 0.0000 | |
509 | R | B | -2.2250 | |
510 | S | B | -1.5994 | |
511 | G | B | 0.0000 | |
512 | T | B | 0.0000 | |
513 | Q | B | -2.4060 | |
514 | K | B | -1.4720 | |
515 | A | B | 0.0000 | |
516 | R | B | -1.5883 | |
517 | M | B | -0.9068 | |
518 | L | B | -1.0082 | |
519 | M | B | 0.0000 | |
520 | E | B | -2.0196 | |
521 | N | B | -1.6912 | |
522 | G | B | -0.7757 | |
523 | V | B | -0.1722 | |
524 | W | B | 0.0000 | |
525 | D | B | -2.2864 | |
526 | T | B | -1.9423 | |
527 | D | B | -2.6974 | |
528 | L | B | -1.6477 | |
529 | L | B | 0.0000 | |
530 | G | B | -2.0475 | |
531 | E | B | -2.4511 | |
532 | L | B | -1.6030 | |
533 | A | B | -1.7610 | |
534 | Q | B | -2.4586 | |
535 | C | B | -1.6644 | |
536 | M | B | 0.0000 | |
537 | R | B | -2.2394 | |
538 | D | B | -2.4250 | |
539 | A | B | -1.1180 | |
540 | S | B | -0.8719 | |
541 | I | B | -0.3858 | |
542 | C | B | -0.6583 | |
543 | G | B | -0.8286 | |
544 | L | B | 0.0000 | |
545 | G | B | 0.0000 | |
546 | Q | B | -1.8705 | |
547 | A | B | 0.0000 | |
548 | A | B | 0.0000 | |
549 | S | B | 0.0000 | |
550 | N | B | 0.0000 | |
551 | P | B | 0.0000 | |
552 | V | B | 0.0000 | |
553 | S | B | -0.5699 | |
554 | T | B | 0.0000 | |
555 | V | B | 0.0000 | |
556 | I | B | -0.6834 | |
557 | K | B | -1.5838 | |
558 | Y | B | -0.5974 | |
559 | F | B | -0.5971 | |
560 | P | B | -1.0771 | |
561 | D | B | -1.8797 | |
562 | L | B | -0.7260 | |
563 | F | B | -0.8966 | |
564 | P | B | -1.4779 | |
565 | E | B | -2.2272 | |
566 | P | B | -2.0589 | |
567 | R | B | -2.8074 |