Chain sequence(s) |
A: MSVTPNAGCVDVVIVGAGISGLGAAYRIIERNPQLTYTILERRARIGGTWDLFRYPGVRSDSSIFTLSFPYEPWTREEGIADGAHIREYLTDMAHKYGIDRHIEFNSYVRAADWDSSTDTWTVTFEQNGVHKHYRSRFVFFGSGYYNYDEGYTPDFGGIEKFGGAVVHPQHWPEDLDYTGKKIVVIGSGATAVTLIPSLTDRAEKVTMLQRSPTYLISASKYSTFAAVVRKALPPKTSHLIVRMYNALLEAVFWFLSRKTPVFVKWLLRRTAIKNLPEGYDIETHFTPRYNPWDQRLCLIPDADLYNAITSGRAEVVTDHIDHFDATGIALKSGGHLDADIIVTATGLQLQALGGAAISLDGVEIDPRDRFVYKAHMLEDVPNLFWCVGYTNASWTLRADMTARATAKLLAHMAAHGHTRAAPHLGDEPMDEKPSWDIQAGYVKRAPYALPKSGTKRPWNVRQNYLADAIDYRFDRIEEAMVFGAA
input PDB |
Selected Chain(s) | A |
Distance of aggregation | 10 Å |
FoldX usage | Yes |
Dynamic mode | No |
Automated mutations | Yes |
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 A 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 (00:05:27) [INFO] Auto_mut: Residue number 252 from chain A and a score of 3.115 (valine) selected for automated muatation (00:05:30) [INFO] Auto_mut: Residue number 249 from chain A and a score of 2.433 (leucine) selected for automated muatation (00:05:30) [INFO] Auto_mut: Residue number 248 from chain A and a score of 2.263 (leucine) selected for automated muatation (00:05:30) [INFO] Auto_mut: Residue number 253 from chain A and a score of 2.112 (phenylalanine) selected for automated muatation (00:05:30) [INFO] Auto_mut: Residue number 262 from chain A and a score of 2.110 (valine) selected for automated muatation (00:05:30) [INFO] Auto_mut: Residue number 251 from chain A and a score of 2.106 (alanine) selected for automated muatation (00:05:30) [INFO] Auto_mut: Mutating residue number 252 from chain A (valine) into glutamic acid (00:05:30) [INFO] Auto_mut: Mutating residue number 252 from chain A (valine) into aspartic acid (00:05:30) [INFO] Auto_mut: Mutating residue number 249 from chain A (leucine) into glutamic acid (00:05:30) [INFO] Auto_mut: Mutating residue number 252 from chain A (valine) into arginine (00:08:22) [INFO] Auto_mut: Mutating residue number 249 from chain A (leucine) into lysine (00:08:25) [INFO] Auto_mut: Mutating residue number 252 from chain A (valine) into lysine (00:08:28) [INFO] Auto_mut: Mutating residue number 249 from chain A (leucine) into aspartic acid (00:11:22) [INFO] Auto_mut: Mutating residue number 248 from chain A (leucine) into glutamic acid (00:11:33) [INFO] Auto_mut: Mutating residue number 248 from chain A (leucine) into aspartic acid (00:11:40) [INFO] Auto_mut: Mutating residue number 249 from chain A (leucine) into arginine (00:14:06) [INFO] Auto_mut: Mutating residue number 248 from chain A (leucine) into arginine (00:14:25) [INFO] Auto_mut: Mutating residue number 248 from chain A (leucine) into lysine (00:14:32) [INFO] Auto_mut: Mutating residue number 253 from chain A (phenylalanine) into glutamic acid Mutating residue number 253 from chain A (phenylalanine) into glutamic acid (00:16:54) [INFO] Auto_mut: Mutating residue number 253 from chain A (phenylalanine) into aspartic acid Mutating residue number 253 from chain A (phenylalanine) into aspartic acid (00:17:26) [INFO] Auto_mut: Mutating residue number 262 from chain A (valine) into glutamic acid (00:17:32) [INFO] Auto_mut: Mutating residue number 253 from chain A (phenylalanine) into lysine (00:20:08) [INFO] Auto_mut: Mutating residue number 253 from chain A (phenylalanine) into arginine (00:20:11) [INFO] Auto_mut: Mutating residue number 262 from chain A (valine) into lysine (00:20:21) [INFO] Auto_mut: Mutating residue number 262 from chain A (valine) into aspartic acid (00:23:11) [INFO] Auto_mut: Mutating residue number 251 from chain A (alanine) into glutamic acid (00:23:26) [INFO] Auto_mut: Mutating residue number 251 from chain A (alanine) into aspartic acid (00:23:30) [INFO] Auto_mut: Mutating residue number 262 from chain A (valine) into arginine (00:25:51) [INFO] Auto_mut: Mutating residue number 251 from chain A (alanine) into lysine (00:26:14) [INFO] Auto_mut: Mutating residue number 251 from chain A (alanine) into arginine (00:26:33) [INFO] Auto_mut: Effect of mutation residue number 252 from chain A (valine) into glutamic acid: Energy difference: -0.2685 kcal/mol, Difference in average score from the base case: -0.0442 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 252 from chain A (valine) into lysine: Energy difference: -0.6713 kcal/mol, Difference in average score from the base case: -0.0410 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 252 from chain A (valine) into aspartic acid: Energy difference: 0.0712 kcal/mol, Difference in average score from the base case: -0.0425 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 252 from chain A (valine) into arginine: Energy difference: -1.2342 kcal/mol, Difference in average score from the base case: -0.0533 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 249 from chain A (leucine) into glutamic acid: Energy difference: 0.3373 kcal/mol, Difference in average score from the base case: -0.0330 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 249 from chain A (leucine) into lysine: Energy difference: -0.0491 kcal/mol, Difference in average score from the base case: -0.0339 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 249 from chain A (leucine) into aspartic acid: Energy difference: 1.4836 kcal/mol, Difference in average score from the base case: -0.0340 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 249 from chain A (leucine) into arginine: Energy difference: 0.0696 kcal/mol, Difference in average score from the base case: -0.0361 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 248 from chain A (leucine) into glutamic acid: Energy difference: 0.8714 kcal/mol, Difference in average score from the base case: -0.0321 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 248 from chain A (leucine) into lysine: Energy difference: 0.4411 kcal/mol, Difference in average score from the base case: -0.0278 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 248 from chain A (leucine) into aspartic acid: Energy difference: 1.2773 kcal/mol, Difference in average score from the base case: -0.0322 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 248 from chain A (leucine) into arginine: Energy difference: 0.5451 kcal/mol, Difference in average score from the base case: -0.0325 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 253 from chain A (phenylalanine) into glutamic acid: Energy difference: 0.7604 kcal/mol, Difference in average score from the base case: -0.0320 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 253 from chain A (phenylalanine) into lysine: Energy difference: 1.8166 kcal/mol, Difference in average score from the base case: -0.0240 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 253 from chain A (phenylalanine) into aspartic acid: Energy difference: 2.1851 kcal/mol, Difference in average score from the base case: -0.0242 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 253 from chain A (phenylalanine) into arginine: Energy difference: 1.4495 kcal/mol, Difference in average score from the base case: -0.0344 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 262 from chain A (valine) into glutamic acid: Energy difference: -1.0295 kcal/mol, Difference in average score from the base case: -0.0381 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 262 from chain A (valine) into lysine: Energy difference: -0.1301 kcal/mol, Difference in average score from the base case: -0.0363 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 262 from chain A (valine) into aspartic acid: Energy difference: -1.3157 kcal/mol, Difference in average score from the base case: -0.0375 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 262 from chain A (valine) into arginine: Energy difference: -0.1611 kcal/mol, Difference in average score from the base case: -0.0421 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 251 from chain A (alanine) into glutamic acid: Energy difference: 0.9898 kcal/mol, Difference in average score from the base case: -0.0195 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 251 from chain A (alanine) into lysine: Energy difference: -0.3581 kcal/mol, Difference in average score from the base case: -0.0298 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 251 from chain A (alanine) into aspartic acid: Energy difference: 1.1504 kcal/mol, Difference in average score from the base case: -0.0209 (00:29:34) [INFO] Auto_mut: Effect of mutation residue number 251 from chain A (alanine) into arginine: Energy difference: -0.3229 kcal/mol, Difference in average score from the base case: -0.0377 (00:29:34) [INFO] Main: Simulation completed successfully. (00:29:43) |
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 | 1.4260 | |
2 | S | A | 1.1295 | |
3 | V | A | 1.6976 | |
4 | T | A | 0.3953 | |
5 | P | A | -0.4418 | |
6 | N | A | -1.3503 | |
7 | A | A | -0.8545 | |
8 | G | A | -0.3945 | |
9 | C | A | 0.1089 | |
10 | V | A | 0.0415 | |
11 | D | A | -0.6455 | |
12 | V | A | 0.0000 | |
13 | V | A | 0.0000 | |
14 | I | A | 0.0000 | |
15 | V | A | 0.0000 | |
16 | G | A | -0.1251 | |
17 | A | A | 0.0000 | |
18 | G | A | 0.0000 | |
19 | I | A | 0.1815 | |
20 | S | A | 0.0000 | |
21 | G | A | 0.0000 | |
22 | L | A | 0.0000 | |
23 | G | A | 0.0000 | |
24 | A | A | 0.0000 | |
25 | A | A | 0.0000 | |
26 | Y | A | -0.3406 | |
27 | R | A | 0.0000 | |
28 | I | A | 0.0000 | |
29 | I | A | -0.7600 | |
30 | E | A | -1.6470 | |
31 | R | A | -2.5174 | |
32 | N | A | 0.0000 | |
33 | P | A | -1.2779 | |
34 | Q | A | -1.5113 | |
35 | L | A | -0.6791 | |
36 | T | A | -0.2564 | |
37 | Y | A | 0.0000 | |
38 | T | A | 0.0000 | |
39 | I | A | 0.0000 | |
40 | L | A | 0.0000 | |
41 | E | A | 0.0000 | |
42 | R | A | -1.3999 | |
43 | R | A | -1.4170 | |
44 | A | A | -1.3513 | |
45 | R | A | -2.0798 | |
46 | I | A | 0.0000 | |
47 | G | A | 0.0000 | |
48 | G | A | 0.0000 | |
49 | T | A | -0.0283 | |
50 | W | A | -0.4727 | |
51 | D | A | 0.0000 | |
52 | L | A | -0.7262 | |
53 | F | A | -0.7572 | |
54 | R | A | -2.2074 | |
55 | Y | A | 0.0000 | |
56 | P | A | -0.7749 | |
57 | G | A | -0.5622 | |
58 | V | A | -0.6461 | |
59 | R | A | -0.8327 | |
60 | S | A | 0.0000 | |
61 | D | A | -0.8108 | |
62 | S | A | -0.4404 | |
63 | S | A | -0.2063 | |
64 | I | A | 0.0000 | |
65 | F | A | 0.0000 | |
66 | T | A | 0.0000 | |
67 | L | A | 0.0000 | |
68 | S | A | 0.0000 | |
69 | F | A | 0.0000 | |
70 | P | A | -0.2226 | |
71 | Y | A | 0.0000 | |
72 | E | A | -0.5330 | |
73 | P | A | -0.7337 | |
74 | W | A | 0.0000 | |
75 | T | A | -1.4782 | |
76 | R | A | -2.6354 | |
77 | E | A | -2.5413 | |
78 | E | A | 0.0000 | |
79 | G | A | 0.0000 | |
80 | I | A | 0.0000 | |
81 | A | A | 0.0000 | |
82 | D | A | -1.0863 | |
83 | G | A | 0.0000 | |
84 | A | A | -1.0512 | |
85 | H | A | -1.4376 | |
86 | I | A | 0.0000 | |
87 | R | A | -1.5691 | |
88 | E | A | -2.1634 | |
89 | Y | A | -1.7090 | |
90 | L | A | 0.0000 | |
91 | T | A | -2.2747 | |
92 | D | A | -3.0386 | |
93 | M | A | 0.0000 | |
94 | A | A | 0.0000 | |
95 | H | A | -2.7904 | |
96 | K | A | -2.6012 | |
97 | Y | A | -1.3619 | |
98 | G | A | -1.7645 | |
99 | I | A | 0.0000 | |
100 | D | A | -2.1094 | |
101 | R | A | -2.4206 | |
102 | H | A | -1.4739 | |
103 | I | A | -1.1056 | |
104 | E | A | -1.0527 | |
105 | F | A | -0.8031 | |
106 | N | A | -1.9540 | |
107 | S | A | 0.0000 | |
108 | Y | A | -1.2190 | |
109 | V | A | 0.0000 | |
110 | R | A | -1.1877 | |
111 | A | A | -0.9054 | |
112 | A | A | 0.0000 | |
113 | D | A | -1.2249 | |
114 | W | A | 0.0000 | |
115 | D | A | -1.5174 | |
116 | S | A | -0.9226 | |
117 | S | A | -0.6485 | |
118 | T | A | -0.4824 | |
119 | D | A | 0.0000 | |
120 | T | A | 0.0000 | |
121 | W | A | 0.0000 | |
122 | T | A | -0.6593 | |
123 | V | A | 0.0000 | |
124 | T | A | -1.0395 | |
125 | F | A | 0.0000 | |
126 | E | A | -1.5554 | |
127 | Q | A | -1.3847 | |
128 | N | A | -1.6309 | |
129 | G | A | -0.8749 | |
130 | V | A | -0.0751 | |
131 | H | A | -1.1564 | |
132 | K | A | -1.1591 | |
133 | H | A | -1.1435 | |
134 | Y | A | -0.5849 | |
135 | R | A | -0.9560 | |
136 | S | A | 0.0000 | |
137 | R | A | -0.9565 | |
138 | F | A | 0.0000 | |
139 | V | A | 0.0000 | |
140 | F | A | 0.0000 | |
141 | F | A | 0.0000 | |
142 | G | A | 0.0000 | |
143 | S | A | -0.1677 | |
144 | G | A | 0.0000 | |
145 | Y | A | -0.0554 | |
146 | Y | A | 0.0000 | |
147 | N | A | -1.2293 | |
148 | Y | A | -1.3419 | |
149 | D | A | -2.3434 | |
150 | E | A | -2.5887 | |
151 | G | A | -1.2370 | |
152 | Y | A | -0.4027 | |
153 | T | A | -0.6084 | |
154 | P | A | -0.8908 | |
155 | D | A | -1.8674 | |
156 | F | A | 0.0000 | |
157 | G | A | -1.7812 | |
158 | G | A | -1.8692 | |
159 | I | A | -1.4934 | |
160 | E | A | -2.5336 | |
161 | K | A | -2.8057 | |
162 | F | A | 0.0000 | |
163 | G | A | -1.3842 | |
164 | G | A | -1.0071 | |
165 | A | A | -0.0062 | |
166 | V | A | 0.4768 | |
167 | V | A | 0.0000 | |
168 | H | A | -0.4914 | |
169 | P | A | 0.0000 | |
170 | Q | A | 0.0000 | |
171 | H | A | -2.0326 | |
172 | W | A | 0.0000 | |
173 | P | A | -2.2344 | |
174 | E | A | -3.3511 | |
175 | D | A | -3.0505 | |
176 | L | A | -2.0588 | |
177 | D | A | -2.7292 | |
178 | Y | A | 0.0000 | |
179 | T | A | -2.2468 | |
180 | G | A | -2.6855 | |
181 | K | A | -2.7658 | |
182 | K | A | -2.6761 | |
183 | I | A | 0.0000 | |
184 | V | A | 0.0000 | |
185 | V | A | 0.0000 | |
186 | I | A | 0.0000 | |
187 | G | A | -0.5151 | |
188 | S | A | -0.4769 | |
189 | G | A | -0.4412 | |
190 | A | A | -0.3422 | |
191 | T | A | -0.1747 | |
192 | A | A | 0.0000 | |
193 | V | A | 0.0000 | |
194 | T | A | 0.0000 | |
195 | L | A | 0.0000 | |
196 | I | A | 0.0000 | |
197 | P | A | -0.8528 | |
198 | S | A | -0.8588 | |
199 | L | A | 0.0000 | |
200 | T | A | 0.0000 | |
201 | D | A | -2.9141 | |
202 | R | A | -3.1667 | |
203 | A | A | 0.0000 | |
204 | E | A | -3.4635 | |
205 | K | A | -2.6022 | |
206 | V | A | 0.0000 | |
207 | T | A | 0.0000 | |
208 | M | A | 0.0000 | |
209 | L | A | 0.0000 | |
210 | Q | A | 0.0000 | |
211 | R | A | -1.9789 | |
212 | S | A | -1.3736 | |
213 | P | A | 0.0000 | |
214 | T | A | 0.0000 | |
215 | Y | A | 0.0000 | |
216 | L | A | 0.0000 | |
217 | I | A | 0.1864 | |
218 | S | A | -0.4747 | |
219 | A | A | -0.4860 | |
220 | S | A | -0.7706 | |
221 | K | A | -0.8888 | |
222 | Y | A | 0.1175 | |
223 | S | A | 0.4596 | |
224 | T | A | 0.6160 | |
225 | F | A | 1.2615 | |
226 | A | A | 0.0000 | |
227 | A | A | 0.3086 | |
228 | V | A | 1.3878 | |
229 | V | A | 0.6672 | |
230 | R | A | -0.7632 | |
231 | K | A | -1.1358 | |
232 | A | A | -0.1791 | |
233 | L | A | 0.0121 | |
234 | P | A | -0.8986 | |
235 | P | A | -1.2803 | |
236 | K | A | -1.6136 | |
237 | T | A | -0.4143 | |
238 | S | A | 0.0000 | |
239 | H | A | 0.0000 | |
240 | L | A | 0.8350 | |
241 | I | A | 1.3522 | |
242 | V | A | 0.0000 | |
243 | R | A | 0.0000 | |
244 | M | A | 1.5422 | |
245 | Y | A | 1.7340 | |
246 | N | A | 1.1792 | |
247 | A | A | 0.0000 | |
248 | L | A | 2.2625 | |
249 | L | A | 2.4326 | |
250 | E | A | 1.5396 | |
251 | A | A | 2.1056 | |
252 | V | A | 3.1147 | |
253 | F | A | 2.1118 | |
254 | W | A | 1.5304 | |
255 | F | A | 1.7840 | |
256 | L | A | 1.2245 | |
257 | S | A | 0.0000 | |
258 | R | A | -0.5717 | |
259 | K | A | -1.1502 | |
260 | T | A | 0.0149 | |
261 | P | A | 0.7212 | |
262 | V | A | 2.1104 | |
263 | F | A | 2.0063 | |
264 | V | A | 0.0000 | |
265 | K | A | 0.7955 | |
266 | W | A | 1.3608 | |
267 | L | A | 1.0151 | |
268 | L | A | 0.0000 | |
269 | R | A | -0.9190 | |
270 | R | A | -1.5808 | |
271 | T | A | -0.9239 | |
272 | A | A | 0.0000 | |
273 | I | A | -0.7838 | |
274 | K | A | -2.0011 | |
275 | N | A | -1.3891 | |
276 | L | A | 0.0000 | |
277 | P | A | -1.4587 | |
278 | E | A | -2.2043 | |
279 | G | A | -1.3849 | |
280 | Y | A | -1.2104 | |
281 | D | A | -1.9589 | |
282 | I | A | 0.0000 | |
283 | E | A | -2.3090 | |
284 | T | A | -1.3387 | |
285 | H | A | -1.2015 | |
286 | F | A | 0.0000 | |
287 | T | A | -1.4104 | |
288 | P | A | 0.0000 | |
289 | R | A | -1.8796 | |
290 | Y | A | -1.1858 | |
291 | N | A | -0.8748 | |
292 | P | A | 0.0000 | |
293 | W | A | -0.5622 | |
294 | D | A | -1.2234 | |
295 | Q | A | -1.2261 | |
296 | R | A | -0.9074 | |
297 | L | A | 0.0000 | |
298 | C | A | 0.0000 | |
299 | L | A | -0.2962 | |
300 | I | A | 0.0000 | |
301 | P | A | 0.0000 | |
302 | D | A | -1.9942 | |
303 | A | A | 0.0000 | |
304 | D | A | -1.3084 | |
305 | L | A | 0.0000 | |
306 | Y | A | 0.0000 | |
307 | N | A | -1.7569 | |
308 | A | A | 0.0000 | |
309 | I | A | 0.0000 | |
310 | T | A | -1.2440 | |
311 | S | A | -1.1575 | |
312 | G | A | -1.5938 | |
313 | R | A | -2.5556 | |
314 | A | A | 0.0000 | |
315 | E | A | -0.9357 | |
316 | V | A | 0.0000 | |
317 | V | A | -0.2926 | |
318 | T | A | -0.7326 | |
319 | D | A | -1.7334 | |
320 | H | A | -2.2703 | |
321 | I | A | -1.9500 | |
322 | D | A | -2.6072 | |
323 | H | A | -2.0361 | |
324 | F | A | 0.0000 | |
325 | D | A | -1.6961 | |
326 | A | A | -1.4358 | |
327 | T | A | -1.3598 | |
328 | G | A | 0.0000 | |
329 | I | A | 0.0000 | |
330 | A | A | -1.6686 | |
331 | L | A | 0.0000 | |
332 | K | A | -2.8542 | |
333 | S | A | -1.7494 | |
334 | G | A | -1.4999 | |
335 | G | A | -1.2124 | |
336 | H | A | -1.5374 | |
337 | L | A | -1.0863 | |
338 | D | A | -2.3131 | |
339 | A | A | 0.0000 | |
340 | D | A | -2.0897 | |
341 | I | A | 0.0000 | |
342 | I | A | 0.0000 | |
343 | V | A | 0.0000 | |
344 | T | A | 0.0000 | |
345 | A | A | 0.0000 | |
346 | T | A | -0.0993 | |
347 | G | A | -0.1256 | |
348 | L | A | -0.2376 | |
349 | Q | A | -0.8492 | |
350 | L | A | 0.0000 | |
351 | Q | A | -0.3840 | |
352 | A | A | -0.4596 | |
353 | L | A | 0.0000 | |
354 | G | A | -0.5187 | |
355 | G | A | -0.6742 | |
356 | A | A | 0.0000 | |
357 | A | A | -0.8667 | |
358 | I | A | 0.0000 | |
359 | S | A | 0.0000 | |
360 | L | A | -0.8879 | |
361 | D | A | -1.9573 | |
362 | G | A | -1.0413 | |
363 | V | A | 0.2091 | |
364 | E | A | -1.3725 | |
365 | I | A | -1.0332 | |
366 | D | A | -2.0484 | |
367 | P | A | -1.7188 | |
368 | R | A | -2.1672 | |
369 | D | A | -2.6286 | |
370 | R | A | -2.1138 | |
371 | F | A | 0.0000 | |
372 | V | A | 0.0000 | |
373 | Y | A | 0.0000 | |
374 | K | A | -0.8868 | |
375 | A | A | -0.3560 | |
376 | H | A | 0.0000 | |
377 | M | A | 0.0000 | |
378 | L | A | 0.0000 | |
379 | E | A | -1.0118 | |
380 | D | A | -0.7693 | |
381 | V | A | 0.0000 | |
382 | P | A | 0.0000 | |
383 | N | A | 0.0000 | |
384 | L | A | 0.0000 | |
385 | F | A | 0.0000 | |
386 | W | A | 0.0000 | |
387 | C | A | 0.0000 | |
388 | V | A | 0.0000 | |
389 | G | A | 0.0000 | |
390 | Y | A | 0.0000 | |
391 | T | A | 0.0000 | |
392 | N | A | -0.3261 | |
393 | A | A | -0.2508 | |
394 | S | A | 0.0000 | |
395 | W | A | 0.1571 | |
396 | T | A | 0.0000 | |
397 | L | A | 0.0000 | |
398 | R | A | 0.0000 | |
399 | A | A | 0.0000 | |
400 | D | A | -0.3966 | |
401 | M | A | -0.3281 | |
402 | T | A | 0.0000 | |
403 | A | A | 0.0000 | |
404 | R | A | -1.7330 | |
405 | A | A | -0.8257 | |
406 | T | A | 0.0000 | |
407 | A | A | 0.0000 | |
408 | K | A | -1.3464 | |
409 | L | A | 0.0000 | |
410 | L | A | 0.0000 | |
411 | A | A | -0.7064 | |
412 | H | A | -0.7893 | |
413 | M | A | 0.0000 | |
414 | A | A | -0.4742 | |
415 | A | A | -0.6070 | |
416 | H | A | -1.2402 | |
417 | G | A | -1.0622 | |
418 | H | A | -0.8195 | |
419 | T | A | -0.6326 | |
420 | R | A | -0.3413 | |
421 | A | A | 0.0000 | |
422 | A | A | 0.1120 | |
423 | P | A | 0.0000 | |
424 | H | A | -0.5602 | |
425 | L | A | -0.9618 | |
426 | G | A | -1.8376 | |
427 | D | A | -2.8535 | |
428 | E | A | -2.9791 | |
429 | P | A | -2.1464 | |
430 | M | A | -2.3278 | |
431 | D | A | -3.2088 | |
432 | E | A | -3.2317 | |
433 | K | A | -2.1266 | |
434 | P | A | -1.2545 | |
435 | S | A | 0.0000 | |
436 | W | A | 0.0000 | |
437 | D | A | -2.4703 | |
438 | I | A | 0.0000 | |
439 | Q | A | -2.0887 | |
440 | A | A | 0.0000 | |
441 | G | A | -1.3695 | |
442 | Y | A | -0.9224 | |
443 | V | A | 0.0000 | |
444 | K | A | -2.4678 | |
445 | R | A | -1.6480 | |
446 | A | A | -0.7275 | |
447 | P | A | -0.8922 | |
448 | Y | A | 0.1526 | |
449 | A | A | 0.0000 | |
450 | L | A | 0.0000 | |
451 | P | A | 0.0000 | |
452 | K | A | -1.7577 | |
453 | S | A | 0.0000 | |
454 | G | A | 0.0000 | |
455 | T | A | -2.2455 | |
456 | K | A | -2.6587 | |
457 | R | A | -2.7041 | |
458 | P | A | -1.8903 | |
459 | W | A | 0.0000 | |
460 | N | A | -2.1399 | |
461 | V | A | 0.0000 | |
462 | R | A | -1.4214 | |
463 | Q | A | -0.8517 | |
464 | N | A | -0.2422 | |
465 | Y | A | 0.4004 | |
466 | L | A | 1.0242 | |
467 | A | A | 0.4057 | |
468 | D | A | 0.2280 | |
469 | A | A | 0.7600 | |
470 | I | A | 1.6902 | |
471 | D | A | 0.0474 | |
472 | Y | A | -0.0876 | |
473 | R | A | -0.5931 | |
474 | F | A | 0.8471 | |
475 | D | A | -0.8452 | |
476 | R | A | -2.2412 | |
477 | I | A | -1.4786 | |
478 | E | A | -1.9557 | |
479 | E | A | 0.0000 | |
480 | A | A | -0.6581 | |
481 | M | A | -0.1752 | |
482 | V | A | 1.1023 | |
483 | F | A | 0.4022 | |
484 | G | A | 0.0624 | |
485 | A | A | -0.3328 | |
486 | A | A | -0.1800 |
Automated mutations analysis
In the automated mutations mode, the server selects aggregation prone resides
and each selected residue is mutated to glutamic acid, lysine, aspartic acid and arginine.
The table below shows 2 best scored mutants for each mutated residue. Protein variants
are ordered according to the mutation effect they had on protein stability
(energetic effect) together with the difference in the average per-residue aggregation score
between the wild type and the mutant (in the table green values indicate a positive change,
grey are neutral, and orange/red mean destabilizing or more aggregation prone mutants).
Summary for all the mutants can be found in this
CSV file.
Mutant |
Energetic effect |
Score comparison |
|||
VR252A | -1.2342 | -0.0533 | View | CSV | PDB |
VD262A | -1.3157 | -0.0375 | View | CSV | PDB |
VE262A | -1.0295 | -0.0381 | View | CSV | PDB |
VK252A | -0.6713 | -0.041 | View | CSV | PDB |
AR251A | -0.3229 | -0.0377 | View | CSV | PDB |
AK251A | -0.3581 | -0.0298 | View | CSV | PDB |
LK249A | -0.0491 | -0.0339 | View | CSV | PDB |
LR249A | 0.0696 | -0.0361 | View | CSV | PDB |
LK248A | 0.4411 | -0.0278 | View | CSV | PDB |
LR248A | 0.5451 | -0.0325 | View | CSV | PDB |
FE253A | 0.7604 | -0.032 | View | CSV | PDB |
FR253A | 1.4495 | -0.0344 | View | CSV | PDB |