Chain sequence(s) |
A: LPNITILATGGTIAGGGDSATKSNYTAGKVGVENLVNAVPQLKDIANVKGEQVVNIGSQDMNDDVWLTLAKKINTDCDKTDGFVITHGTDTMEETAYFLDLTVKCDKPVVMVGAMRPSTSMSADGPFNLYNAVVTAADKASANRGVLVVMNDTVLDGRDVTKTNTTDVATFKSVNYGPLGYIHNGKIDYQRTPARKHTSDTPFDVSKLNELPKVGIVYNYANASDLPAKALVDAGYDGIVSAGVGNGNLYKTVFDTLATAAKNGTAVVRSSRVPTGATTQDAEVDDAKYGFVASGTLNPQKARVLLQLALTQTKDPQQIQQIFNQYD
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] (00:00:00) [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 (00:02:09) [INFO] Main: Simulation completed successfully. (00:02:11) |
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 | L | A | 0.5992 | |
2 | P | A | -0.0271 | |
3 | N | A | -1.1735 | |
4 | I | A | 0.0000 | |
5 | T | A | -1.7396 | |
6 | I | A | 0.0000 | |
7 | L | A | 0.0000 | |
8 | A | A | 0.0000 | |
9 | T | A | 0.0000 | |
10 | G | A | 0.0000 | |
11 | G | A | 0.0000 | |
12 | T | A | 0.0000 | |
13 | I | A | 0.0000 | |
14 | A | A | 0.0000 | |
15 | G | A | 0.0000 | |
16 | G | A | -1.0809 | |
17 | G | A | -1.7432 | |
18 | D | A | -2.3920 | |
19 | S | A | -1.5971 | |
20 | A | A | -0.7851 | |
21 | T | A | -1.1130 | |
22 | K | A | -2.3815 | |
23 | S | A | -1.8970 | |
24 | N | A | -2.0102 | |
25 | Y | A | -1.1846 | |
26 | T | A | -0.7057 | |
27 | A | A | -0.7496 | |
28 | G | A | -0.8651 | |
29 | K | A | -1.7040 | |
30 | V | A | -1.3512 | |
31 | G | A | -1.7137 | |
32 | V | A | 0.0000 | |
33 | E | A | -3.3761 | |
34 | N | A | -2.5711 | |
35 | L | A | 0.0000 | |
36 | V | A | 0.0000 | |
37 | N | A | -2.6271 | |
38 | A | A | -1.4381 | |
39 | V | A | 0.0000 | |
40 | P | A | -1.9526 | |
41 | Q | A | -2.2928 | |
42 | L | A | 0.0000 | |
43 | K | A | -3.1023 | |
44 | D | A | -2.7759 | |
45 | I | A | -1.0895 | |
46 | A | A | 0.0000 | |
47 | N | A | -1.8310 | |
48 | V | A | -1.3983 | |
49 | K | A | -2.6719 | |
50 | G | A | -2.4226 | |
51 | E | A | -2.5931 | |
52 | Q | A | -1.3373 | |
53 | V | A | -0.2708 | |
54 | V | A | 0.1067 | |
55 | N | A | -0.5329 | |
56 | I | A | -0.7529 | |
57 | G | A | -1.3080 | |
58 | S | A | 0.0000 | |
59 | Q | A | -2.3043 | |
60 | D | A | -2.5460 | |
61 | M | A | -1.8237 | |
62 | N | A | -2.0797 | |
63 | D | A | -2.3203 | |
64 | D | A | -2.7875 | |
65 | V | A | 0.0000 | |
66 | W | A | 0.0000 | |
67 | L | A | 0.0000 | |
68 | T | A | -1.0813 | |
69 | L | A | 0.0000 | |
70 | A | A | 0.0000 | |
71 | K | A | -1.5587 | |
72 | K | A | -1.2464 | |
73 | I | A | 0.0000 | |
74 | N | A | -1.4538 | |
75 | T | A | -1.6200 | |
76 | D | A | -2.4037 | |
77 | C | A | -2.4403 | |
78 | D | A | -3.1493 | |
79 | K | A | -3.0728 | |
80 | T | A | 0.0000 | |
81 | D | A | -2.4860 | |
82 | G | A | 0.0000 | |
83 | F | A | 0.0000 | |
84 | V | A | 0.0000 | |
85 | I | A | 0.0000 | |
86 | T | A | 0.0000 | |
87 | H | A | 0.0000 | |
88 | G | A | 0.0000 | |
89 | T | A | 0.0000 | |
90 | D | A | -1.2277 | |
91 | T | A | -1.0785 | |
92 | M | A | 0.0000 | |
93 | E | A | 0.0000 | |
94 | E | A | -0.4010 | |
95 | T | A | 0.0000 | |
96 | A | A | 0.0000 | |
97 | Y | A | 0.0000 | |
98 | F | A | 0.0000 | |
99 | L | A | 0.0000 | |
100 | D | A | 0.0000 | |
101 | L | A | 0.0000 | |
102 | T | A | 0.0000 | |
103 | V | A | 0.0000 | |
104 | K | A | -1.4588 | |
105 | C | A | 0.0000 | |
106 | D | A | -1.5248 | |
107 | K | A | -1.9786 | |
108 | P | A | 0.0000 | |
109 | V | A | 0.0000 | |
110 | V | A | 0.0000 | |
111 | M | A | 0.0000 | |
112 | V | A | 0.0000 | |
113 | G | A | 0.0000 | |
114 | A | A | 0.0000 | |
115 | M | A | 0.0000 | |
116 | R | A | -0.8410 | |
117 | P | A | 0.0000 | |
118 | S | A | -0.4737 | |
119 | T | A | -0.4932 | |
120 | S | A | -0.5130 | |
121 | M | A | 0.5532 | |
122 | S | A | 0.0623 | |
123 | A | A | 0.1288 | |
124 | D | A | 0.0616 | |
125 | G | A | 0.0000 | |
126 | P | A | 0.6508 | |
127 | F | A | 1.5526 | |
128 | N | A | 0.0000 | |
129 | L | A | 0.0000 | |
130 | Y | A | 0.6227 | |
131 | N | A | 0.0000 | |
132 | A | A | 0.0000 | |
133 | V | A | 0.0000 | |
134 | V | A | 0.0000 | |
135 | T | A | 0.0000 | |
136 | A | A | 0.0000 | |
137 | A | A | -0.8529 | |
138 | D | A | -1.6923 | |
139 | K | A | -2.2996 | |
140 | A | A | -1.3705 | |
141 | S | A | 0.0000 | |
142 | A | A | -1.7297 | |
143 | N | A | -1.9300 | |
144 | R | A | -1.4207 | |
145 | G | A | -1.0799 | |
146 | V | A | 0.0000 | |
147 | L | A | 0.0000 | |
148 | V | A | 0.0000 | |
149 | V | A | 0.0000 | |
150 | M | A | 0.0000 | |
151 | N | A | -0.8516 | |
152 | D | A | -0.8383 | |
153 | T | A | -0.5733 | |
154 | V | A | 0.0000 | |
155 | L | A | 0.0000 | |
156 | D | A | 0.0000 | |
157 | G | A | 0.0000 | |
158 | R | A | 0.0000 | |
159 | D | A | 0.0000 | |
160 | V | A | 0.0000 | |
161 | T | A | 0.0000 | |
162 | K | A | -1.0669 | |
163 | T | A | -1.0392 | |
164 | N | A | -1.4021 | |
165 | T | A | -0.8612 | |
166 | T | A | -0.9191 | |
167 | D | A | -1.2741 | |
168 | V | A | -0.6295 | |
169 | A | A | -0.9396 | |
170 | T | A | 0.0000 | |
171 | F | A | 0.0000 | |
172 | K | A | -1.2850 | |
173 | S | A | 0.0000 | |
174 | V | A | 0.0153 | |
175 | N | A | 0.1147 | |
176 | Y | A | 0.7768 | |
177 | G | A | 0.0158 | |
178 | P | A | -0.3457 | |
179 | L | A | 0.0000 | |
180 | G | A | 0.0000 | |
181 | Y | A | -0.1846 | |
182 | I | A | 0.0000 | |
183 | H | A | -2.3101 | |
184 | N | A | -2.4469 | |
185 | G | A | -2.0279 | |
186 | K | A | -2.6684 | |
187 | I | A | -1.7545 | |
188 | D | A | -2.2815 | |
189 | Y | A | -1.6527 | |
190 | Q | A | -2.2808 | |
191 | R | A | -2.5208 | |
192 | T | A | -1.5306 | |
193 | P | A | -0.9144 | |
194 | A | A | -0.9054 | |
195 | R | A | -1.7124 | |
196 | K | A | -2.1211 | |
197 | H | A | -1.7919 | |
198 | T | A | 0.0000 | |
199 | S | A | -1.9016 | |
200 | D | A | -2.4235 | |
201 | T | A | 0.0000 | |
202 | P | A | -1.2968 | |
203 | F | A | 0.0000 | |
204 | D | A | -1.9508 | |
205 | V | A | 0.0000 | |
206 | S | A | -1.8445 | |
207 | K | A | -2.5242 | |
208 | L | A | -2.1420 | |
209 | N | A | -2.8660 | |
210 | E | A | -3.2381 | |
211 | L | A | 0.0000 | |
212 | P | A | -1.6350 | |
213 | K | A | -2.3634 | |
214 | V | A | 0.0000 | |
215 | G | A | -0.2481 | |
216 | I | A | 0.8054 | |
217 | V | A | 0.0000 | |
218 | Y | A | 1.3705 | |
219 | N | A | 0.0000 | |
220 | Y | A | 0.7592 | |
221 | A | A | -0.0375 | |
222 | N | A | -1.2811 | |
223 | A | A | 0.0000 | |
224 | S | A | -0.1362 | |
225 | D | A | -0.3741 | |
226 | L | A | 0.8330 | |
227 | P | A | 0.4190 | |
228 | A | A | 0.0000 | |
229 | K | A | -0.8472 | |
230 | A | A | -0.4525 | |
231 | L | A | -0.4819 | |
232 | V | A | -0.8222 | |
233 | D | A | -1.6901 | |
234 | A | A | -1.1509 | |
235 | G | A | -1.3375 | |
236 | Y | A | -1.2182 | |
237 | D | A | -1.8381 | |
238 | G | A | 0.0000 | |
239 | I | A | 0.0000 | |
240 | V | A | 0.0000 | |
241 | S | A | 0.0000 | |
242 | A | A | 0.0000 | |
243 | G | A | 0.0000 | |
244 | V | A | 0.2724 | |
245 | G | A | -0.6972 | |
246 | N | A | -1.2315 | |
247 | G | A | 0.0000 | |
248 | N | A | -1.0585 | |
249 | L | A | 0.0000 | |
250 | Y | A | -0.7097 | |
251 | K | A | -2.2290 | |
252 | T | A | -1.3968 | |
253 | V | A | 0.0000 | |
254 | F | A | -1.1714 | |
255 | D | A | -2.1208 | |
256 | T | A | 0.0000 | |
257 | L | A | 0.0000 | |
258 | A | A | 0.0000 | |
259 | T | A | -1.3536 | |
260 | A | A | 0.0000 | |
261 | A | A | -1.3518 | |
262 | K | A | -2.6043 | |
263 | N | A | -2.2690 | |
264 | G | A | -2.2177 | |
265 | T | A | -1.4325 | |
266 | A | A | -1.2592 | |
267 | V | A | 0.0000 | |
268 | V | A | 0.0000 | |
269 | R | A | 0.0000 | |
270 | S | A | 0.0000 | |
271 | S | A | 0.0000 | |
272 | R | A | -1.0256 | |
273 | V | A | -0.2181 | |
274 | P | A | -0.4740 | |
275 | T | A | -0.2300 | |
276 | G | A | -0.4300 | |
277 | A | A | -0.5116 | |
278 | T | A | 0.0000 | |
279 | T | A | -1.2026 | |
280 | Q | A | -2.2097 | |
281 | D | A | -2.8859 | |
282 | A | A | -2.4148 | |
283 | E | A | -2.9082 | |
284 | V | A | 0.0000 | |
285 | D | A | -3.1723 | |
286 | D | A | 0.0000 | |
287 | A | A | -1.7145 | |
288 | K | A | -2.2826 | |
289 | Y | A | -1.3025 | |
290 | G | A | -1.4333 | |
291 | F | A | 0.0000 | |
292 | V | A | 0.0000 | |
293 | A | A | 0.0000 | |
294 | S | A | 0.0000 | |
295 | G | A | -0.6588 | |
296 | T | A | -0.3062 | |
297 | L | A | 0.0000 | |
298 | N | A | -0.6624 | |
299 | P | A | 0.0000 | |
300 | Q | A | -0.5942 | |
301 | K | A | 0.0000 | |
302 | A | A | 0.0000 | |
303 | R | A | -0.5521 | |
304 | V | A | 0.0000 | |
305 | L | A | 0.0000 | |
306 | L | A | 0.0000 | |
307 | Q | A | 0.0000 | |
308 | L | A | 0.0000 | |
309 | A | A | 0.0000 | |
310 | L | A | 0.0000 | |
311 | T | A | -1.0653 | |
312 | Q | A | -1.5782 | |
313 | T | A | -1.7694 | |
314 | K | A | -2.7668 | |
315 | D | A | -2.5192 | |
316 | P | A | -1.9243 | |
317 | Q | A | -2.3486 | |
318 | Q | A | -2.4672 | |
319 | I | A | 0.0000 | |
320 | Q | A | -1.9112 | |
321 | Q | A | -2.3402 | |
322 | I | A | 0.0000 | |
323 | F | A | 0.0000 | |
324 | N | A | -2.1430 | |
325 | Q | A | -1.9045 | |
326 | Y | A | -1.4185 | |
401 | D | A | -0.9420 |