Aggrescan3D: ae7a1300911b495

Project name: ae7a1300911b495

Status: done

Started: 2026-04-02 12:47:31

Settings

Chain sequence(s)	A: LAFSPPFYPSPWANGQGEWAEAYQRAVAIVSQMTLDEKVNLTTGTGWELEKCVGQTGGVPRLNIGGMCLQDSPLGIRDSDYNSAFPAGVNVAATWDKNLAYLRGQAMGQEFSDKGIDVQLGPAAGPLGRSPDGGRNWEGFSPDPALTGVLFAETIKGIQDAGVVATAKHYILNEQEHFRQVAEAAGYGFNISDTISSNVDDKTIHEMYLWPFADAVRAGVGAIMCSYNQINNSYGCQNSYTLNKLLKAELGFQGFVMSDWGAHHSGVGSALAGLDMSMPGDITFDSATSFWGTNLTIAVLNGTVPQWRVDDMAVRIMAAYYKVGRDRLYQPPNFSSWTRDEYGFKYFYPQEGPYEKVNHFVNVQRNHSEVIRKLGADSTVLLKNNNALPLTGKERKVAILGEDAGSNSYGANGCSDRGCDNGTLAMAWGSGTAEFPYLVTPEQAIQAEVLKHKGSVYAITDNWALSQVETLAKQASVSLVFVNSDAGEGYISVDGNEGDRNNLTLWKNGDNLIKAAANNCNNTIVVIHSVGPVLVDEWYDHPNVTAILWAGLPGQESGNSLADVLYGRVNPGAKSPFTWGKTREAYGDYLVRELNNGNGAPQDDFSEGVFIDYRGFDKRNETPIYEFGHGLSYTTFNYSGLHIQVLNAVATETGAAPTFGQVGNASDYVYPEGLTRISKFIYPWLNSTDLKASSGDPYYGVDTAEHVPEGATDGSPQPVLPAGGGSGGNPRLYDELIRVSVTVKNTGRVAGDAVPQLYVSLGGPNEPKVVLRKFDRLTLKPSEETVWTTTLTRRDLSNWDVAAQDWVITSYPKKVHVGSSSRQLPLHAALPKVQ 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

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[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                                          (00:06:24)
[INFO]       Auto_mut: Residue number 24 from chain A and a score of 2.083 (phenylalanine)         
                       selected for automated muatation                                            (00:06:31)
[INFO]       Auto_mut: Residue number 22 from chain A and a score of 1.870 (leucine) selected for  
                       automated muatation                                                         (00:06:31)
[INFO]       Auto_mut: Residue number 675 from chain A and a score of 1.304 (valine) selected for  
                       automated muatation                                                         (00:06:31)
[INFO]       Auto_mut: Residue number 23 from chain A and a score of 1.292 (alanine) selected for  
                       automated muatation                                                         (00:06:31)
[INFO]       Auto_mut: Residue number 812 from chain A and a score of 1.232 (valine) selected for  
                       automated muatation                                                         (00:06:31)
[INFO]       Auto_mut: Residue number 478 from chain A and a score of 0.913 (tyrosine) selected    
                       for automated muatation                                                     (00:06:31)
[INFO]       Auto_mut: Mutating residue number 22 from chain A (leucine) into glutamic acid        (00:06:31)
[INFO]       Auto_mut: Mutating residue number 24 from chain A (phenylalanine) into glutamic acid  
                       Mutating residue number 24 from chain A (phenylalanine) into glutamic acid  (00:06:31)
[INFO]       Auto_mut: Mutating residue number 24 from chain A (phenylalanine) into aspartic acid  
                       Mutating residue number 24 from chain A (phenylalanine) into aspartic acid  (00:06:31)
[INFO]       Auto_mut: Mutating residue number 22 from chain A (leucine) into lysine               (00:09:49)
[INFO]       Auto_mut: Mutating residue number 24 from chain A (phenylalanine) into lysine         (00:10:03)
[INFO]       Auto_mut: Mutating residue number 24 from chain A (phenylalanine) into arginine       (00:10:04)
[INFO]       Auto_mut: Mutating residue number 22 from chain A (leucine) into aspartic acid        (00:13:29)
[INFO]       Auto_mut: Mutating residue number 675 from chain A (valine) into glutamic acid        (00:13:31)
[INFO]       Auto_mut: Mutating residue number 675 from chain A (valine) into aspartic acid        (00:13:51)
[INFO]       Auto_mut: Mutating residue number 22 from chain A (leucine) into arginine             (00:16:44)
[INFO]       Auto_mut: Mutating residue number 675 from chain A (valine) into lysine               (00:16:57)
[INFO]       Auto_mut: Mutating residue number 675 from chain A (valine) into arginine             (00:17:24)
[INFO]       Auto_mut: Mutating residue number 23 from chain A (alanine) into glutamic acid        (00:20:06)
[INFO]       Auto_mut: Mutating residue number 23 from chain A (alanine) into aspartic acid        (00:20:44)
[INFO]       Auto_mut: Mutating residue number 812 from chain A (valine) into glutamic acid        (00:20:48)
[INFO]       Auto_mut: Mutating residue number 23 from chain A (alanine) into lysine               (00:23:27)
[INFO]       Auto_mut: Mutating residue number 23 from chain A (alanine) into arginine             (00:24:01)
[INFO]       Auto_mut: Mutating residue number 812 from chain A (valine) into lysine               (00:24:11)
[INFO]       Auto_mut: Mutating residue number 812 from chain A (valine) into aspartic acid        (00:27:16)
[INFO]       Auto_mut: Mutating residue number 478 from chain A (tyrosine) into glutamic acid      (00:27:23)
[INFO]       Auto_mut: Mutating residue number 478 from chain A (tyrosine) into aspartic acid      (00:27:53)
[INFO]       Auto_mut: Mutating residue number 812 from chain A (valine) into arginine             (00:30:29)
[INFO]       Auto_mut: Mutating residue number 478 from chain A (tyrosine) into lysine             (00:30:37)
[INFO]       Auto_mut: Mutating residue number 478 from chain A (tyrosine) into arginine           (00:31:06)
[INFO]       Auto_mut: Effect of mutation residue number 24 from chain A (phenylalanine) into      
                       glutamic acid: Energy difference: 0.6581 kcal/mol, Difference in average    
                       score from the base case: -0.0149                                           (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 24 from chain A (phenylalanine) into      
                       lysine: Energy difference: 0.5746 kcal/mol, Difference in average score     
                       from the base case: -0.0148                                                 (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 24 from chain A (phenylalanine) into      
                       aspartic acid: Energy difference: 1.2307 kcal/mol, Difference in average    
                       score from the base case: -0.0146                                           (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 24 from chain A (phenylalanine) into      
                       arginine: Energy difference: 0.6512 kcal/mol, Difference in average score   
                       from the base case: -0.0147                                                 (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 22 from chain A (leucine) into glutamic   
                       acid: Energy difference: 0.5856 kcal/mol, Difference in average score from  
                       the base case: -0.0086                                                      (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 22 from chain A (leucine) into lysine:    
                       Energy difference: 0.3835 kcal/mol, Difference in average score from the    
                       base case: -0.0079                                                          (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 22 from chain A (leucine) into aspartic   
                       acid: Energy difference: 0.6410 kcal/mol, Difference in average score from  
                       the base case: -0.0089                                                      (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 22 from chain A (leucine) into arginine:  
                       Energy difference: -0.1605 kcal/mol, Difference in average score from the   
                       base case: -0.0080                                                          (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 675 from chain A (valine) into glutamic   
                       acid: Energy difference: 0.1884 kcal/mol, Difference in average score from  
                       the base case: -0.0085                                                      (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 675 from chain A (valine) into lysine:    
                       Energy difference: 0.1695 kcal/mol, Difference in average score from the    
                       base case: -0.0071                                                          (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 675 from chain A (valine) into aspartic   
                       acid: Energy difference: 0.5277 kcal/mol, Difference in average score from  
                       the base case: -0.0096                                                      (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 675 from chain A (valine) into arginine:  
                       Energy difference: 0.3084 kcal/mol, Difference in average score from the    
                       base case: -0.0106                                                          (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 23 from chain A (alanine) into glutamic   
                       acid: Energy difference: 0.8913 kcal/mol, Difference in average score from  
                       the base case: -0.0007                                                      (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 23 from chain A (alanine) into lysine:    
                       Energy difference: -0.2730 kcal/mol, Difference in average score from the   
                       base case: -0.0002                                                          (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 23 from chain A (alanine) into aspartic   
                       acid: Energy difference: 1.1924 kcal/mol, Difference in average score from  
                       the base case: 0.0003                                                       (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 23 from chain A (alanine) into arginine:  
                       Energy difference: 0.6183 kcal/mol, Difference in average score from the    
                       base case: -0.0026                                                          (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 812 from chain A (valine) into glutamic   
                       acid: Energy difference: -0.4109 kcal/mol, Difference in average score from 
                       the base case: -0.0123                                                      (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 812 from chain A (valine) into lysine:    
                       Energy difference: -0.5093 kcal/mol, Difference in average score from the   
                       base case: -0.0104                                                          (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 812 from chain A (valine) into aspartic   
                       acid: Energy difference: -0.5597 kcal/mol, Difference in average score from 
                       the base case: -0.0120                                                      (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 812 from chain A (valine) into arginine:  
                       Energy difference: -0.4235 kcal/mol, Difference in average score from the   
                       base case: -0.0106                                                          (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 478 from chain A (tyrosine) into glutamic 
                       acid: Energy difference: 0.3324 kcal/mol, Difference in average score from  
                       the base case: -0.0100                                                      (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 478 from chain A (tyrosine) into lysine:  
                       Energy difference: 0.0673 kcal/mol, Difference in average score from the    
                       base case: -0.0096                                                          (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 478 from chain A (tyrosine) into aspartic 
                       acid: Energy difference: 0.6895 kcal/mol, Difference in average score from  
                       the base case: -0.0111                                                      (00:34:27)
[INFO]       Auto_mut: Effect of mutation residue number 478 from chain A (tyrosine) into          
                       arginine: Energy difference: -0.2496 kcal/mol, Difference in average score  
                       from the base case: -0.0098                                                 (00:34:27)
[INFO]       Main:     Simulation completed successfully.                                          (00:34:44)

Note Your prediction results will be deleted after 360 days.

Drag cursor over the plot to display residue labels.

Show buried residues

Minimal score value: -3.1429
Maximal score value: 2.0835
Average score: -0.4686
Total score value: -390.7848

Download the table (csv)

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	mutation
22	L	A	1.8703
23	A	A	1.2923
24	F	A	2.0835
25	S	A	0.8664
26	P	A	0.3494
27	P	A	-0.1341
28	F	A	0.0922
29	Y	A	-0.2642
30	P	A	0.0000
31	S	A	0.0000
32	P	A	-0.2068
33	W	A	0.0000
34	A	A	0.0000
35	N	A	-1.6447
36	G	A	-1.5867
37	Q	A	-1.3542
38	G	A	-1.5123
39	E	A	-1.6797
40	W	A	0.0000
41	A	A	-2.0494
42	E	A	-2.8209
43	A	A	0.0000
44	Y	A	-1.7761
45	Q	A	-2.3429
46	R	A	-2.1200
47	A	A	0.0000
48	V	A	-0.5910
49	A	A	-0.7013
50	I	A	-0.4708
51	V	A	0.0000
52	S	A	-0.7915
53	Q	A	-1.1831
54	M	A	0.0000
55	T	A	-0.8427
56	L	A	0.0000
57	D	A	-0.4264
58	E	A	-0.7525
59	K	A	0.0000
60	V	A	0.0000
61	N	A	-0.3405
62	L	A	0.0000
63	T	A	0.0000
64	T	A	0.0000
65	G	A	0.0000
66	T	A	0.0000
67	G	A	0.0000
68	W	A	0.2528
69	E	A	0.0898
70	L	A	0.0000
71	E	A	-0.2098
72	K	A	-0.4345
73	C	A	0.0000
74	V	A	0.0000
75	G	A	0.0000
76	Q	A	0.0000
77	T	A	0.0000
78	G	A	-0.3219
79	G	A	0.0000
80	V	A	0.0000
81	P	A	-1.6468
82	R	A	-2.2812
83	L	A	-1.5197
84	N	A	-1.9100
85	I	A	0.0000
86	G	A	-1.0169
87	G	A	-0.5981
88	M	A	0.0000
89	C	A	0.0000
90	L	A	0.0000
91	Q	A	0.0000
92	D	A	0.0000
93	S	A	0.0000
94	P	A	0.0000
95	L	A	0.0000
96	G	A	0.0000
97	I	A	0.0000
98	R	A	-0.5479
99	D	A	-0.7246
100	S	A	0.0000
101	D	A	-0.4935
102	Y	A	0.0624
103	N	A	0.0000
104	S	A	0.0000
105	A	A	0.0000
106	F	A	0.0000
107	P	A	0.0000
108	A	A	0.0000
109	G	A	0.0000
110	V	A	0.0000
111	N	A	0.0000
112	V	A	0.0000
113	A	A	0.0000
114	A	A	0.0000
115	T	A	0.0000
116	W	A	0.0000
117	D	A	-0.9565
118	K	A	-1.1646
119	N	A	-1.4556
120	L	A	0.0000
121	A	A	0.0000
122	Y	A	-0.7219
123	L	A	0.1159
124	R	A	0.0000
125	G	A	0.0000
126	Q	A	-0.7973
127	A	A	0.0000
128	M	A	0.0000
129	G	A	0.0000
130	Q	A	-1.0543
131	E	A	0.0000
132	F	A	0.0000
133	S	A	-0.3788
134	D	A	-0.8524
135	K	A	0.0000
136	G	A	0.0000
137	I	A	0.0000
138	D	A	0.0000
139	V	A	0.0000
140	Q	A	0.0000
141	L	A	0.0000
142	G	A	0.0000
143	P	A	0.0000
144	A	A	0.0000
145	A	A	0.0000
146	G	A	0.0000
147	P	A	0.0000
148	L	A	0.0000
149	G	A	-0.0563
150	R	A	0.0000
151	S	A	0.0000
152	P	A	-0.0841
153	D	A	0.0000
154	G	A	0.0000
155	G	A	0.0000
156	R	A	0.0000
157	N	A	0.0000
158	W	A	0.0000
159	E	A	0.0000
160	G	A	0.0000
161	F	A	0.0000
162	S	A	0.0000
163	P	A	0.0000
164	D	A	0.0000
165	P	A	0.0000
166	A	A	0.0000
167	L	A	0.0000
168	T	A	0.0000
169	G	A	0.0000
170	V	A	0.1289
171	L	A	0.0000
172	F	A	0.0000
173	A	A	-0.5099
174	E	A	-0.8738
175	T	A	0.0000
176	I	A	0.0000
177	K	A	-1.6151
178	G	A	0.0000
179	I	A	0.0000
180	Q	A	-1.4599
181	D	A	-2.2642
182	A	A	-1.1425
183	G	A	0.0000
184	V	A	0.0000
185	V	A	0.0000
186	A	A	0.0000
187	T	A	0.0000
188	A	A	0.0000
189	K	A	0.0000
190	H	A	0.0000
191	Y	A	0.0000
192	I	A	0.0000
193	L	A	0.0000
194	N	A	0.0000
195	E	A	0.0000
196	Q	A	0.0000
197	E	A	0.0000
198	H	A	-0.3527
199	F	A	0.0000
200	R	A	0.0000
201	Q	A	-0.0556
202	V	A	-0.0226
203	A	A	-0.1228
204	E	A	-0.2239
205	A	A	0.0000
206	A	A	-0.4688
207	G	A	-0.4373
208	Y	A	-0.2488
209	G	A	-0.5883
210	F	A	-0.8600
211	N	A	-1.6537
212	I	A	0.0000
213	S	A	-1.0691
214	D	A	-0.9989
215	T	A	0.0000
216	I	A	0.0000
217	S	A	0.0000
218	S	A	0.0000
219	N	A	-0.7841
220	V	A	-1.2829
221	D	A	-1.8162
222	D	A	-1.0048
223	K	A	-0.8653
224	T	A	0.0000
225	I	A	0.0000
226	H	A	0.0000
227	E	A	-0.3418
228	M	A	0.0000
229	Y	A	0.0000
230	L	A	0.0000
231	W	A	0.0000
232	P	A	0.0000
233	F	A	0.0000
234	A	A	0.0000
235	D	A	-0.4514
236	A	A	0.0000
237	V	A	0.0000
238	R	A	-1.1079
239	A	A	-0.8330
240	G	A	0.0000
241	V	A	0.0000
242	G	A	0.0000
243	A	A	0.0000
244	I	A	0.0000
245	M	A	0.0000
246	C	A	0.0000
247	S	A	0.0000
248	Y	A	0.0000
249	N	A	0.0000
250	Q	A	0.0000
251	I	A	0.0000
252	N	A	0.1881
253	N	A	0.2640
254	S	A	-0.0479
255	Y	A	0.0000
256	G	A	0.0000
257	C	A	0.0000
258	Q	A	-0.3185
259	N	A	0.0000
260	S	A	0.0000
261	Y	A	0.1377
262	T	A	0.0000
263	L	A	0.0000
264	N	A	0.0000
265	K	A	0.0423
266	L	A	0.0000
267	L	A	0.0000
268	K	A	0.0000
269	A	A	0.0588
270	E	A	0.0000
271	L	A	0.0000
272	G	A	-0.4478
273	F	A	0.0000
274	Q	A	0.0000
275	G	A	0.0000
276	F	A	0.0000
277	V	A	0.0000
278	M	A	0.0000
279	S	A	0.0000
280	D	A	0.0000
281	W	A	0.2465
282	G	A	0.1141
283	A	A	0.0000
284	H	A	0.0000
285	H	A	-0.1887
286	S	A	0.0121
287	G	A	0.1773
288	V	A	0.2534
289	G	A	-0.1437
290	S	A	0.0000
291	A	A	0.0000
292	L	A	0.0000
293	A	A	0.0000
294	G	A	0.0000
295	L	A	0.0000
296	D	A	0.0000
297	M	A	0.0000
298	S	A	0.0000
299	M	A	0.0000
300	P	A	0.0000
301	G	A	0.0000
302	D	A	0.0000
303	I	A	0.6771
304	T	A	0.4162
305	F	A	0.5270
306	D	A	-0.1769
307	S	A	-0.0771
308	A	A	-0.1673
309	T	A	-0.0538
310	S	A	0.0000
311	F	A	0.3096
312	W	A	0.0000
313	G	A	0.0000
314	T	A	-0.1557
315	N	A	-0.3472
316	L	A	0.0000
317	T	A	0.0000
318	I	A	0.0000
319	A	A	0.0000
320	V	A	0.0000
321	L	A	-0.3894
322	N	A	-0.9369
323	G	A	-0.7471
324	T	A	-0.3232
325	V	A	0.0000
326	P	A	-0.4427
327	Q	A	-0.3765
328	W	A	0.0000
329	R	A	0.0000
330	V	A	0.0000
331	D	A	0.0000
332	D	A	0.0000
333	M	A	0.0000
334	A	A	0.0000
335	V	A	0.0000
336	R	A	0.0000
337	I	A	0.0000
338	M	A	0.0000
339	A	A	0.0000
340	A	A	0.0000
341	Y	A	0.0000
342	Y	A	-1.1028
343	K	A	-1.3312
344	V	A	-0.8509
345	G	A	0.0000
346	R	A	0.0000
347	D	A	-1.2901
348	R	A	-1.6481
349	L	A	-0.3432
350	Y	A	-0.7261
351	Q	A	-1.4179
352	P	A	-0.8986
353	P	A	0.0000
354	N	A	-0.6739
355	F	A	0.0000
356	S	A	0.0000
357	S	A	0.0000
358	W	A	-0.2058
359	T	A	-0.9389
360	R	A	-1.8645
361	D	A	-2.6902
362	E	A	-2.6680
363	Y	A	-1.2918
364	G	A	-0.7672
365	F	A	0.1533
366	K	A	-0.9618
367	Y	A	-0.2214
368	F	A	0.2528
369	Y	A	0.2836
370	P	A	-0.3916
371	Q	A	-0.6436
372	E	A	-0.6544
373	G	A	-0.8251
374	P	A	-0.5856
375	Y	A	0.1521
376	E	A	-1.6620
377	K	A	-2.0487
378	V	A	0.0000
379	N	A	0.0000
380	H	A	-1.0938
381	F	A	-0.0957
382	V	A	0.0750
383	N	A	-1.1529
384	V	A	0.0000
385	Q	A	-1.7050
386	R	A	-2.9413
387	N	A	-2.6835
388	H	A	0.0000
389	S	A	-1.9335
390	E	A	-2.7790
391	V	A	-1.3204
392	I	A	0.0000
393	R	A	-1.7620
394	K	A	-1.7882
395	L	A	0.0000
396	G	A	0.0000
397	A	A	0.0000
398	D	A	0.0000
399	S	A	0.0000
400	T	A	0.0000
401	V	A	0.0000
402	L	A	0.0000
403	L	A	0.0000
404	K	A	-0.9853
405	N	A	-1.3533
406	N	A	-2.1818
407	N	A	-2.0205
408	A	A	-1.2330
409	L	A	0.0000
410	P	A	-0.5889
411	L	A	0.0000
412	T	A	-0.7471
413	G	A	0.0000
414	K	A	-2.7194
415	E	A	-2.3221
416	R	A	-3.0601
417	K	A	-1.8548
418	V	A	0.0000
419	A	A	0.0000
420	I	A	0.0000
421	L	A	0.0000
422	G	A	0.0000
423	E	A	-0.9001
424	D	A	0.0000
425	A	A	0.0000
426	G	A	0.0000
427	S	A	-0.4213
428	N	A	-0.2713
429	S	A	0.0996
430	Y	A	0.7146
431	G	A	-0.0493
432	A	A	-0.2425
433	N	A	-0.7628
434	G	A	-0.4263
435	C	A	-0.3282
436	S	A	-0.6526
437	D	A	-0.7268
438	R	A	0.0000
439	G	A	-0.2361
440	C	A	-0.3578
441	D	A	0.0000
442	N	A	-0.3906
443	G	A	0.0000
444	T	A	0.0000
445	L	A	0.0000
446	A	A	0.0000
447	M	A	0.0000
448	A	A	0.0000
449	W	A	0.0000
450	G	A	0.0000
451	S	A	-0.1135
452	G	A	0.0000
453	T	A	0.0000
454	A	A	0.0000
455	E	A	-0.7201
456	F	A	0.0000
457	P	A	0.1279
458	Y	A	0.5853
459	L	A	0.3043
460	V	A	0.1324
461	T	A	0.0000
462	P	A	0.0000
463	E	A	-0.8770
464	Q	A	-1.2404
465	A	A	0.0000
466	I	A	0.0000
467	Q	A	-0.7802
468	A	A	-0.9335
469	E	A	-1.0235
470	V	A	0.0000
471	L	A	-0.6976
472	K	A	-1.9538
473	H	A	-2.2233
474	K	A	-2.5450
475	G	A	-2.1604
476	S	A	-0.7818
477	V	A	-0.0273
478	Y	A	0.9134
479	A	A	0.1266
480	I	A	-0.1687
481	T	A	-0.7155
482	D	A	-1.5953
483	N	A	0.0000
484	W	A	0.2805
485	A	A	-0.3125
486	L	A	-0.4699
487	S	A	-0.6911
488	Q	A	-1.4451
489	V	A	0.0000
490	E	A	-2.0357
491	T	A	-1.6588
492	L	A	0.0000
493	A	A	0.0000
494	K	A	-2.9236
495	Q	A	-2.4458
496	A	A	-1.7401
497	S	A	-1.7327
498	V	A	0.0000
499	S	A	0.0000
500	L	A	0.0000
501	V	A	0.0000
502	F	A	0.0000
503	V	A	0.0000
504	N	A	0.0000
505	S	A	0.0000
506	D	A	0.0000
507	A	A	0.0000
508	G	A	0.0000
509	E	A	0.0000
510	G	A	0.0000
511	Y	A	0.4763
512	I	A	0.0968
513	S	A	-0.4322
514	V	A	-0.8745
515	D	A	-2.0512
516	G	A	-1.4940
517	N	A	0.0000
518	E	A	-0.6918
519	G	A	0.0000
520	D	A	0.0000
521	R	A	0.0000
522	N	A	-1.9043
523	N	A	-1.5987
524	L	A	0.0000
525	T	A	-0.5318
526	L	A	0.0000
527	W	A	-0.4845
528	K	A	-0.7455
529	N	A	-0.8314
530	G	A	0.0000
531	D	A	-1.6941
532	N	A	-1.7709
533	L	A	0.0000
534	I	A	0.0000
535	K	A	-1.9289
536	A	A	0.0000
537	A	A	0.0000
538	A	A	0.0000
539	N	A	-2.2332
540	N	A	-2.2683
541	C	A	0.0000
542	N	A	-2.0556
543	N	A	-1.1744
544	T	A	0.0000
545	I	A	0.0000
546	V	A	0.0000
547	V	A	0.0000
548	I	A	0.0000
549	H	A	0.0000
550	S	A	0.0000
551	V	A	0.0000
552	G	A	0.0000
553	P	A	0.0000
554	V	A	0.0000
555	L	A	-0.8250
556	V	A	0.0000
557	D	A	-2.7572
558	E	A	-3.1429
559	W	A	0.0000
560	Y	A	-1.6397
561	D	A	-2.4317
562	H	A	-1.9866
563	P	A	-1.4101
564	N	A	-1.6875
565	V	A	0.0000
566	T	A	-1.4607
567	A	A	0.0000
568	I	A	0.0000
569	L	A	0.0000
570	W	A	0.0000
571	A	A	0.0000
572	G	A	0.0000
573	L	A	0.0000
574	P	A	0.0000
575	G	A	0.0000
576	Q	A	0.0000
577	E	A	0.0000
578	S	A	0.0000
579	G	A	0.0000
580	N	A	-0.6538
581	S	A	0.0000
582	L	A	0.0000
583	A	A	0.0000
584	D	A	0.0000
585	V	A	0.0000
586	L	A	0.0000
587	Y	A	-0.4679
588	G	A	-0.7600
589	R	A	-1.4859
590	V	A	-0.8015
591	N	A	-0.2426
592	P	A	0.0000
593	G	A	0.0000
594	A	A	0.0000
595	K	A	-0.1617
596	S	A	0.0000
597	P	A	0.0000
598	F	A	0.0000
599	T	A	0.0000
600	W	A	0.0000
601	G	A	0.0000
602	K	A	-1.6985
603	T	A	-1.2758
604	R	A	-1.2964
605	E	A	-1.9218
606	A	A	0.0000
607	Y	A	0.0000
608	G	A	-0.5036
609	D	A	0.0000
610	Y	A	0.6544
611	L	A	0.0000
612	V	A	-0.6700
613	R	A	-1.3384
614	E	A	-2.2589
615	L	A	-1.9622
616	N	A	-2.2665
617	N	A	-1.7360
618	G	A	-2.0518
619	N	A	-2.2900
620	G	A	-1.6400
621	A	A	0.0000
622	P	A	0.0000
623	Q	A	-1.0053
624	D	A	0.0000
625	D	A	-2.1241
626	F	A	0.0000
627	S	A	-1.1734
628	E	A	-0.7201
629	G	A	-1.0359
630	V	A	0.0000
631	F	A	0.0000
632	I	A	0.0000
633	D	A	0.0000
634	Y	A	0.0000
635	R	A	0.0000
636	G	A	0.0000
637	F	A	0.0000
638	D	A	0.0000
639	K	A	-3.0755
640	R	A	-2.5216
641	N	A	-2.5366
642	E	A	-1.9156
643	T	A	-1.0008
644	P	A	0.0000
645	I	A	-0.4800
646	Y	A	0.0000
647	E	A	-0.4951
648	F	A	0.0000
649	G	A	0.0000
650	H	A	-0.4160
651	G	A	-0.0417
652	L	A	0.2871
653	S	A	0.2803
654	Y	A	-0.0994
655	T	A	0.0000
656	T	A	-0.3260
657	F	A	-0.8084
658	N	A	-1.4321
659	Y	A	0.0000
660	S	A	-0.5010
661	G	A	-0.2511
662	L	A	-0.3475
663	H	A	-1.2547
664	I	A	-0.3830
665	Q	A	-0.7270
666	V	A	0.5152
667	L	A	-0.2483
668	N	A	-1.1085
669	A	A	-1.0325
675	V	A	1.3037
676	A	A	0.3213
677	T	A	-0.4776
678	E	A	-1.7799
679	T	A	-1.4466
680	G	A	-1.2182
681	A	A	-0.6849
682	A	A	-0.5508
683	P	A	-0.2830
684	T	A	-0.2831
685	F	A	-0.3100
686	G	A	-0.8947
687	Q	A	-1.2802
688	V	A	-0.7597
689	G	A	-1.4263
690	N	A	-1.8589
691	A	A	-1.4445
692	S	A	-1.7157
693	D	A	-2.1818
694	Y	A	0.0000
695	V	A	-0.9908
696	Y	A	-0.8258
697	P	A	-1.2800
698	E	A	-1.8452
699	G	A	-1.2991
700	L	A	-0.6592
701	T	A	-0.8939
702	R	A	-1.4263
703	I	A	-0.8567
704	S	A	-0.8284
705	K	A	-0.7139
706	F	A	-0.3552
707	I	A	0.0000
708	Y	A	-0.1136
709	P	A	0.0000
710	W	A	-0.2478
711	L	A	0.0000
712	N	A	-1.3726
713	S	A	-1.4267
714	T	A	-1.6911
715	D	A	-2.2280
716	L	A	-1.8199
717	K	A	-2.3388
718	A	A	-1.7291
719	S	A	-1.5880
720	S	A	-1.3516
721	G	A	-1.1422
722	D	A	-0.9937
723	P	A	-0.2582
724	Y	A	0.6478
725	Y	A	-0.2603
726	G	A	-0.5673
727	V	A	-0.2439
728	D	A	-2.0259
729	T	A	-1.3583
730	A	A	-1.7577
731	E	A	-2.8611
732	H	A	-2.1948
733	V	A	-1.3630
734	P	A	-1.4456
735	E	A	-2.2322
736	G	A	-1.1496
737	A	A	0.0000
738	T	A	-0.8247
739	D	A	-1.1956
740	G	A	-0.6939
741	S	A	-0.6238
742	P	A	-1.0434
743	Q	A	-1.0627
744	P	A	-0.9748
745	V	A	-0.2427
746	L	A	-0.2239
747	P	A	-0.0897
748	A	A	0.0000
749	G	A	0.0000
750	G	A	-0.1417
751	G	A	0.0000
752	S	A	-0.7443
753	G	A	0.0000
754	G	A	0.0000
755	N	A	-0.4966
756	P	A	-0.7126
757	R	A	-1.7291
758	L	A	0.0000
759	Y	A	-0.9011
760	D	A	-1.4591
761	E	A	-1.6068
762	L	A	0.0000
763	I	A	0.0000
764	R	A	-1.0518
765	V	A	0.0000
766	S	A	-0.2112
767	V	A	0.0000
768	T	A	-0.2627
769	V	A	0.0000
770	K	A	-2.0482
771	N	A	0.0000
772	T	A	-1.3441
773	G	A	-1.1935
774	R	A	-1.6552
775	V	A	-0.3052
776	A	A	-0.8971
777	G	A	0.0000
778	D	A	-0.4153
779	A	A	0.0000
780	V	A	0.0000
781	P	A	0.0000
782	Q	A	0.0000
783	L	A	0.0000
784	Y	A	0.0000
785	V	A	0.0000
786	S	A	-0.8480
787	L	A	0.0000
788	G	A	-0.7641
789	G	A	-0.8150
790	P	A	-1.1467
791	N	A	-2.0240
792	E	A	-1.6661
793	P	A	0.0000
794	K	A	-2.2521
795	V	A	-1.1157
796	V	A	0.0000
797	L	A	0.0000
798	R	A	0.0000
799	K	A	-0.3380
800	F	A	0.0000
801	D	A	-0.8457
802	R	A	-0.6957
803	L	A	-0.1790
804	T	A	-0.8462
805	L	A	0.0000
806	K	A	-2.6096
807	P	A	-1.9659
808	S	A	-1.9874
809	E	A	-2.8332
810	E	A	-2.6491
811	T	A	-0.4176
812	V	A	1.2319
813	W	A	0.0000
814	T	A	0.0905
815	T	A	-0.2997
816	T	A	-0.6890
817	L	A	0.0000
818	T	A	-0.9902
819	R	A	-1.0061
820	R	A	0.0000
821	D	A	0.0000
822	L	A	0.0000
823	S	A	0.0000
824	N	A	0.0000
825	W	A	0.0000
826	D	A	-0.0365
827	V	A	0.6619
828	A	A	0.4151
829	A	A	0.1135
830	Q	A	-0.0621
831	D	A	-0.2646
832	W	A	0.0136
833	V	A	0.2323
834	I	A	-0.1386
835	T	A	-0.0726
836	S	A	-0.1514
837	Y	A	0.3017
838	P	A	-0.4252
839	K	A	0.0000
840	K	A	-1.1479
841	V	A	0.0000
842	H	A	-0.7337
843	V	A	0.0000
844	G	A	0.0000
845	S	A	-0.5598
846	S	A	0.0000
847	S	A	0.0000
848	R	A	-1.3350
849	Q	A	-1.3783
850	L	A	-0.8054
851	P	A	-0.7902
852	L	A	-0.6030
853	H	A	-1.2083
854	A	A	-0.7512
855	A	A	-0.7304
856	L	A	-0.6031
857	P	A	-0.9005
858	K	A	-1.6332
859	V	A	-0.9506
860	Q	A	-1.4415

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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
VD812A	-0.5597	-0.012	View	CSV	PDB
VE812A	-0.4109	-0.0123	View	CSV	PDB
YR478A	-0.2496	-0.0098	View	CSV	PDB
LR22A	-0.1605	-0.008	View	CSV	PDB
AK23A	-0.273	-0.0002	View	CSV	PDB
YK478A	0.0673	-0.0096	View	CSV	PDB
VE675A	0.1884	-0.0085	View	CSV	PDB
VK675A	0.1695	-0.0071	View	CSV	PDB
FK24A	0.5746	-0.0148	View	CSV	PDB
FE24A	0.6581	-0.0149	View	CSV	PDB
LK22A	0.3835	-0.0079	View	CSV	PDB
AR23A	0.6183	-0.0026	View	CSV	PDB

Project name: ae7a1300911b495

Status: done

Started: 2026-04-02 12:47:31

Automated mutations analysis

Mutant

Energetic effect

Score comparison