Project name: 93bed06b80b8da2

Status: done

Started: 2026-06-15 10:34:40
Chain sequence(s) A: VYTHDTGLDYITYSDYELDPANPLAGGAAWIEGAFVPPSEARISIFDQGFYTSDATYTTFHVWNGNAFRLGDHIERLFSNAESIRLIPPLTQDEVKEIALELVAKTELREAMVTVTITRGYSSTPFERDITKHRPQVYMSAPYQWIVPFDRIRDGVHLMVAQSVRRTPRSSIDPQVKNFQWGDLIRAIQETHDRGFELPLLLDCDNLLAEGPGFNVVVIKDGVVRSPGRAALPGITRKTVLEIAESLGHEAILADITPAELYDADEVLGCSTGGGVWPFVSVDGNSISDGVPGPVTQSIIRRYWELNVEPSSLLTPVQY
B: PEIVYTHDTGLDYITYSDYELDPANPLAGGAAWIEGAFVPPSEARISIFDQGFYTSDATYTTFHVWNGNAFRLGDHIERLFSNAESIRLIPPLTQDEVKEIALELVAKTELREAMVTVTITRGYSSTPFERDITKHRPQVYMSAPYQWIVPFDRIRDGVHLMVAQSVRRTPRSSIDPQVKNFQWGDLIRAIQETHDRGFELPLLLDCDNLLAEGPGFNVVVIKDGVVRSPGRAALPGITRKTVLEIAESLGHEAILADITPAELYDADEVLGCSTGGGVWPFVSVDGNSISDGVPGPVTQSIIRRYWELNVEPSSLLTPVQY
input PDB
Selected Chain(s) A,B
Distance of aggregation 10 Å
FoldX usage Yes
pH calculations No
alphaCutter usage No
Dynamic mode No
Automated mutations Yes
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 all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimization                                          (00:00:01)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (00:05:44)
[INFO]       AutoMut:  Residue number 11 from chain A and a score of 1.625 (valine) selected for   
                       automated mutation                                                          (00:05:49)
[INFO]       AutoMut:  Residue number 11 from chain B and a score of 1.484 (valine) selected for   
                       automated mutation                                                          (00:05:49)
[INFO]       AutoMut:  Residue number 10 from chain B and a score of 1.323 (isoleucine) selected   
                       for automated mutation                                                      (00:05:49)
[INFO]       AutoMut:  Residue number 97 from chain B and a score of 0.968 (isoleucine) selected   
                       for automated mutation                                                      (00:05:49)
[INFO]       AutoMut:  Residue number 56 from chain B and a score of 0.893 (phenylalanine)         
                       selected for automated mutation                                             (00:05:49)
[INFO]       AutoMut:  Residue number 56 from chain A and a score of 0.867 (phenylalanine)         
                       selected for automated mutation                                             (00:05:49)
[INFO]       AutoMut:  Mutating residue number 11 from chain A (valine) into glutamic acid         (00:05:49)
[INFO]       AutoMut:  Mutating residue number 11 from chain B (valine) into glutamic acid         (00:05:49)
[INFO]       AutoMut:  Mutating residue number 11 from chain A (valine) into aspartic acid         (00:05:49)
[INFO]       AutoMut:  Mutating residue number 11 from chain A (valine) into arginine              (00:06:02)
[INFO]       AutoMut:  Mutating residue number 11 from chain A (valine) into lysine                (00:06:02)
[INFO]       AutoMut:  Mutating residue number 11 from chain B (valine) into lysine                (00:06:06)
[INFO]       AutoMut:  Mutating residue number 11 from chain B (valine) into aspartic acid         (00:06:23)
[INFO]       AutoMut:  Mutating residue number 10 from chain B (isoleucine) into glutamic acid     (00:06:25)
[INFO]       AutoMut:  Mutating residue number 10 from chain B (isoleucine) into aspartic acid     (00:06:29)
[INFO]       AutoMut:  Mutating residue number 11 from chain B (valine) into arginine              (00:06:37)
[INFO]       AutoMut:  Mutating residue number 10 from chain B (isoleucine) into lysine            (00:06:40)
[INFO]       AutoMut:  Mutating residue number 10 from chain B (isoleucine) into arginine          (00:06:44)
[INFO]       AutoMut:  Mutating residue number 97 from chain B (isoleucine) into glutamic acid     (00:06:56)
[INFO]       AutoMut:  Mutating residue number 97 from chain B (isoleucine) into aspartic acid     (00:06:59)
[INFO]       AutoMut:  Mutating residue number 56 from chain B (phenylalanine) into glutamic acid  
                       Mutating residue number 56 from chain B (phenylalanine) into glutamic acid  (00:07:00)
[INFO]       AutoMut:  Mutating residue number 97 from chain B (isoleucine) into lysine            (00:07:11)
[INFO]       AutoMut:  Mutating residue number 97 from chain B (isoleucine) into arginine          (00:07:11)
[INFO]       AutoMut:  Mutating residue number 56 from chain B (phenylalanine) into lysine         (00:07:23)
[INFO]       AutoMut:  Mutating residue number 56 from chain B (phenylalanine) into aspartic acid  
                       Mutating residue number 56 from chain B (phenylalanine) into aspartic acid  (00:07:28)
[INFO]       AutoMut:  Mutating residue number 56 from chain A (phenylalanine) into glutamic acid  
                       Mutating residue number 56 from chain A (phenylalanine) into glutamic acid  (00:07:31)
[INFO]       AutoMut:  Mutating residue number 56 from chain B (phenylalanine) into arginine       (00:07:43)
[INFO]       AutoMut:  Mutating residue number 56 from chain A (phenylalanine) into lysine         (00:07:49)
[INFO]       AutoMut:  Mutating residue number 56 from chain A (phenylalanine) into aspartic acid  
                       Mutating residue number 56 from chain A (phenylalanine) into aspartic acid  (00:08:12)
[INFO]       AutoMut:  Mutating residue number 56 from chain A (phenylalanine) into arginine       (00:08:29)
[INFO]       AutoMut:  Effect of mutation residue number 11 from chain A (valine) into glutamic    
                       acid: Energy difference: 0.1234 kcal/mol, Difference in average score from  
                       the base case: -0.0130                                                      (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 11 from chain A (valine) into lysine:     
                       Energy difference: -0.3507 kcal/mol, Difference in average score from the   
                       base case: -0.0119                                                          (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 11 from chain A (valine) into aspartic    
                       acid: Energy difference: -0.0049 kcal/mol, Difference in average score from 
                       the base case: -0.0136                                                      (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 11 from chain A (valine) into arginine:   
                       Energy difference: -0.8255 kcal/mol, Difference in average score from the   
                       base case: -0.0125                                                          (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 11 from chain B (valine) into glutamic    
                       acid: Energy difference: 0.2965 kcal/mol, Difference in average score from  
                       the base case: -0.0128                                                      (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 11 from chain B (valine) into lysine:     
                       Energy difference: -0.0855 kcal/mol, Difference in average score from the   
                       base case: -0.0146                                                          (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 11 from chain B (valine) into aspartic    
                       acid: Energy difference: 0.3585 kcal/mol, Difference in average score from  
                       the base case: -0.0133                                                      (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 11 from chain B (valine) into arginine:   
                       Energy difference: -0.3323 kcal/mol, Difference in average score from the   
                       base case: -0.0126                                                          (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 10 from chain B (isoleucine) into         
                       glutamic acid: Energy difference: 1.5974 kcal/mol, Difference in average    
                       score from the base case: -0.0162                                           (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 10 from chain B (isoleucine) into lysine: 
                       Energy difference: 0.7169 kcal/mol, Difference in average score from the    
                       base case: -0.0126                                                          (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 10 from chain B (isoleucine) into         
                       aspartic acid: Energy difference: 1.6672 kcal/mol, Difference in average    
                       score from the base case: -0.0161                                           (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 10 from chain B (isoleucine) into         
                       arginine: Energy difference: 0.4261 kcal/mol, Difference in average score   
                       from the base case: -0.0144                                                 (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 97 from chain B (isoleucine) into         
                       glutamic acid: Energy difference: 0.4052 kcal/mol, Difference in average    
                       score from the base case: -0.0188                                           (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 97 from chain B (isoleucine) into lysine: 
                       Energy difference: -0.3063 kcal/mol, Difference in average score from the   
                       base case: -0.0170                                                          (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 97 from chain B (isoleucine) into         
                       aspartic acid: Energy difference: 0.2131 kcal/mol, Difference in average    
                       score from the base case: -0.0187                                           (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 97 from chain B (isoleucine) into         
                       arginine: Energy difference: -0.2888 kcal/mol, Difference in average score  
                       from the base case: -0.0189                                                 (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 56 from chain B (phenylalanine) into      
                       glutamic acid: Energy difference: 1.2266 kcal/mol, Difference in average    
                       score from the base case: -0.0065                                           (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 56 from chain B (phenylalanine) into      
                       lysine: Energy difference: 0.8812 kcal/mol, Difference in average score     
                       from the base case: -0.0072                                                 (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 56 from chain B (phenylalanine) into      
                       aspartic acid: Energy difference: 1.2313 kcal/mol, Difference in average    
                       score from the base case: -0.0082                                           (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 56 from chain B (phenylalanine) into      
                       arginine: Energy difference: 0.7206 kcal/mol, Difference in average score   
                       from the base case: -0.0090                                                 (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 56 from chain A (phenylalanine) into      
                       glutamic acid: Energy difference: 1.9227 kcal/mol, Difference in average    
                       score from the base case: -0.0100                                           (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 56 from chain A (phenylalanine) into      
                       lysine: Energy difference: 1.0627 kcal/mol, Difference in average score     
                       from the base case: -0.0071                                                 (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 56 from chain A (phenylalanine) into      
                       aspartic acid: Energy difference: 1.6987 kcal/mol, Difference in average    
                       score from the base case: -0.0118                                           (00:09:04)
[INFO]       AutoMut:  Effect of mutation residue number 56 from chain A (phenylalanine) into      
                       arginine: Energy difference: 0.5944 kcal/mol, Difference in average score   
                       from the base case: -0.0087                                                 (00:09:04)
[INFO]       Main:     Simulation completed successfully.                                          (00:09:12)
Show buried residues
Minimal score value
-3.3838
Maximal score value
1.6246
Average score
-0.6331
Total score value
-405.7884
Download the table (csv)

The table below lists A4D score for protein residues. Residues with A4D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan4D score mutation
11 V A 1.6246
12 Y A 0.3603
13 T A -0.3781
14 H A -1.0434
15 D A -2.3050
16 T A -1.9511
17 G A -1.9339
18 L A -1.8051
19 D A -2.0458
20 Y A -1.1949
21 I A 0.0000
22 T A -0.9367
23 Y A -0.9476
24 S A -1.3636
25 D A -2.1961
26 Y A -1.7516
27 E A -2.3288
28 L A -1.3596
29 D A -1.9448
30 P A -1.1898
31 A A -0.6852
32 N A -1.0393
33 P A -0.7948
34 L A 0.0000
35 A A -1.0356
36 G A -0.4947
37 G A -0.3833
38 A A 0.0000
39 A A 0.0000
40 W A -0.3614
41 I A 0.0000
42 E A -1.9857
43 G A -1.1632
44 A A -0.4876
45 F A -0.2125
46 V A 0.0000
47 P A -0.7727
48 P A -0.6677
49 S A -0.9657
50 E A -1.6829
51 A A 0.0000
52 R A -1.3079
53 I A 0.0000
54 S A -0.3434
55 I A 0.0000
56 F A 0.8670
57 D A 0.0000
58 Q A 0.0000
59 G A 0.0000
60 F A 0.0000
61 Y A 0.4672
62 T A 0.0000
63 S A 0.0000
64 D A 0.0000
65 A A 0.0000
66 T A 0.0000
67 Y A 0.0000
68 T A 0.0000
69 T A -0.0498
70 F A 0.0000
71 H A 0.0000
72 V A 0.0000
73 W A 0.0000
74 N A -0.9546
75 G A 0.0000
76 N A -0.5623
77 A A 0.0000
78 F A 0.0000
79 R A -0.4032
80 L A 0.0000
81 G A -1.7437
82 D A -1.6756
83 H A 0.0000
84 I A 0.0000
85 E A -2.6865
86 R A -2.0268
87 L A 0.0000
88 F A 0.0000
89 S A -1.4587
90 N A 0.0000
91 A A 0.0000
92 E A -1.9866
93 S A -1.2853
94 I A -1.0569
95 R A -1.9343
96 L A 0.0000
97 I A 0.7218
98 P A 0.0000
99 P A -0.2613
100 L A -0.5140
101 T A -1.2510
102 Q A -2.9291
103 D A -3.3838
104 E A -2.8638
105 V A 0.0000
106 K A -2.6036
107 E A -3.2145
108 I A -1.6207
109 A A 0.0000
110 L A 0.0000
111 E A -1.4393
112 L A 0.0000
113 V A 0.0000
114 A A -0.6089
115 K A -0.9974
116 T A 0.0000
117 E A -1.1018
118 L A 0.0000
119 R A -0.9709
120 E A 0.0000
121 A A 0.0000
122 M A -0.2265
123 V A 0.0000
124 T A 0.0039
125 V A 0.0000
126 T A 0.0000
127 I A 0.0000
128 T A 0.0000
129 R A -0.4615
130 G A 0.0000
131 Y A 0.4847
132 S A -0.7588
133 S A -0.6982
134 T A -0.3006
135 P A -0.1334
136 F A -0.4381
137 E A -1.2606
138 R A -1.4371
139 D A -0.9138
140 I A 0.4747
141 T A -0.6300
142 K A -2.0234
143 H A -1.4381
144 R A -1.8858
145 P A -0.7948
146 Q A -0.7782
147 V A 0.0000
148 Y A 0.0000
149 M A 0.0000
150 S A 0.1290
151 A A -0.1956
153 P A 0.0207
154 Y A 0.0000
155 Q A -0.8164
156 W A -0.2191
157 I A 0.2168
158 V A 0.0000
159 P A -1.1935
160 F A -1.8022
161 D A -2.9125
162 R A -2.3692
163 I A 0.0000
164 R A -3.0130
165 D A -1.9671
166 G A 0.0000
167 V A 0.0000
168 H A -0.7319
169 L A 0.0000
170 M A 0.0000
171 V A 0.0000
172 A A 0.0000
173 Q A -1.4328
174 S A -1.0368
175 V A 0.0000
176 R A -1.4871
177 R A 0.0000
178 T A 0.0000
179 P A 0.0000
180 R A -1.7917
181 S A -0.9068
182 S A 0.0000
183 I A 0.0000
184 D A -1.0085
185 P A 0.0000
186 Q A -0.9269
187 V A -0.5571
188 K A -0.5843
189 N A -0.2731
190 F A 0.0000
191 Q A 0.0000
192 W A 0.0918
193 G A -0.0768
194 D A 0.0000
195 L A 0.0000
196 I A -0.0151
197 R A -0.6848
198 A A 0.0000
199 I A 0.0000
200 Q A -1.4737
201 E A 0.0000
202 T A 0.0000
203 H A -2.4344
204 D A -3.0323
205 R A -2.8129
206 G A -1.9086
207 F A -1.2930
208 E A -0.8412
209 L A 0.0000
210 P A 0.0000
211 L A 0.0000
212 L A 0.0000
213 L A 0.0000
214 D A 0.0000
215 C A -1.1354
216 D A -2.2101
217 N A -2.1315
218 L A -1.4569
219 L A 0.0000
220 A A 0.0000
221 E A 0.0000
222 G A 0.0000
223 P A 0.0000
224 G A -0.0927
225 F A 0.0000
226 N A 0.0000
227 V A 0.0000
228 V A 0.0000
229 V A 0.0000
230 I A 0.0000
231 K A -2.0971
232 D A -2.4390
233 G A -1.7148
234 V A -1.4418
235 V A 0.0000
236 R A -0.2453
237 S A 0.0000
238 P A 0.0000
239 G A -1.1643
240 R A -2.1765
241 A A 0.0000
242 A A 0.0000
243 L A -0.3751
244 P A -0.6376
245 G A -0.4180
246 I A -0.4866
247 T A 0.0000
248 R A -0.6015
249 K A -0.9751
250 T A 0.0000
251 V A 0.0000
252 L A 0.0000
253 E A -1.6544
254 I A 0.0000
255 A A 0.0000
256 E A -2.5813
257 S A -1.4608
258 L A -0.8102
259 G A -1.3588
260 H A -1.9936
261 E A -2.5303
262 A A -1.1686
263 I A 0.1178
264 L A 0.2658
265 A A -0.4933
266 D A -1.5881
267 I A 0.0000
268 T A -0.8028
269 P A -0.5115
270 A A -0.5176
271 E A -1.2521
272 L A 0.0000
273 Y A -1.0628
274 D A -2.1740
275 A A 0.0000
276 D A -2.0576
277 E A 0.0000
278 V A 0.0000
279 L A 0.0000
280 G A 0.0000
281 C A 0.0000
282 S A -0.0203
283 T A -0.1314
284 G A -0.2198
285 G A 0.0000
286 G A 0.0000
287 V A 0.0000
288 W A 0.0000
289 P A 0.0000
290 F A 0.0000
291 V A 0.0352
292 S A 0.0000
293 V A 0.0000
294 D A -1.1292
295 G A -1.1455
296 N A -1.4566
297 S A -1.2247
298 I A 0.0000
299 S A -1.3981
300 D A -1.5139
301 G A -0.4353
302 V A 0.6138
303 P A -0.3151
304 G A -0.4130
305 P A -0.4323
306 V A -0.4233
307 T A 0.0000
308 Q A -1.6657
309 S A -1.0691
310 I A 0.0000
311 I A 0.0000
312 R A -2.0229
313 R A -1.8623
314 Y A 0.0000
315 W A 0.0000
316 E A -1.8058
317 L A -1.0318
318 N A 0.0000
319 V A -0.4129
320 E A -1.8173
321 P A -1.0346
322 S A -0.5101
323 S A -0.3760
324 L A -0.1487
325 L A -0.2483
326 T A -0.4026
327 P A -0.5138
328 V A 0.0000
329 Q A -0.9337
330 Y A 0.4134
8 P B -0.6347
9 E B -0.8253
10 I B 1.3230
11 V B 1.4837
12 Y B 0.2422
13 T B -0.5059
14 H B -1.4551
15 D B -2.2171
16 T B -1.8402
17 G B -2.0185
18 L B 0.0000
19 D B -1.9821
20 Y B -1.3062
21 I B 0.0000
22 T B -1.0046
23 Y B -0.9700
24 S B -1.3472
25 D B -2.1685
26 Y B -1.7660
27 E B -2.4644
28 L B -1.3815
29 D B -2.0535
30 P B -1.2447
31 A B -0.7045
32 N B -1.0020
33 P B -0.7242
34 L B 0.0000
35 A B -0.7584
36 G B 0.0000
37 G B 0.0084
38 A B 0.0000
39 A B 0.0000
40 W B -0.2787
41 I B 0.0000
42 E B -1.0960
43 G B -0.7401
44 A B -0.1588
45 F B -0.0312
46 V B -0.3729
47 P B -0.7924
48 P B -0.8210
49 S B -1.2698
50 E B -2.0914
51 A B 0.0000
52 R B -1.3648
53 I B 0.0000
54 S B -0.2840
55 I B 0.0000
56 F B 0.8931
57 D B 0.0000
58 Q B 0.0000
59 G B 0.0000
60 F B 0.0000
61 Y B 0.5563
62 T B 0.0000
63 S B 0.0000
64 D B 0.0000
65 A B 0.0000
66 T B 0.0000
67 Y B 0.0000
68 T B 0.0000
69 T B -0.0735
70 F B 0.0000
71 H B 0.0000
72 V B 0.0000
73 W B 0.0000
74 N B -0.8113
75 G B 0.0000
76 N B -0.7321
77 A B 0.0000
78 F B 0.0000
79 R B 0.0000
80 L B 0.0000
81 G B -1.2870
82 D B -1.2354
83 H B 0.0000
84 I B 0.0000
85 E B -1.8548
86 R B -1.5282
87 L B 0.0000
88 F B -0.6923
89 S B -1.1020
90 N B 0.0000
91 A B 0.0000
92 E B -1.6994
93 S B -1.0511
94 I B -0.7304
95 R B -1.0735
96 L B 0.0000
97 I B 0.9676
98 P B 0.1532
99 P B -0.2404
100 L B -0.4663
101 T B -1.0627
102 Q B -2.3654
103 D B -3.2239
104 E B -2.8237
105 V B 0.0000
106 K B -2.5507
107 E B -3.2676
108 I B -1.7178
109 A B 0.0000
110 L B 0.0000
111 E B -1.4433
112 L B 0.0000
113 V B 0.0000
114 A B -0.5554
115 K B -0.8448
116 T B 0.0000
117 E B -0.9262
118 L B 0.0000
119 R B -1.0013
120 E B 0.0000
121 A B 0.0000
122 M B -0.1669
123 V B 0.0000
124 T B 0.0116
125 V B 0.0000
126 T B 0.0000
127 I B 0.0000
128 T B 0.0000
129 R B 0.0000
130 G B 0.0000
131 Y B 0.3926
132 S B -0.5830
133 S B -0.6392
134 T B -0.3016
135 P B -0.1857
136 F B -0.4816
137 E B -1.4922
138 R B -2.3733
139 D B -1.3049
140 I B 0.1625
141 T B -0.6072
142 K B -1.7178
143 H B -1.2324
144 R B -1.7142
145 P B -0.7187
146 Q B -0.8168
147 V B 0.0000
148 Y B 0.0000
149 M B 0.0000
150 S B 0.1516
151 A B -0.1704
153 P B 0.2054
154 Y B 0.0000
155 Q B -1.0473
156 W B -0.3186
157 I B -0.0778
158 V B 0.0000
159 P B -1.1601
160 F B -1.9289
161 D B -3.0299
162 R B -2.6757
163 I B 0.0000
164 R B -2.9567
165 D B -2.7474
166 G B 0.0000
167 V B 0.0000
168 H B -0.9493
169 L B 0.0000
170 M B 0.0000
171 V B 0.0000
172 A B 0.0000
173 Q B -1.3652
174 S B -0.9942
175 V B 0.0000
176 R B -1.0717
177 R B 0.0000
178 T B 0.0000
179 P B 0.0000
180 R B -1.8191
181 S B -1.1214
182 S B 0.0000
183 I B 0.0000
184 D B -1.0568
185 P B 0.0000
186 Q B -1.0011
187 V B -0.6961
188 K B -0.6285
189 N B -0.3045
190 F B 0.0000
191 Q B 0.0000
192 W B 0.0815
193 G B -0.0866
194 D B 0.0000
195 L B 0.0000
196 I B -0.0066
197 R B -0.7375
198 A B 0.0000
199 I B 0.0000
200 Q B -1.5068
201 E B 0.0000
202 T B 0.0000
203 H B -2.4090
204 D B -3.0118
205 R B -3.1453
206 G B -2.0029
207 F B -1.3402
208 E B -0.9467
209 L B 0.0000
210 P B 0.0000
211 L B 0.0000
212 L B 0.0000
213 L B 0.0000
214 D B 0.0000
215 C B -0.7017
216 D B -1.9086
217 N B -1.7447
218 L B -1.4531
219 L B 0.0000
220 A B 0.0000
221 E B 0.0000
222 G B 0.0000
223 P B 0.0000
224 G B -0.2366
225 F B 0.0000
226 N B 0.0000
227 V B 0.0000
228 V B 0.0000
229 V B 0.0000
230 I B 0.0000
231 K B -2.3150
232 D B -2.4909
233 G B -1.7569
234 V B -1.5549
235 V B 0.0000
236 R B -0.3692
237 S B 0.0000
238 P B 0.0000
239 G B -1.1184
240 R B -2.3166
241 A B -1.5685
242 A B 0.0000
243 L B -0.5636
244 P B -0.6527
245 G B -0.5320
246 I B 0.0000
247 T B 0.0000
248 R B -0.6207
249 K B -0.9116
250 T B 0.0000
251 V B 0.0000
252 L B 0.0000
253 E B -2.1654
254 I B 0.0000
255 A B 0.0000
256 E B -2.8316
257 S B -1.7251
258 L B -1.1047
259 G B -1.4949
260 H B -2.0801
261 E B -2.5996
262 A B -1.2575
263 I B 0.3601
264 L B 0.4056
265 A B -0.4571
266 D B -1.5588
267 I B 0.0000
268 T B -1.2021
269 P B -0.7450
270 A B -1.0025
271 E B -1.9480
272 L B 0.0000
273 Y B -1.3369
274 D B -2.4873
275 A B 0.0000
276 D B -2.3229
277 E B 0.0000
278 V B 0.0000
279 L B 0.0000
280 G B 0.0000
281 C B 0.0000
282 S B -0.1102
283 T B 0.0000
284 G B -0.3017
285 G B 0.0000
286 G B 0.0000
287 V B 0.0000
288 W B 0.0000
289 P B 0.0000
290 F B 0.0000
291 V B -0.3572
292 S B -0.6125
293 V B 0.0000
294 D B -1.3712
295 G B -1.1972
296 N B -1.5199
297 S B -1.2992
298 I B 0.0000
299 S B -1.4743
300 D B -1.5593
301 G B -0.6168
302 V B 0.5873
303 P B -0.3553
304 G B -0.3786
305 P B -0.3339
306 V B -0.3435
307 T B 0.0000
308 Q B -1.5232
309 S B -1.0442
310 I B 0.0000
311 I B 0.0000
312 R B -2.2588
313 R B -2.0972
314 Y B 0.0000
315 W B 0.0000
316 E B -2.0818
317 L B -1.0741
318 N B 0.0000
319 V B -0.4322
320 E B -1.8862
321 P B -1.0798
322 S B -0.5143
323 S B -0.3505
324 L B -0.0810
325 L B -0.1315
326 T B -0.4297
327 P B -0.5764
328 V B 0.0000
329 Q B -1.2301
330 Y B 0.3126
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Automated mutations analysis - charged mutations

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
VR11A -0.8255 -0.0125 View CSV PDB
IR97B -0.2888 -0.0189 View CSV PDB
IK97B -0.3063 -0.017 View CSV PDB
VR11B -0.3323 -0.0126 View CSV PDB
VK11A -0.3507 -0.0119 View CSV PDB
VK11B -0.0855 -0.0146 View CSV PDB
IR10B 0.4261 -0.0144 View CSV PDB
IK10B 0.7169 -0.0126 View CSV PDB
FR56A 0.5944 -0.0087 View CSV PDB
FR56B 0.7206 -0.009 View CSV PDB
FK56B 0.8812 -0.0072 View CSV PDB
FD56A 1.6987 -0.0118 View CSV PDB