Aggrescan3D: 36Ab

Project name: 36Ab

Status: done

Started: 2025-07-27 05:15:54

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Chain sequence(s)	A: EVQLVESGGGLVQPGGSLRLSCAASGLPVTLSQSGIYMHWVRQAPGKGLEWVGLIRHDGTTIYDPKFQDRATISADNSKNTAYLQMNSLRAEDTAVYYCARPKQGSSALENWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCDKTHTCPPCPAPELLGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSHEDPEVKFNWYVDGVEVHNAKTKPREEQYNSTYRVVSVLTVLHQDWLNGKEYKCKVSNKALPAPIEKTISKAKGQPREPQVYTLPPSRDELTKNQVSLSCAVKGFYPSDIAVEWESNGQPENNYKTTPPVLDSDGSFFLVSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSLSPGK B: DIQMTQSPSSLSASVGDRVTITCKTNSSFSSSDGTITWYQQKPGKAPKVLIYATNKRVPGVPSRFSGSGSGTDYTLTISSLQPEDFATYYCVLISKDGTITFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC E: EVQLVESGGGLVQPGGSLRLSCAASSSDTPAETGGYMHWVRQAPGKGLEWVGLIAKTIYDPKFQDRATISADNSKNTAYLQMNSLRAEDTAVYYCARGSAGSWGQGTLVTVSSRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGECDKTHTCPPCPAPELLGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSHEDPEVKFNWYVDGVEVHNAKTKPREEQYNSTYRVVSVLTVLHQDWLNGKEYKCKVSNKALPAPIEKTISKAKGQPREPQVYTLPPSRDELTKNQVSLWCLVKGFYPSDIAVEWESNGQPENNYKTTPPVLDSDGSFFLYSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSLSPGK D: DIQMTQSPSSLSASVGDRVTITCKLSGDLKTGSLNWYQQKPGKAPKVLIYGGVPGVPSRFSGSGSGTDYTLTISSLQPEDFATYYCATTSGNFGQGTKVEIKASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSC input PDB
Selected Chain(s)	A,B,D,E
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 all chain(s) selected           (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:18:56)
[INFO]       Auto_mut: Residue number 56 from chain D and a score of 1.693 (valine) selected for   
                       automated muatation                                                         (00:19:14)
[INFO]       Auto_mut: Residue number 246 from chain A and a score of 1.664 (phenylalanine)        
                       selected for automated muatation                                            (00:19:14)
[INFO]       Auto_mut: Residue number 53 from chain D and a score of 1.612 (valine) selected for   
                       automated muatation                                                         (00:19:14)
[INFO]       Auto_mut: Residue number 253 from chain E and a score of 1.487 (isoleucine) selected  
                       for automated muatation                                                     (00:19:14)
[INFO]       Auto_mut: Residue number 258 from chain A and a score of 1.442 (isoleucine) selected  
                       for automated muatation                                                     (00:19:14)
[INFO]       Auto_mut: Residue number 58 from chain E and a score of 1.366 (isoleucine) selected   
                       for automated muatation                                                     (00:19:14)
[INFO]       Auto_mut: Mutating residue number 56 from chain D (valine) into glutamic acid         (00:19:14)
[INFO]       Auto_mut: Mutating residue number 56 from chain D (valine) into aspartic acid         (00:19:14)
[INFO]       Auto_mut: Mutating residue number 246 from chain A (phenylalanine) into glutamic acid 
                       Mutating residue number 246 from chain A (phenylalanine) into glutamic acid (00:19:14)
[INFO]       Auto_mut: Mutating residue number 56 from chain D (valine) into lysine                (00:27:31)
[INFO]       Auto_mut: Mutating residue number 56 from chain D (valine) into arginine              (00:27:37)
[INFO]       Auto_mut: Mutating residue number 246 from chain A (phenylalanine) into lysine        (00:27:44)
[INFO]       Auto_mut: Mutating residue number 246 from chain A (phenylalanine) into aspartic acid 
                       Mutating residue number 246 from chain A (phenylalanine) into aspartic acid (00:36:05)
[INFO]       Auto_mut: Mutating residue number 53 from chain D (valine) into glutamic acid         (00:36:19)
[INFO]       Auto_mut: Mutating residue number 53 from chain D (valine) into aspartic acid         (00:36:42)
[INFO]       Auto_mut: Mutating residue number 246 from chain A (phenylalanine) into arginine      (00:44:27)
[INFO]       Auto_mut: Mutating residue number 53 from chain D (valine) into lysine                (00:44:41)
[INFO]       Auto_mut: Mutating residue number 53 from chain D (valine) into arginine              (00:45:06)
[INFO]       Auto_mut: Mutating residue number 253 from chain E (isoleucine) into glutamic acid    (00:53:07)
[INFO]       Auto_mut: Mutating residue number 253 from chain E (isoleucine) into aspartic acid    (00:53:22)
[INFO]       Auto_mut: Mutating residue number 258 from chain A (isoleucine) into glutamic acid    (00:54:05)
[INFO]       Auto_mut: Mutating residue number 253 from chain E (isoleucine) into lysine           (01:01:32)
[INFO]       Auto_mut: Mutating residue number 253 from chain E (isoleucine) into arginine         (01:01:44)
[INFO]       Auto_mut: Mutating residue number 258 from chain A (isoleucine) into lysine           (01:02:44)
[INFO]       Auto_mut: Mutating residue number 258 from chain A (isoleucine) into aspartic acid    (01:09:50)
[INFO]       Auto_mut: Mutating residue number 58 from chain E (isoleucine) into glutamic acid     (01:10:04)
[INFO]       Auto_mut: Mutating residue number 58 from chain E (isoleucine) into aspartic acid     (01:11:21)
[INFO]       Auto_mut: Mutating residue number 258 from chain A (isoleucine) into arginine         (01:17:53)
[INFO]       Auto_mut: Mutating residue number 58 from chain E (isoleucine) into lysine            (01:18:33)
[INFO]       Auto_mut: Mutating residue number 58 from chain E (isoleucine) into arginine          (01:19:55)
[INFO]       Auto_mut: Effect of mutation residue number 56 from chain D (valine) into glutamic    
                       acid: Energy difference: -0.1882 kcal/mol, Difference in average score from 
                       the base case: 0.0008                                                       (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 56 from chain D (valine) into lysine:     
                       Energy difference: -0.2337 kcal/mol, Difference in average score from the   
                       base case: -0.0013                                                          (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 56 from chain D (valine) into aspartic    
                       acid: Energy difference: -0.0731 kcal/mol, Difference in average score from 
                       the base case: -0.0029                                                      (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 56 from chain D (valine) into arginine:   
                       Energy difference: -0.3249 kcal/mol, Difference in average score from the   
                       base case: -0.0019                                                          (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 246 from chain A (phenylalanine) into     
                       glutamic acid: Energy difference: 0.3855 kcal/mol, Difference in average    
                       score from the base case: -0.0004                                           (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 246 from chain A (phenylalanine) into     
                       lysine: Energy difference: 0.1201 kcal/mol, Difference in average score     
                       from the base case: 0.0018                                                  (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 246 from chain A (phenylalanine) into     
                       aspartic acid: Energy difference: 0.8499 kcal/mol, Difference in average    
                       score from the base case: -0.0002                                           (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 246 from chain A (phenylalanine) into     
                       arginine: Energy difference: 0.4059 kcal/mol, Difference in average score   
                       from the base case: 0.0006                                                  (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 53 from chain D (valine) into glutamic    
                       acid: Energy difference: -0.0794 kcal/mol, Difference in average score from 
                       the base case: -0.0036                                                      (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 53 from chain D (valine) into lysine:     
                       Energy difference: -0.4551 kcal/mol, Difference in average score from the   
                       base case: -0.0036                                                          (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 53 from chain D (valine) into aspartic    
                       acid: Energy difference: -0.0632 kcal/mol, Difference in average score from 
                       the base case: -0.0042                                                      (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 53 from chain D (valine) into arginine:   
                       Energy difference: -0.3465 kcal/mol, Difference in average score from the   
                       base case: -0.0042                                                          (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 253 from chain E (isoleucine) into        
                       glutamic acid: Energy difference: 0.0559 kcal/mol, Difference in average    
                       score from the base case: -0.0051                                           (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 253 from chain E (isoleucine) into        
                       lysine: Energy difference: -0.1980 kcal/mol, Difference in average score    
                       from the base case: -0.0034                                                 (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 253 from chain E (isoleucine) into        
                       aspartic acid: Energy difference: 0.2865 kcal/mol, Difference in average    
                       score from the base case: -0.0050                                           (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 253 from chain E (isoleucine) into        
                       arginine: Energy difference: -0.4798 kcal/mol, Difference in average score  
                       from the base case: -0.0042                                                 (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 258 from chain A (isoleucine) into        
                       glutamic acid: Energy difference: 0.0904 kcal/mol, Difference in average    
                       score from the base case: -0.0056                                           (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 258 from chain A (isoleucine) into        
                       lysine: Energy difference: -0.0111 kcal/mol, Difference in average score    
                       from the base case: -0.0040                                                 (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 258 from chain A (isoleucine) into        
                       aspartic acid: Energy difference: 0.2665 kcal/mol, Difference in average    
                       score from the base case: -0.0043                                           (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 258 from chain A (isoleucine) into        
                       arginine: Energy difference: -0.2816 kcal/mol, Difference in average score  
                       from the base case: -0.0049                                                 (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 58 from chain E (isoleucine) into         
                       glutamic acid: Energy difference: 0.2236 kcal/mol, Difference in average    
                       score from the base case: -0.0017                                           (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 58 from chain E (isoleucine) into lysine: 
                       Energy difference: 0.1035 kcal/mol, Difference in average score from the    
                       base case: -0.0004                                                          (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 58 from chain E (isoleucine) into         
                       aspartic acid: Energy difference: 0.1996 kcal/mol, Difference in average    
                       score from the base case: -0.0018                                           (01:28:30)
[INFO]       Auto_mut: Effect of mutation residue number 58 from chain E (isoleucine) into         
                       arginine: Energy difference: 0.1928 kcal/mol, Difference in average score   
                       from the base case: -0.0002                                                 (01:28:30)
[INFO]       Main:     Simulation completed successfully.                                          (01:28:49)

Note Your prediction results will be deleted after 360 days.

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Show buried residues

Minimal score value: -3.9204
Maximal score value: 1.6934
Average score: -0.7479
Total score value: -988.7104

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
1	E	A	-1.8529
2	V	A	-1.2617
3	Q	A	-1.4306
4	L	A	0.0000
5	V	A	0.3610
6	E	A	0.0000
7	S	A	-0.4755
8	G	A	-0.8665
9	G	A	-0.4189
10	G	A	-0.0280
11	L	A	0.0474
12	V	A	-0.5909
13	Q	A	-1.5451
14	P	A	-1.6472
15	G	A	-1.5053
16	G	A	-1.0632
17	S	A	-1.3076
18	L	A	-1.2232
19	R	A	-2.1803
20	L	A	0.0000
21	S	A	-0.4836
22	C	A	0.0000
23	A	A	-0.2960
24	A	A	0.0000
25	S	A	-0.6416
26	G	A	-0.4871
27	L	A	0.8719
28	P	A	0.4140
29	V	A	-0.0936
30	T	A	-0.9395
31	L	A	0.0000
32	S	A	-1.8515
33	Q	A	-1.7283
34	S	A	0.0000
35	G	A	-1.7309
36	I	A	0.0000
37	Y	A	-0.8582
38	M	A	0.0000
39	H	A	0.0000
40	W	A	0.0000
41	V	A	0.0000
42	R	A	0.0000
43	Q	A	-0.7910
44	A	A	-1.2079
45	P	A	-1.1414
46	G	A	-1.4710
47	K	A	-2.3837
48	G	A	-1.6322
49	L	A	0.0000
50	E	A	-1.3471
51	W	A	0.0000
52	V	A	0.0000
53	G	A	0.0000
54	L	A	0.0000
55	I	A	0.0000
56	R	A	-1.5576
57	H	A	-2.4239
58	D	A	-2.7172
59	G	A	-1.8738
60	T	A	-1.0393
61	T	A	-0.4855
62	I	A	-0.0696
63	Y	A	-0.7388
64	D	A	-1.3029
65	P	A	-1.7559
66	K	A	-2.6037
67	F	A	0.0000
68	Q	A	-2.3900
69	D	A	-3.0100
70	R	A	-1.9708
71	A	A	0.0000
72	T	A	-0.9561
73	I	A	0.0000
74	S	A	-0.5168
75	A	A	-1.2701
76	D	A	-1.7193
77	N	A	-2.2199
78	S	A	-1.7329
79	K	A	-2.3669
80	N	A	-1.6016
81	T	A	0.0000
82	A	A	0.0000
83	Y	A	-0.6179
84	L	A	0.0000
85	Q	A	-1.4335
86	M	A	0.0000
87	N	A	-1.5475
88	S	A	-1.5506
89	L	A	0.0000
90	R	A	-2.3434
91	A	A	-1.7267
92	E	A	-2.2713
93	D	A	0.0000
94	T	A	-0.6997
95	A	A	0.0000
96	V	A	0.2293
97	Y	A	0.0000
98	Y	A	0.0000
99	C	A	0.0000
100	A	A	0.0000
101	R	A	0.0000
102	P	A	0.0000
103	K	A	-2.4393
104	Q	A	-2.2576
105	G	A	-1.6086
106	S	A	-1.2701
107	S	A	-0.9878
108	A	A	0.0000
109	L	A	0.0000
110	E	A	-0.9719
111	N	A	-1.2433
112	W	A	-0.7656
113	G	A	0.0000
114	Q	A	-1.4562
115	G	A	0.0000
116	T	A	-0.0188
117	L	A	0.1805
118	V	A	0.0000
119	T	A	0.0000
120	V	A	0.0000
121	S	A	-0.9837
122	S	A	-0.8402
123	A	A	-0.4850
124	S	A	-0.5717
125	T	A	-0.6830
126	K	A	-1.1199
127	G	A	-1.3092
128	P	A	0.0000
129	S	A	-0.3759
130	V	A	0.0000
131	F	A	0.0000
132	P	A	-1.2999
133	L	A	0.0000
134	A	A	-1.3128
135	P	A	0.0000
136	S	A	-0.9235
137	S	A	-0.7085
138	K	A	-0.9083
139	S	A	0.0000
140	T	A	-0.6540
141	S	A	-0.6765
142	G	A	-0.7864
143	G	A	-0.8628
144	T	A	-0.5727
145	A	A	0.0000
146	A	A	0.0000
147	L	A	0.0000
148	G	A	0.0000
149	C	A	0.0000
150	L	A	0.0000
151	V	A	0.0000
152	K	A	0.0000
153	D	A	-0.3466
154	Y	A	0.0000
155	F	A	0.0000
156	P	A	0.0000
157	E	A	-0.4489
158	P	A	-0.7566
159	V	A	0.0000
160	T	A	-0.6927
161	V	A	-0.4073
162	S	A	-0.3847
163	W	A	0.0000
164	N	A	-0.7102
165	S	A	-0.6256
166	G	A	-0.3986
167	A	A	-0.1786
168	L	A	0.0728
169	T	A	-0.1101
170	S	A	-0.1352
171	G	A	-0.1773
172	V	A	0.2408
173	H	A	0.0000
174	T	A	-0.1323
175	F	A	0.0000
176	P	A	-0.1868
177	A	A	0.2734
178	V	A	0.5147
179	L	A	0.8735
180	Q	A	0.0729
181	S	A	-0.2672
182	S	A	-0.1954
183	G	A	0.0111
184	L	A	0.1047
185	Y	A	0.3517
186	S	A	0.0000
187	L	A	0.0000
188	S	A	0.0000
189	S	A	0.0000
190	V	A	0.0000
191	V	A	0.0000
192	T	A	-0.0928
193	V	A	0.0000
194	P	A	-0.6083
195	S	A	-0.5625
196	S	A	-0.5790
197	S	A	-0.6086
198	L	A	-0.7756
199	G	A	-0.9656
200	T	A	-0.6856
201	Q	A	-1.1436
202	T	A	-1.0427
203	Y	A	0.0000
204	I	A	-1.1869
205	C	A	0.0000
206	N	A	-1.5347
207	V	A	0.0000
208	N	A	-1.9937
209	H	A	0.0000
210	K	A	-2.7296
211	P	A	-1.5673
212	S	A	-1.7977
213	N	A	-2.5711
214	T	A	-2.0384
215	K	A	-2.6965
216	V	A	-1.5928
217	D	A	-2.5277
218	K	A	-2.1440
219	K	A	-2.3957
220	V	A	0.0000
221	E	A	-2.8436
222	P	A	-1.9247
223	K	A	-2.5375
224	S	A	-1.6749
225	C	A	-1.5367
226	D	A	-2.7466
227	K	A	-2.8499
228	T	A	-1.7137
229	H	A	-1.8265
230	T	A	-0.8277
231	C	A	-0.4724
232	P	A	-0.3764
233	P	A	-0.2445
234	C	A	-0.3645
235	P	A	-0.7499
236	A	A	-1.0248
237	P	A	0.0000
238	E	A	-1.7410
239	L	A	0.0000
240	L	A	1.1082
241	G	A	0.2107
242	G	A	0.0000
243	P	A	0.0000
244	S	A	0.3938
245	V	A	0.0000
246	F	A	1.6641
247	L	A	1.3254
248	F	A	1.3050
249	P	A	0.0257
250	P	A	0.0000
251	K	A	-2.1841
252	P	A	-1.4081
253	K	A	-1.2895
254	D	A	0.0000
255	T	A	0.0000
256	L	A	0.0000
257	M	A	0.2784
258	I	A	1.4420
259	S	A	0.0971
260	R	A	-1.1202
261	T	A	-0.6542
262	P	A	0.0000
263	E	A	-1.1677
264	V	A	0.0000
265	T	A	0.3720
266	C	A	0.0000
267	V	A	0.0000
268	V	A	0.0000
269	V	A	-0.5416
270	D	A	-0.8897
271	V	A	0.0000
272	S	A	-1.5759
273	H	A	-2.0276
274	E	A	-1.9371
275	D	A	0.0000
276	P	A	-1.4053
277	E	A	-0.9129
278	V	A	0.0000
279	K	A	0.0000
280	F	A	0.0000
281	N	A	0.0000
282	W	A	0.0000
283	Y	A	0.0000
284	V	A	-0.6947
285	D	A	-1.8383
286	G	A	-0.5624
287	V	A	0.8979
288	E	A	0.1629
289	V	A	-0.0132
290	H	A	-0.6326
291	N	A	-0.9791
292	A	A	0.0000
293	K	A	-1.4343
294	T	A	-1.1363
295	K	A	-1.6092
296	P	A	-1.7469
297	R	A	-2.4065
298	E	A	-2.6653
299	E	A	-2.6282
300	Q	A	-1.4538
301	Y	A	-0.2783
302	N	A	-0.8425
303	S	A	-1.0856
304	T	A	-1.5181
305	Y	A	-1.9536
306	R	A	-1.6989
307	V	A	0.0000
308	V	A	0.0000
309	S	A	0.0000
310	V	A	0.0000
311	L	A	0.0000
312	T	A	-0.4579
313	V	A	0.0000
314	L	A	0.5015
315	H	A	0.0000
316	Q	A	-1.2170
317	D	A	-1.5509
318	W	A	0.0000
319	L	A	-0.9966
320	N	A	-2.1267
321	G	A	-2.1388
322	K	A	-2.2326
323	E	A	-2.2172
324	Y	A	0.0000
325	K	A	0.0000
326	C	A	0.0000
327	K	A	0.0000
328	V	A	0.0000
329	S	A	0.0000
330	N	A	0.0000
331	K	A	0.0000
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124	F	E	0.0000
125	P	E	-0.5551
126	P	E	0.0000
127	S	E	-1.6758
128	D	E	-2.8844
129	E	E	-2.5174
130	Q	E	0.0000
131	L	E	-2.1576
132	K	E	-2.7275
133	S	E	-1.7163
134	G	E	-1.2920
135	T	E	-0.9772
136	A	E	0.0000
137	S	E	0.0000
138	V	E	0.0000
139	V	E	0.0000
140	C	E	0.0000
141	L	E	0.0000
142	L	E	0.0000
143	N	E	0.0000
144	N	E	-0.6980
145	F	E	0.0000
146	Y	E	0.0000
147	P	E	0.0000
148	R	E	-1.3102
149	E	E	-1.4105
150	A	E	-1.3917
151	K	E	-2.1754
152	V	E	-0.9700
153	Q	E	-0.4346
154	W	E	0.0000
155	K	E	-0.4945
156	V	E	0.0000
157	D	E	-1.9348
158	N	E	-1.5292
159	A	E	-0.2586
160	L	E	0.7710
161	Q	E	-0.0860
162	S	E	-0.4417
163	G	E	-0.8899
164	N	E	-0.8154
165	S	E	-1.1111
166	Q	E	-1.4954
167	E	E	-2.1709
168	S	E	-1.0604
169	V	E	-0.7928
170	T	E	-1.1374
171	E	E	-2.3504
172	Q	E	-1.9627
173	D	E	-1.4194
174	S	E	-1.3834
175	K	E	-0.8734
176	D	E	-0.7883
177	S	E	-1.0030
178	T	E	0.0000
179	Y	E	0.0000
180	S	E	0.0000
181	L	E	0.0000
182	S	E	0.0000
183	S	E	0.0000
184	T	E	-0.6403
185	L	E	0.0000
186	T	E	-0.4020
187	L	E	-0.5605
188	S	E	-0.9334
189	K	E	-1.9862
190	A	E	-1.6744
191	D	E	-2.0971
192	Y	E	0.0000
193	E	E	-3.2157
194	K	E	-3.4239
195	H	E	-2.8677
196	K	E	-3.2502
197	V	E	-1.4672
198	Y	E	0.0000
199	A	E	0.0000
200	C	E	0.0000
201	E	E	-0.6246
202	V	E	0.0000
203	T	E	-1.0103
204	H	E	0.0000
205	Q	E	-1.4717
206	G	E	-0.5275
207	L	E	-0.2891
208	S	E	-0.7218
209	S	E	-0.4173
210	P	E	-0.5634
211	V	E	0.1259
212	T	E	-0.2631
213	K	E	-0.5258
214	S	E	-0.4721
215	F	E	0.0000
216	N	E	-1.8217
217	R	E	-2.4162
218	G	E	-1.9875
219	E	E	-2.6262
220	C	E	-1.7463
221	D	E	-2.3348
222	K	E	-2.5922
223	T	E	-1.4228
224	H	E	-1.6982
225	T	E	-0.5840
226	C	E	0.3137
227	P	E	0.0022
228	P	E	0.1668
229	C	E	0.4843
230	P	E	-0.3288
231	A	E	-0.3864
232	P	E	-0.7234
233	E	E	-1.3523
234	L	E	0.3564
235	L	E	0.4780
236	G	E	-0.5346
237	G	E	-0.3307
238	P	E	0.0000
239	S	E	0.0832
240	V	E	0.0000
241	F	E	1.2381
242	L	E	0.8669
243	F	E	1.1389
244	P	E	-0.2269
245	P	E	0.0000
246	K	E	-2.1597
247	P	E	-1.3611
248	K	E	-1.0195
249	D	E	-1.1556
250	T	E	0.0000
251	L	E	0.0000
252	M	E	0.3502
253	I	E	1.4871
254	S	E	0.1837
255	R	E	-0.9856
256	T	E	-0.6417
257	P	E	0.0000
258	E	E	-1.2508
259	V	E	0.0000
260	T	E	0.1878
261	C	E	0.0000
262	V	E	0.0000
263	V	E	0.0000
264	V	E	-1.0359
265	D	E	-1.6406
266	V	E	0.0000
267	S	E	-2.3492
268	H	E	-2.6954
269	E	E	-3.0476
270	D	E	-2.7741
271	P	E	-2.9218
272	E	E	-3.2262
273	V	E	-2.1514
274	K	E	-2.2474
275	F	E	-1.3750
276	N	E	-1.3286
277	W	E	0.0000
278	Y	E	-1.0215
279	V	E	-1.1496
280	D	E	-2.3221
281	G	E	-1.1200
282	V	E	0.1790
283	E	E	-1.4588
284	V	E	-0.9316
285	H	E	-2.0512
286	N	E	-2.2559
287	A	E	-1.8677
288	K	E	-2.3350
289	T	E	-1.7979
290	K	E	-2.0807
291	P	E	-2.4149
292	R	E	-3.8561
293	E	E	-3.9204
294	E	E	-3.5721
295	Q	E	-1.7444
296	Y	E	0.1631
297	N	E	-0.8021
298	S	E	-1.3375
299	T	E	-2.1282
300	Y	E	0.0000
301	R	E	-2.7778
302	V	E	0.0000
303	V	E	-0.9812
304	S	E	0.0000
305	V	E	0.0000
306	L	E	0.0000
307	T	E	-0.7574
308	V	E	0.0000
309	L	E	0.4464
310	H	E	-0.2674
311	Q	E	-1.2599
312	D	E	-1.6056
313	W	E	0.0000
314	L	E	-0.9965
315	N	E	-2.1484
316	G	E	-2.1663
317	K	E	-2.4014
318	E	E	-2.5451
319	Y	E	0.0000
320	K	E	-1.8226
321	C	E	0.0000
322	K	E	-1.5825
323	V	E	0.0000
324	S	E	-1.5184
325	N	E	0.0000
326	K	E	-2.6510
327	A	E	-1.4038
328	L	E	0.0000
329	P	E	-0.6211
330	A	E	-0.6751
331	P	E	-1.0666
332	I	E	-0.9171
333	E	E	-2.1404
334	K	E	-1.3355
335	T	E	-1.2011
336	I	E	-0.3530
337	S	E	-1.3229
338	K	E	-1.3652
339	A	E	-1.1775
340	K	E	-2.3658
341	G	E	-2.0146
342	Q	E	-2.1584
343	P	E	-1.8168
344	R	E	-2.1634
345	E	E	-2.6401
346	P	E	0.0000
347	Q	E	-1.2141
348	V	E	0.0000
349	Y	E	0.0000
350	T	E	-0.7899
351	L	E	0.0000
352	P	E	-0.3390
353	P	E	0.0000
354	S	E	0.0000
355	R	E	-2.7492
356	D	E	-2.8255
357	E	E	0.0000
358	L	E	-1.8552
359	T	E	-1.6522
360	K	E	-2.3833
361	N	E	-2.4807
362	Q	E	-2.2556
363	V	E	0.0000
364	S	E	0.0000
365	L	E	0.0000
366	W	E	0.0000
367	C	E	0.0000
368	L	E	0.0000
369	V	E	0.0000
370	K	E	-0.4456
371	G	E	-0.9860
372	F	E	0.0000
373	Y	E	-1.0625
374	P	E	0.0000
375	S	E	-0.1773
376	D	E	-1.1301
377	I	E	0.0000
378	A	E	-0.5961
379	V	E	0.0000
380	E	E	-1.0559
381	W	E	0.0000
382	E	E	-1.8007
383	S	E	0.0000
384	N	E	-1.8568
385	G	E	-1.7672
386	Q	E	-2.3042
387	P	E	-1.9382
388	E	E	-1.8036
389	N	E	-1.9922
390	N	E	-1.3180
391	Y	E	-0.8889
392	K	E	-0.7568
393	T	E	-0.2557
394	T	E	0.0000
395	P	E	-0.1177
396	P	E	0.2170
397	V	E	0.7253
398	L	E	1.1079
399	D	E	-0.2570
400	S	E	-1.0795
401	D	E	-1.8517
402	G	E	-0.7978
403	S	E	0.0000
404	F	E	0.2853
405	F	E	0.0000
406	L	E	0.0000
407	Y	E	0.0000
408	S	E	0.0000
409	K	E	0.0000
410	L	E	0.0000
411	T	E	-0.8601
412	V	E	0.0000
413	D	E	-2.3932
414	K	E	-2.5880
415	S	E	-2.1715
416	R	E	-1.9633
417	W	E	0.0000
418	Q	E	-2.1932
419	Q	E	-2.0666
420	G	E	-1.1475
421	N	E	-0.8269
422	V	E	0.2148
423	F	E	0.0000
424	S	E	0.0000
425	C	E	0.0000
426	S	E	0.0000
427	V	E	0.0000
428	M	E	0.0000
429	H	E	0.0000
430	E	E	-1.0760
431	A	E	-1.5399
432	L	E	-1.4380
433	H	E	-1.7588
434	N	E	-1.6643
435	H	E	-0.9589
436	Y	E	-0.4845
437	T	E	-0.8098
438	Q	E	-1.3205
439	K	E	-1.1614
440	S	E	-0.5286
441	L	E	0.0000
442	S	E	-0.1408
443	L	E	-0.3965
444	S	E	-0.6030
445	P	E	-1.2344
446	G	E	-1.4479
447	K	E	-2.0308

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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
IR253E	-0.4798	-0.0042	View	CSV	PDB
IR258A	-0.2816	-0.0049	View	CSV	PDB
VR53D	-0.3465	-0.0042	View	CSV	PDB
VK53D	-0.4551	-0.0036	View	CSV	PDB
IK253E	-0.198	-0.0034	View	CSV	PDB
IK258A	-0.0111	-0.004	View	CSV	PDB
VD56D	-0.0731	-0.0029	View	CSV	PDB
VR56D	-0.3249	-0.0019	View	CSV	PDB
ID58E	0.1996	-0.0018	View	CSV	PDB
IE58E	0.2236	-0.0017	View	CSV	PDB
FE246A	0.3855	-0.0004	View	CSV	PDB
FD246A	0.8499	-0.0002	View	CSV	PDB

Project name: 36Ab

Status: done

Started: 2025-07-27 05:15:54

Automated mutations analysis

Mutant

Energetic effect

Score comparison