Chain sequence(s) |
A: MSHEKSFLVSGDNYPPPNPGYPGGPQPPMPPYAQPPYPGAPYPQPPFQPSPYGQPGYPHGPSPYPQGGYPQGPYPQGGYPQGPYPQEGYPQGPYPQGGYPQGPYPQSPFPPNPYGQPQVFPGQDPDSPQHGNYQEEGPPSYYDNQDFPATNWDDKSIRQAFIRKVFLVLTLQLSVTLSTVSVFTFVAEVKGFVRENVWTYYVSYAVFFISLIVLSCCGDFRRKHPWNLVALSVLTASLSYMVGMIASFYNTEAVIMAVGITTAVCFTVVIFSMQTRYDFTSCMGVLLVSMVVLFIFAILCIFIRNRILEIVYASLGALLFTCFLAVDTQLLLGNKQLSLSPEEYVFAALNLYTDIINIFLYILTIIGRAKE
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] (00:00:04) [WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow to prevent this behavior) (00:00:04) [INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:04) [INFO] runJob: Creating pdb object from: input.pdb (00:00:04) [INFO] FoldX: Starting FoldX energy minimalization (00:00:04) [INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:06:14) [INFO] Movie: Creting movie with webm format (00:09:27) [INFO] Main: Simulation completed successfully. (00:09:34) |
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 | 0.3455 | |
2 | S | A | -0.7539 | |
3 | H | A | -1.3915 | |
4 | E | A | -1.8198 | |
5 | K | A | -1.2596 | |
6 | S | A | 0.4483 | |
7 | F | A | 2.7412 | |
8 | L | A | 2.8427 | |
9 | V | A | 2.4532 | |
10 | S | A | 1.0119 | |
11 | G | A | 0.0000 | |
12 | D | A | -1.8183 | |
13 | N | A | -1.6495 | |
14 | Y | A | -0.6594 | |
15 | P | A | -0.2917 | |
16 | P | A | 0.0000 | |
17 | P | A | 0.0000 | |
18 | N | A | 0.0000 | |
19 | P | A | 0.1381 | |
20 | G | A | 0.0000 | |
21 | Y | A | 0.4157 | |
22 | P | A | 0.0000 | |
23 | G | A | 0.0000 | |
24 | G | A | -0.6926 | |
25 | P | A | 0.0932 | |
26 | Q | A | -0.4651 | |
27 | P | A | -0.0382 | |
28 | P | A | 0.1724 | |
29 | M | A | 0.9888 | |
30 | P | A | 0.8043 | |
31 | P | A | 0.5176 | |
32 | Y | A | 0.7646 | |
33 | A | A | 0.0454 | |
34 | Q | A | -0.5939 | |
35 | P | A | -0.1721 | |
36 | P | A | -0.0164 | |
37 | Y | A | 0.7840 | |
38 | P | A | 0.1666 | |
39 | G | A | -0.4046 | |
40 | A | A | -0.6124 | |
41 | P | A | -0.4857 | |
42 | Y | A | 0.1815 | |
43 | P | A | 0.0000 | |
44 | Q | A | 0.0000 | |
45 | P | A | 0.0000 | |
46 | P | A | 0.2111 | |
47 | F | A | 0.0000 | |
48 | Q | A | -0.2704 | |
49 | P | A | -0.2795 | |
50 | S | A | -0.5685 | |
51 | P | A | -0.0010 | |
52 | Y | A | 0.5956 | |
53 | G | A | -0.7983 | |
54 | Q | A | -1.5395 | |
55 | P | A | -0.8514 | |
56 | G | A | -0.1988 | |
57 | Y | A | 0.9047 | |
58 | P | A | 0.2445 | |
59 | H | A | -0.1812 | |
60 | G | A | -0.4340 | |
61 | P | A | 0.0000 | |
62 | S | A | -0.4701 | |
63 | P | A | 0.0599 | |
64 | Y | A | 0.9105 | |
65 | P | A | 0.0000 | |
66 | Q | A | -0.0512 | |
67 | G | A | -0.1129 | |
68 | G | A | -0.0047 | |
69 | Y | A | 0.3641 | |
70 | P | A | 0.0110 | |
71 | Q | A | -0.0801 | |
72 | G | A | -0.5250 | |
73 | P | A | -0.4997 | |
74 | Y | A | 0.0000 | |
75 | P | A | -1.3128 | |
76 | Q | A | -1.4819 | |
77 | G | A | -1.0246 | |
78 | G | A | -0.7561 | |
79 | Y | A | 0.1948 | |
80 | P | A | -0.5553 | |
81 | Q | A | -1.2424 | |
82 | G | A | -0.8451 | |
83 | P | A | -0.6251 | |
84 | Y | A | -0.5384 | |
85 | P | A | -0.7686 | |
86 | Q | A | -0.9548 | |
87 | E | A | -1.6468 | |
88 | G | A | -0.7209 | |
89 | Y | A | 0.0968 | |
90 | P | A | -0.2311 | |
91 | Q | A | -1.2541 | |
92 | G | A | -0.9293 | |
93 | P | A | -0.2662 | |
94 | Y | A | 0.7210 | |
95 | P | A | 0.2198 | |
96 | Q | A | 0.1095 | |
97 | G | A | 0.0000 | |
98 | G | A | 0.0000 | |
99 | Y | A | -0.2115 | |
100 | P | A | 0.0000 | |
101 | Q | A | 0.0000 | |
102 | G | A | 0.0000 | |
103 | P | A | 0.1988 | |
104 | Y | A | 0.3835 | |
105 | P | A | -0.1625 | |
106 | Q | A | -0.8108 | |
107 | S | A | -0.5801 | |
108 | P | A | -0.5681 | |
109 | F | A | -0.1170 | |
110 | P | A | 0.0000 | |
111 | P | A | -0.2551 | |
112 | N | A | 0.0000 | |
113 | P | A | 0.0000 | |
114 | Y | A | -0.1987 | |
115 | G | A | -0.7086 | |
116 | Q | A | -1.3013 | |
117 | P | A | -0.9504 | |
118 | Q | A | -0.7719 | |
119 | V | A | 0.0728 | |
120 | F | A | -0.1570 | |
121 | P | A | -0.7325 | |
122 | G | A | -1.3101 | |
123 | Q | A | -1.9173 | |
124 | D | A | -1.9855 | |
125 | P | A | 0.0000 | |
126 | D | A | 0.0000 | |
127 | S | A | -1.3319 | |
128 | P | A | -1.3303 | |
129 | Q | A | -1.7895 | |
130 | H | A | -1.6847 | |
131 | G | A | -1.3960 | |
132 | N | A | -1.2342 | |
133 | Y | A | -0.3102 | |
134 | Q | A | -0.9618 | |
135 | E | A | -2.2617 | |
136 | E | A | 0.0000 | |
137 | G | A | -0.9437 | |
138 | P | A | -0.7465 | |
139 | P | A | -0.6570 | |
140 | S | A | 0.0000 | |
141 | Y | A | -0.8249 | |
142 | Y | A | -1.3954 | |
143 | D | A | -1.4918 | |
144 | N | A | 0.0000 | |
145 | Q | A | 0.0000 | |
146 | D | A | -0.5080 | |
147 | F | A | 0.3155 | |
148 | P | A | 0.1805 | |
149 | A | A | 0.1403 | |
150 | T | A | -0.7758 | |
151 | N | A | -0.7169 | |
152 | W | A | -0.4835 | |
153 | D | A | -1.8865 | |
154 | D | A | -1.7031 | |
155 | K | A | -1.3086 | |
156 | S | A | -0.8904 | |
157 | I | A | 0.0000 | |
158 | R | A | -2.2748 | |
159 | Q | A | -2.0402 | |
160 | A | A | -1.8912 | |
161 | F | A | 0.0000 | |
162 | I | A | 0.0000 | |
163 | R | A | -2.4593 | |
164 | K | A | -1.9264 | |
165 | V | A | 0.0000 | |
166 | F | A | 0.1456 | |
167 | L | A | 0.6315 | |
168 | V | A | 0.0000 | |
169 | L | A | 0.0000 | |
170 | T | A | 1.2391 | |
171 | L | A | 1.9125 | |
172 | Q | A | 0.0000 | |
173 | L | A | 1.4844 | |
174 | S | A | 1.2294 | |
175 | V | A | 1.5990 | |
176 | T | A | 0.0000 | |
177 | L | A | 1.9977 | |
178 | S | A | 1.0803 | |
179 | T | A | 1.1647 | |
180 | V | A | 1.0637 | |
181 | S | A | 1.0179 | |
182 | V | A | 1.8649 | |
183 | F | A | 0.0000 | |
184 | T | A | 0.5004 | |
185 | F | A | 2.0590 | |
186 | V | A | 1.6398 | |
187 | A | A | 0.8769 | |
188 | E | A | 0.3558 | |
189 | V | A | 0.0000 | |
190 | K | A | -1.5625 | |
191 | G | A | -0.4291 | |
192 | F | A | 1.3903 | |
193 | V | A | 0.7823 | |
194 | R | A | -0.4911 | |
195 | E | A | -1.1866 | |
196 | N | A | 0.3605 | |
197 | V | A | 2.1333 | |
198 | W | A | 2.0812 | |
199 | T | A | 1.5319 | |
200 | Y | A | 2.5245 | |
201 | Y | A | 2.2028 | |
202 | V | A | 2.5678 | |
203 | S | A | 1.8230 | |
204 | Y | A | 2.0037 | |
205 | A | A | 1.0681 | |
206 | V | A | 0.0000 | |
207 | F | A | 1.7540 | |
208 | F | A | 2.0100 | |
209 | I | A | 0.0000 | |
210 | S | A | 0.8525 | |
211 | L | A | 0.0000 | |
212 | I | A | 0.8611 | |
213 | V | A | 0.0000 | |
214 | L | A | 0.0000 | |
215 | S | A | 0.3418 | |
216 | C | A | -0.4775 | |
217 | C | A | 0.0000 | |
218 | G | A | -0.3900 | |
219 | D | A | -2.0590 | |
220 | F | A | -1.2667 | |
221 | R | A | -1.5900 | |
222 | R | A | -2.4539 | |
223 | K | A | -2.3336 | |
224 | H | A | -1.5146 | |
225 | P | A | 0.0000 | |
226 | W | A | 0.3120 | |
227 | N | A | 1.1394 | |
228 | L | A | 1.9423 | |
229 | V | A | 2.6486 | |
230 | A | A | 1.8666 | |
231 | L | A | 0.0000 | |
232 | S | A | 2.0342 | |
233 | V | A | 2.5293 | |
234 | L | A | 1.5193 | |
235 | T | A | 0.0000 | |
236 | A | A | 1.2925 | |
237 | S | A | 0.6981 | |
238 | L | A | 0.0000 | |
239 | S | A | 0.0000 | |
240 | Y | A | 1.1515 | |
241 | M | A | 0.6242 | |
242 | V | A | 0.0000 | |
243 | G | A | 0.0000 | |
244 | M | A | 0.0000 | |
245 | I | A | 0.0000 | |
246 | A | A | 0.0000 | |
247 | S | A | -0.7208 | |
248 | F | A | -0.0754 | |
249 | Y | A | -0.0152 | |
250 | N | A | -1.1897 | |
251 | T | A | -0.7351 | |
252 | E | A | -1.1595 | |
253 | A | A | 0.0834 | |
254 | V | A | 0.8047 | |
255 | I | A | 2.1888 | |
256 | M | A | 2.1265 | |
257 | A | A | 0.0000 | |
258 | V | A | 1.9421 | |
259 | G | A | 1.5380 | |
260 | I | A | 2.3706 | |
261 | T | A | 0.0000 | |
262 | T | A | 1.1340 | |
263 | A | A | 1.3878 | |
264 | V | A | 1.6138 | |
265 | C | A | 0.0000 | |
266 | F | A | 3.0204 | |
267 | T | A | 2.2498 | |
268 | V | A | 2.1317 | |
269 | V | A | 0.0000 | |
270 | I | A | 3.0823 | |
271 | F | A | 2.5873 | |
272 | S | A | 0.0000 | |
273 | M | A | 0.5738 | |
274 | Q | A | -0.1113 | |
275 | T | A | -0.4196 | |
276 | R | A | -1.6469 | |
277 | Y | A | -0.4485 | |
278 | D | A | -1.3570 | |
279 | F | A | 0.0287 | |
280 | T | A | -0.1701 | |
281 | S | A | 0.0457 | |
282 | C | A | 0.9942 | |
283 | M | A | 1.2707 | |
284 | G | A | 1.3362 | |
285 | V | A | 2.8132 | |
286 | L | A | 0.0000 | |
287 | L | A | 3.0002 | |
288 | V | A | 3.7968 | |
289 | S | A | 3.2027 | |
290 | M | A | 0.0000 | |
291 | V | A | 4.1560 | |
292 | V | A | 3.7341 | |
293 | L | A | 0.0000 | |
294 | F | A | 3.2590 | |
295 | I | A | 4.1397 | |
296 | F | A | 3.2558 | |
297 | A | A | 0.0000 | |
298 | I | A | 3.9238 | |
299 | L | A | 3.4917 | |
300 | C | A | 0.0000 | |
301 | I | A | 3.7014 | |
302 | F | A | 3.7100 | |
303 | I | A | 2.4590 | |
304 | R | A | -0.6459 | |
305 | N | A | -1.3754 | |
306 | R | A | -1.2525 | |
307 | I | A | 1.9125 | |
308 | L | A | 2.0743 | |
309 | E | A | 1.5645 | |
310 | I | A | 3.0397 | |
311 | V | A | 3.3477 | |
312 | Y | A | 2.2517 | |
313 | A | A | 0.0000 | |
314 | S | A | 1.7022 | |
315 | L | A | 2.0566 | |
316 | G | A | 0.0000 | |
317 | A | A | 1.4392 | |
318 | L | A | 2.0057 | |
319 | L | A | 1.5588 | |
320 | F | A | 0.0000 | |
321 | T | A | 0.8724 | |
322 | C | A | 0.8353 | |
323 | F | A | 0.0000 | |
324 | L | A | 0.0000 | |
325 | A | A | 1.3767 | |
326 | V | A | 0.0000 | |
327 | D | A | 0.0000 | |
328 | T | A | 0.0000 | |
329 | Q | A | 0.0000 | |
330 | L | A | 0.0079 | |
331 | L | A | 0.0000 | |
332 | L | A | -0.9360 | |
333 | G | A | -0.9302 | |
334 | N | A | -0.5668 | |
335 | K | A | -0.5561 | |
336 | Q | A | -0.0157 | |
337 | L | A | 1.2215 | |
338 | S | A | 0.1379 | |
339 | L | A | 0.0000 | |
340 | S | A | 0.0000 | |
341 | P | A | -0.2204 | |
342 | E | A | -0.1615 | |
343 | E | A | -0.1783 | |
344 | Y | A | 0.0096 | |
345 | V | A | 0.0000 | |
346 | F | A | -0.0976 | |
347 | A | A | 0.0000 | |
348 | A | A | 0.0000 | |
349 | L | A | 0.0000 | |
350 | N | A | 0.0000 | |
351 | L | A | 0.0000 | |
352 | Y | A | 0.0000 | |
353 | T | A | 0.0000 | |
354 | D | A | 0.0000 | |
355 | I | A | 0.3702 | |
356 | I | A | 0.0000 | |
357 | N | A | 0.0000 | |
358 | I | A | 0.0000 | |
359 | F | A | 0.0000 | |
360 | L | A | 0.0000 | |
361 | Y | A | 0.0000 | |
362 | I | A | 1.2510 | |
363 | L | A | 0.0000 | |
364 | T | A | 1.3086 | |
365 | I | A | 1.0370 | |
366 | I | A | 0.7234 | |
367 | G | A | 0.0000 | |
368 | R | A | -0.3320 | |
369 | A | A | 0.0000 | |
370 | K | A | -1.0366 | |
371 | E | A | -1.6383 |