Aggrescan3D: 6M-30-660-TSA1

Project name: 6M-30-660-TSA1

Status: done

Started: 2025-02-11 05:13:13

Settings

Chain sequence(s)	A: MAVERNSGDLQLPQEIAMLVPNKTQVVPKSGGEGKVKDIFASPALVRAGGVMIAFVEGRTKNKLFPEVIDLSSSDIVAGYIKAPETWQSLVAEVTKEYWQAHTVLESANNSNHRVGVARLPTGITRGNKVFLLVGSYEERREIDDYIWKAEAWNIKVIEGEATQSTEVQPTQPINWSEPKPLFQTDSPNNKGDLKEFLGGGGSGIVMGNGTLVFPLTAKDESNKVFSLITYSTDDGQKWEIPGGVSSVACRSPRVTEWEEGTLLMVTYCEDGRKVFESRDMGKTWTEARGTLPGVWLKSGPELPEVSLRVDALITATIEGRKVMLYTQKVRHFLEVDEPNALHLWVTDNNRTFHLGPFSVDSAENKTFANTLLYSDDALHLLQAKGDHESTAVSLARLTEELNTINSVLSTWVQLDASFSESSIPTAGLVGFLSNTTSSGDTWIDGYRSMNATVTKAAKVENGFKFTGPGSRATWPVNSRWDIKQYGFVDYNFTIVAMATIHQVPSESTPLLGASLRGNKRTKLIGLSYGAGGKWETVYDGTKTVQGGTWEPGREYQVALMLQDGNKGFVYVDGRLVGNPAMLPTPEERWTEFSHFYFGGDEGDSGSDATLTDVFLYNRPLSKGELKMIKEVED 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]                                                (00:00:01)
[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 A chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:10:45)
[INFO]       Auto_mut: Residue number 1 from chain A and a score of 1.354 omitted from automated   
                       muatation (excluded by the user).                                           (00:10:49)
[INFO]       Auto_mut: Residue number 147 from chain A and a score of 1.189 (isoleucine) selected  
                       for automated muatation                                                     (00:10:49)
[INFO]       Auto_mut: Residue number 333 from chain A and a score of 1.166 (phenylalanine)        
                       selected for automated muatation                                            (00:10:49)
[INFO]       Auto_mut: Residue number 146 from chain A and a score of 1.007 (tyrosine) selected    
                       for automated muatation                                                     (00:10:49)
[INFO]       Auto_mut: Residue number 2 from chain A and a score of 0.718 (alanine) selected for   
                       automated muatation                                                         (00:10:49)
[INFO]       Auto_mut: Residue number 360 from chain A and a score of 0.690 (valine) selected for  
                       automated muatation                                                         (00:10:49)
[INFO]       Auto_mut: Residue number 143 from chain A and a score of 0.670 (isoleucine) selected  
                       for automated muatation                                                     (00:10:49)
[INFO]       Auto_mut: Mutating residue number 147 from chain A (isoleucine) into glutamic acid    (00:10:49)
[INFO]       Auto_mut: Mutating residue number 147 from chain A (isoleucine) into aspartic acid    (00:10:49)
[INFO]       Auto_mut: Mutating residue number 333 from chain A (phenylalanine) into glutamic acid 
                       Mutating residue number 333 from chain A (phenylalanine) into glutamic acid (00:10:49)
[INFO]       Auto_mut: Mutating residue number 147 from chain A (isoleucine) into arginine         (00:15:14)
[INFO]       Auto_mut: Mutating residue number 147 from chain A (isoleucine) into lysine           (00:15:14)
[INFO]       Auto_mut: Mutating residue number 333 from chain A (phenylalanine) into lysine        (00:15:18)
[INFO]       Auto_mut: Mutating residue number 333 from chain A (phenylalanine) into aspartic acid 
                       Mutating residue number 333 from chain A (phenylalanine) into aspartic acid (00:19:41)
[INFO]       Auto_mut: Mutating residue number 146 from chain A (tyrosine) into glutamic acid      (00:20:09)
[INFO]       Auto_mut: Mutating residue number 146 from chain A (tyrosine) into aspartic acid      (00:20:14)
[INFO]       Auto_mut: Mutating residue number 333 from chain A (phenylalanine) into arginine      (00:24:06)
[INFO]       Auto_mut: Mutating residue number 146 from chain A (tyrosine) into lysine             (00:24:35)
[INFO]       Auto_mut: Mutating residue number 146 from chain A (tyrosine) into arginine           (00:24:39)
[INFO]       Auto_mut: Mutating residue number 2 from chain A (alanine) into glutamic acid         (00:28:33)
[INFO]       Auto_mut: Mutating residue number 2 from chain A (alanine) into aspartic acid         (00:29:06)
[INFO]       Auto_mut: Mutating residue number 360 from chain A (valine) into glutamic acid        (00:29:08)
[INFO]       Auto_mut: Mutating residue number 2 from chain A (alanine) into lysine                (00:32:55)
[INFO]       Auto_mut: Mutating residue number 2 from chain A (alanine) into arginine              (00:33:12)
[INFO]       Auto_mut: Mutating residue number 360 from chain A (valine) into lysine               (00:33:14)
[INFO]       Auto_mut: Mutating residue number 360 from chain A (valine) into aspartic acid        (00:37:19)
[INFO]       Auto_mut: Mutating residue number 143 from chain A (isoleucine) into glutamic acid    (00:37:29)
[INFO]       Auto_mut: Mutating residue number 143 from chain A (isoleucine) into aspartic acid    (00:37:43)
[INFO]       Auto_mut: Mutating residue number 360 from chain A (valine) into arginine             (00:41:32)
[INFO]       Auto_mut: Mutating residue number 143 from chain A (isoleucine) into lysine           (00:41:58)
[INFO]       Auto_mut: Mutating residue number 143 from chain A (isoleucine) into arginine         (00:42:11)
[INFO]       Auto_mut: Effect of mutation residue number 147 from chain A (isoleucine) into        
                       glutamic acid: Energy difference: 0.5875 kcal/mol, Difference in average    
                       score from the base case: -0.0182                                           (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 147 from chain A (isoleucine) into        
                       lysine: Energy difference: 0.2929 kcal/mol, Difference in average score     
                       from the base case: -0.0318                                                 (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 147 from chain A (isoleucine) into        
                       aspartic acid: Energy difference: 0.7809 kcal/mol, Difference in average    
                       score from the base case: -0.0178                                           (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 147 from chain A (isoleucine) into        
                       arginine: Energy difference: -0.4700 kcal/mol, Difference in average score  
                       from the base case: -0.0327                                                 (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 333 from chain A (phenylalanine) into     
                       glutamic acid: Energy difference: 0.6392 kcal/mol, Difference in average    
                       score from the base case: -0.0185                                           (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 333 from chain A (phenylalanine) into     
                       lysine: Energy difference: 0.0527 kcal/mol, Difference in average score     
                       from the base case: -0.0177                                                 (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 333 from chain A (phenylalanine) into     
                       aspartic acid: Energy difference: 0.8382 kcal/mol, Difference in average    
                       score from the base case: -0.0142                                           (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 333 from chain A (phenylalanine) into     
                       arginine: Energy difference: 0.1106 kcal/mol, Difference in average score   
                       from the base case: -0.0229                                                 (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 146 from chain A (tyrosine) into glutamic 
                       acid: Energy difference: -0.2680 kcal/mol, Difference in average score from 
                       the base case: -0.0192                                                      (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 146 from chain A (tyrosine) into lysine:  
                       Energy difference: -0.5495 kcal/mol, Difference in average score from the   
                       base case: -0.0206                                                          (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 146 from chain A (tyrosine) into aspartic 
                       acid: Energy difference: -0.3977 kcal/mol, Difference in average score from 
                       the base case: -0.0181                                                      (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 146 from chain A (tyrosine) into          
                       arginine: Energy difference: -0.5288 kcal/mol, Difference in average score  
                       from the base case: -0.0213                                                 (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 2 from chain A (alanine) into glutamic    
                       acid: Energy difference: 0.0932 kcal/mol, Difference in average score from  
                       the base case: -0.0069                                                      (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 2 from chain A (alanine) into lysine:     
                       Energy difference: -0.3965 kcal/mol, Difference in average score from the   
                       base case: -0.0062                                                          (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 2 from chain A (alanine) into aspartic    
                       acid: Energy difference: -0.4944 kcal/mol, Difference in average score from 
                       the base case: -0.0102                                                      (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 2 from chain A (alanine) into arginine:   
                       Energy difference: -0.1833 kcal/mol, Difference in average score from the   
                       base case: -0.0058                                                          (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 360 from chain A (valine) into glutamic   
                       acid: Energy difference: 1.3643 kcal/mol, Difference in average score from  
                       the base case: -0.0157                                                      (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 360 from chain A (valine) into lysine:    
                       Energy difference: -0.1000 kcal/mol, Difference in average score from the   
                       base case: -0.0124                                                          (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 360 from chain A (valine) into aspartic   
                       acid: Energy difference: 1.7417 kcal/mol, Difference in average score from  
                       the base case: -0.0161                                                      (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 360 from chain A (valine) into arginine:  
                       Energy difference: 0.0937 kcal/mol, Difference in average score from the    
                       base case: -0.0142                                                          (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 143 from chain A (isoleucine) into        
                       glutamic acid: Energy difference: -0.7900 kcal/mol, Difference in average   
                       score from the base case: -0.0176                                           (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 143 from chain A (isoleucine) into        
                       lysine: Energy difference: -0.6831 kcal/mol, Difference in average score    
                       from the base case: -0.0189                                                 (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 143 from chain A (isoleucine) into        
                       aspartic acid: Energy difference: -0.5667 kcal/mol, Difference in average   
                       score from the base case: -0.0190                                           (00:46:42)
[INFO]       Auto_mut: Effect of mutation residue number 143 from chain A (isoleucine) into        
                       arginine: Energy difference: -0.7796 kcal/mol, Difference in average score  
                       from the base case: -0.0195                                                 (00:46:42)
[INFO]       Main:     Simulation completed successfully.                                          (00:46:57)

Note Your prediction results will be deleted after 360 days.

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Show buried residues

Minimal score value: -3.6276
Maximal score value: 1.3544
Average score: -0.8133
Total score value: -515.632

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	M	A	1.3544
2	A	A	0.7178
3	V	A	0.5882
4	E	A	-2.1853
5	R	A	-3.3625
6	N	A	-3.1361
7	S	A	-2.2882
8	G	A	-2.3438
9	D	A	-2.8105
10	L	A	-1.8445
11	Q	A	-1.6204
12	L	A	-0.4351
13	P	A	-1.2754
14	Q	A	-2.0234
15	E	A	-2.1316
16	I	A	-0.8787
17	A	A	-0.1298
18	M	A	0.0000
19	L	A	0.0000
20	V	A	-0.2571
21	P	A	-1.0806
22	N	A	-2.0399
23	K	A	-2.3259
24	T	A	0.0000
25	Q	A	-1.8244
26	V	A	0.0000
27	V	A	-1.3834
28	P	A	-1.7543
29	K	A	-1.5016
30	S	A	-1.1097
31	G	A	-1.4076
32	G	A	-1.9746
33	E	A	-2.6061
34	G	A	-2.1290
35	K	A	-2.4378
36	V	A	-1.1690
37	K	A	0.0000
38	D	A	-1.3183
39	I	A	-0.8632
40	F	A	0.0000
41	A	A	0.0379
42	S	A	0.0373
43	P	A	0.0000
44	A	A	0.0000
45	L	A	0.0000
46	V	A	0.0000
47	R	A	-0.8999
48	A	A	0.0000
49	G	A	-1.4162
50	G	A	-1.2418
51	V	A	0.0000
52	M	A	0.0000
53	I	A	0.0000
54	A	A	0.0000
55	F	A	0.0000
56	V	A	0.0000
57	E	A	0.0000
58	G	A	0.0000
59	R	A	-0.6948
60	T	A	-0.9862
61	K	A	-1.8534
62	N	A	-1.6964
63	K	A	-1.7303
64	L	A	-0.5716
65	F	A	-0.4998
66	P	A	-1.0292
67	E	A	-1.3553
68	V	A	0.1965
69	I	A	0.1081
70	D	A	-1.5363
71	L	A	0.0000
72	S	A	0.0000
73	S	A	0.0000
74	S	A	0.0000
75	D	A	-0.8443
76	I	A	0.0000
77	V	A	0.0000
78	A	A	0.0000
79	G	A	0.0000
80	Y	A	0.0000
81	I	A	0.0000
82	K	A	-1.0755
83	A	A	-0.9205
84	P	A	0.0000
85	E	A	-2.3063
86	T	A	-1.2515
87	W	A	-1.1524
88	Q	A	-1.3525
89	S	A	-1.0938
90	L	A	0.0000
91	V	A	-0.4754
92	A	A	-0.5311
93	E	A	-0.8067
94	V	A	0.0000
95	T	A	-0.8303
96	K	A	-1.6031
97	E	A	-1.8910
98	Y	A	-0.4626
99	W	A	-0.6931
100	Q	A	-0.9966
101	A	A	0.0000
102	H	A	0.0000
103	T	A	0.0000
104	V	A	0.0000
105	L	A	0.0000
106	E	A	-1.8063
107	S	A	-1.3277
108	A	A	-1.3719
109	N	A	-2.4152
110	N	A	-2.6160
111	S	A	-2.1825
112	N	A	-2.1622
113	H	A	-1.4515
114	R	A	-2.5422
115	V	A	0.0000
116	G	A	0.0000
117	V	A	0.0000
118	A	A	0.0000
119	R	A	-0.4585
120	L	A	-0.0560
121	P	A	0.0000
122	T	A	0.0000
123	G	A	0.0000
124	I	A	0.0000
125	T	A	-1.0533
126	R	A	-1.8225
127	G	A	-1.6948
128	N	A	-1.9850
129	K	A	-2.4126
130	V	A	0.0000
131	F	A	0.0000
132	L	A	0.0000
133	L	A	0.0000
134	V	A	0.0000
135	G	A	0.0000
136	S	A	-0.4036
137	Y	A	-0.4788
138	E	A	-1.2670
139	E	A	-1.2872
140	R	A	-1.4625
141	R	A	0.0000
142	E	A	-0.8541
143	I	A	0.6701
144	D	A	-1.3896
145	D	A	-1.3025
146	Y	A	1.0066
147	I	A	1.1893
148	W	A	0.0410
149	K	A	-1.2236
150	A	A	-0.8688
151	E	A	-0.9400
152	A	A	-0.3680
153	W	A	-0.4535
154	N	A	-0.7821
155	I	A	0.0000
156	K	A	-1.0282
157	V	A	0.0000
158	I	A	0.0000
159	E	A	-2.0269
160	G	A	0.0000
161	E	A	-2.5194
162	A	A	0.0000
163	T	A	-1.5599
164	Q	A	-1.7782
165	S	A	-1.2113
166	T	A	-0.9972
167	E	A	-1.6113
168	V	A	0.2909
169	Q	A	-1.1796
170	P	A	-1.1589
171	T	A	-0.7191
172	Q	A	-1.2376
173	P	A	0.0000
174	I	A	0.0000
175	N	A	-1.9482
176	W	A	-1.5885
177	S	A	-1.7331
178	E	A	-2.2249
179	P	A	-1.5588
180	K	A	-1.7573
181	P	A	-1.1869
182	L	A	0.0000
183	F	A	-1.3810
184	Q	A	-2.0691
185	T	A	-1.6738
186	D	A	-2.6726
187	S	A	-2.4810
188	P	A	-2.5767
189	N	A	-3.4383
190	N	A	-3.4820
191	K	A	-3.4008
192	G	A	-3.1813
193	D	A	-3.6113
194	L	A	-2.8575
195	K	A	-2.6590
196	E	A	-1.2461
197	F	A	0.0000
198	L	A	-0.2081
199	G	A	0.0000
200	G	A	0.0000
201	G	A	0.0000
202	G	A	0.0000
203	S	A	0.1698
204	G	A	0.0000
205	I	A	0.4421
206	V	A	0.3379
207	M	A	0.0000
208	G	A	-1.5640
209	N	A	-1.7237
210	G	A	-1.0151
211	T	A	0.0000
212	L	A	0.0000
213	V	A	0.0000
214	F	A	0.0000
215	P	A	0.0000
216	L	A	0.0000
217	T	A	-0.3959
218	A	A	0.0000
219	K	A	-1.9753
220	D	A	-2.7954
221	E	A	-3.4728
222	S	A	-2.3273
223	N	A	-2.7154
224	K	A	-1.8270
225	V	A	-0.9040
226	F	A	-0.0369
227	S	A	0.0000
228	L	A	0.0000
229	I	A	0.0000
230	T	A	0.0000
231	Y	A	-0.4739
232	S	A	0.0000
233	T	A	-1.3562
234	D	A	-1.6111
235	D	A	-2.1467
236	G	A	0.0000
237	Q	A	-2.5709
238	K	A	-2.8780
239	W	A	-1.8172
240	E	A	-1.5358
241	I	A	-0.8381
242	P	A	0.0000
243	G	A	-1.5512
244	G	A	0.0000
245	V	A	0.5630
246	S	A	0.0000
247	S	A	-0.0090
248	V	A	0.6529
249	A	A	-0.7966
250	C	A	0.0000
251	R	A	-1.7241
252	S	A	-0.7782
253	P	A	0.0000
254	R	A	0.0000
255	V	A	0.0000
256	T	A	0.0000
257	E	A	-0.9291
258	W	A	-1.5312
259	E	A	-3.0986
260	E	A	-3.3224
261	G	A	-2.4556
262	T	A	0.0000
263	L	A	0.0000
264	L	A	0.0000
265	M	A	0.0000
266	V	A	0.0000
267	T	A	0.0000
268	Y	A	0.0000
269	C	A	0.0000
270	E	A	-2.8586
271	D	A	-2.9358
272	G	A	0.0000
273	R	A	0.0000
274	K	A	-1.7087
275	V	A	0.0000
276	F	A	0.0000
277	E	A	-1.3141
278	S	A	0.0000
279	R	A	-2.7910
280	D	A	-1.8065
281	M	A	-1.0734
282	G	A	0.0000
283	K	A	-2.0665
284	T	A	-1.2244
285	W	A	-1.0196
286	T	A	-1.4477
287	E	A	-2.5479
288	A	A	0.0000
289	R	A	-2.5368
290	G	A	-1.4585
291	T	A	-1.1242
292	L	A	0.0000
293	P	A	0.0000
294	G	A	0.0000
295	V	A	0.0000
296	W	A	-0.6880
297	L	A	0.0000
298	K	A	-2.3668
299	S	A	0.0000
300	G	A	-1.5147
301	P	A	-1.4700
302	E	A	-1.3623
303	L	A	0.4812
304	P	A	-0.4297
305	E	A	0.0958
306	V	A	0.5431
307	S	A	0.2788
308	L	A	0.0000
309	R	A	-0.3130
310	V	A	0.0000
311	D	A	0.0000
312	A	A	0.0000
313	L	A	0.0000
314	I	A	0.2961
315	T	A	-0.0912
316	A	A	-0.7302
317	T	A	-1.4092
318	I	A	0.0000
319	E	A	-2.5144
320	G	A	-1.7053
321	R	A	-1.6534
322	K	A	-1.8661
323	V	A	0.0000
324	M	A	0.0000
325	L	A	0.0000
326	Y	A	0.0000
327	T	A	0.0000
328	Q	A	0.0000
329	K	A	0.0000
330	V	A	0.0000
331	R	A	-0.2066
332	H	A	-0.1930
333	F	A	1.1661
334	L	A	0.6412
335	E	A	-0.5288
336	V	A	0.5235
337	D	A	-1.2526
338	E	A	-0.7322
339	P	A	-0.4594
340	N	A	0.0000
341	A	A	0.0000
342	L	A	0.0000
343	H	A	0.0000
344	L	A	0.0000
345	W	A	0.0000
346	V	A	0.0000
347	T	A	0.0000
348	D	A	-0.7370
349	N	A	-0.7231
350	N	A	-0.8229
351	R	A	0.0000
352	T	A	0.0000
353	F	A	-0.1015
354	H	A	-0.2634
355	L	A	0.0000
356	G	A	-0.2830
357	P	A	-0.0824
358	F	A	0.0000
359	S	A	0.4030
360	V	A	0.6904
361	D	A	-0.4879
362	S	A	-1.1325
363	A	A	-1.4401
364	E	A	-2.7718
365	N	A	-2.2668
366	K	A	-1.4966
367	T	A	0.0000
368	F	A	0.0488
369	A	A	0.1162
370	N	A	0.0000
371	T	A	0.0000
372	L	A	0.0000
373	L	A	0.0595
374	Y	A	-0.5131
375	S	A	-1.3979
376	D	A	-2.8807
377	D	A	-2.8258
378	A	A	-1.7544
379	L	A	0.0000
380	H	A	0.0000
381	L	A	0.0000
382	L	A	0.0000
383	Q	A	0.0000
384	A	A	0.0000
385	K	A	-0.9528
386	G	A	0.0000
387	D	A	-2.7009
388	H	A	-2.6048
389	E	A	-2.7388
390	S	A	-1.9776
391	T	A	0.0000
392	A	A	-0.3380
393	V	A	0.0000
394	S	A	-0.3502
395	L	A	0.0000
396	A	A	0.0000
397	R	A	-1.0355
398	L	A	0.0000
399	T	A	-1.6584
400	E	A	-2.4661
401	E	A	0.0000
402	L	A	0.0000
403	N	A	-2.0817
404	T	A	-1.2891
405	I	A	0.0000
406	N	A	-1.4819
407	S	A	-0.9175
408	V	A	0.0000
409	L	A	0.0000
410	S	A	-0.6329
411	T	A	-0.2908
412	W	A	0.0000
413	V	A	0.2191
414	Q	A	-0.6470
415	L	A	-0.3740
416	D	A	-0.4671
417	A	A	-0.7517
418	S	A	-0.9607
419	F	A	0.0000
420	S	A	-1.3952
421	E	A	-2.0745
422	S	A	-1.4255
423	S	A	-1.1262
424	I	A	0.0000
425	P	A	-0.3916
426	T	A	-0.1381
427	A	A	-0.2052
428	G	A	-0.4105
429	L	A	0.0000
430	V	A	0.0000
431	G	A	0.0000
432	F	A	0.0000
433	L	A	0.0000
434	S	A	0.0000
435	N	A	-2.1139
436	T	A	-1.6963
437	T	A	-1.2063
438	S	A	-0.9349
439	S	A	-1.0291
440	G	A	-1.7677
441	D	A	-2.0714
442	T	A	-1.2067
443	W	A	0.0000
444	I	A	-0.7221
445	D	A	0.0000
446	G	A	-0.5427
447	Y	A	0.0000
448	R	A	-0.8595
449	S	A	0.0000
450	M	A	-0.2647
451	N	A	-0.5728
452	A	A	0.0000
453	T	A	-0.5999
454	V	A	0.0000
455	T	A	-1.4440
456	K	A	-2.3812
457	A	A	-1.7439
458	A	A	-1.4636
459	K	A	-2.7793
460	V	A	-1.9132
461	E	A	-2.7753
462	N	A	-2.3959
463	G	A	0.0000
464	F	A	0.0000
465	K	A	-1.3797
466	F	A	0.0000
467	T	A	-0.9797
468	G	A	-1.4797
469	P	A	-2.0263
470	G	A	-2.0293
471	S	A	0.0000
472	R	A	-1.6704
473	A	A	0.0000
474	T	A	-0.2995
475	W	A	0.0000
476	P	A	-0.4519
477	V	A	0.0000
478	N	A	0.0000
479	S	A	-1.1669
480	R	A	-0.9141
481	W	A	-0.2028
482	D	A	0.0000
483	I	A	0.0000
484	K	A	-0.6364
485	Q	A	0.0000
486	Y	A	0.0000
487	G	A	-0.5171
488	F	A	0.0000
489	V	A	0.0000
490	D	A	0.0000
491	Y	A	-1.1083
492	N	A	-1.1202
493	F	A	0.0000
494	T	A	0.0000
495	I	A	0.0000
496	V	A	0.0000
497	A	A	0.0000
498	M	A	-0.5498
499	A	A	0.0000
500	T	A	-1.9731
501	I	A	0.0000
502	H	A	-1.7572
503	Q	A	-0.9064
504	V	A	0.1944
505	P	A	0.0000
506	S	A	-1.2407
507	E	A	-2.2725
508	S	A	-1.5415
509	T	A	0.0000
510	P	A	0.0000
511	L	A	0.0000
512	L	A	0.0000
513	G	A	0.0000
514	A	A	0.0000
515	S	A	0.0000
516	L	A	0.0000
517	R	A	-2.5549
518	G	A	-2.6026
519	N	A	-2.9596
520	K	A	-3.5509
521	R	A	-3.5883
522	T	A	-2.6307
523	K	A	-1.8630
524	L	A	0.0000
525	I	A	0.0000
526	G	A	0.0000
527	L	A	0.0000
528	S	A	0.0000
529	Y	A	0.0000
530	G	A	0.0000
531	A	A	-0.6805
532	G	A	-0.7669
533	G	A	-1.1009
534	K	A	-1.6534
535	W	A	0.0000
536	E	A	0.0000
537	T	A	0.0000
538	V	A	0.0000
539	Y	A	0.0000
540	D	A	-1.6068
541	G	A	-2.0144
542	T	A	-1.3555
543	K	A	-1.2497
544	T	A	-0.3108
545	V	A	0.0877
546	Q	A	-0.7432
547	G	A	-0.8755
548	G	A	-1.1128
549	T	A	-1.3454
550	W	A	0.0000
551	E	A	-2.9672
552	P	A	-2.2428
553	G	A	-2.6918
554	R	A	-3.6276
555	E	A	-3.2647
556	Y	A	0.0000
557	Q	A	0.0000
558	V	A	0.0000
559	A	A	0.0000
560	L	A	0.0000
561	M	A	0.0000
562	L	A	0.0000
563	Q	A	-1.5515
564	D	A	-2.2924
565	G	A	0.0000
566	N	A	-1.2463
567	K	A	-1.0585
568	G	A	0.0000
569	F	A	-0.0488
570	V	A	0.0000
571	Y	A	0.0000
572	V	A	0.0000
573	D	A	-1.4630
574	G	A	0.0000
575	R	A	-2.0693
576	L	A	-0.9271
577	V	A	0.0000
578	G	A	-0.9991
579	N	A	-1.2261
580	P	A	-0.4796
581	A	A	-0.1797
582	M	A	0.3946
583	L	A	0.0000
584	P	A	-0.9929
585	T	A	-1.6064
586	P	A	-1.4827
587	E	A	-2.5137
588	E	A	-2.5153
589	R	A	-1.2840
590	W	A	-0.4680
591	T	A	-1.0201
592	E	A	-1.4505
593	F	A	0.0000
594	S	A	0.0000
595	H	A	-0.6738
596	F	A	0.0000
597	Y	A	0.0000
598	F	A	0.0000
599	G	A	0.0000
600	G	A	-1.6803
601	D	A	-2.8672
602	E	A	-2.8731
603	G	A	-2.3978
604	D	A	-2.2176
605	S	A	-1.2330
606	G	A	-0.9264
607	S	A	0.0000
608	D	A	0.0000
609	A	A	0.0000
610	T	A	-0.7120
611	L	A	0.0000
612	T	A	-0.9107
613	D	A	-0.9875
614	V	A	0.0000
615	F	A	0.0000
616	L	A	0.0000
617	Y	A	0.0000
618	N	A	-0.6512
619	R	A	-0.8948
620	P	A	-0.8930
621	L	A	0.0000
622	S	A	-1.3451
623	K	A	-2.3803
624	G	A	-1.6358
625	E	A	-1.4122
626	L	A	0.0000
627	K	A	-2.3629
628	M	A	-1.3645
629	I	A	0.0000
630	K	A	-2.6753
631	E	A	-3.0377
632	V	A	-1.8422
633	E	A	-3.0886
634	D	A	-2.9779

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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
IR147A	-0.47	-0.0327	View	CSV	PDB
IR143A	-0.7796	-0.0195	View	CSV	PDB
IE143A	-0.79	-0.0176	View	CSV	PDB
YR146A	-0.5288	-0.0213	View	CSV	PDB
YK146A	-0.5495	-0.0206	View	CSV	PDB
AD2A	-0.4944	-0.0102	View	CSV	PDB
VK360A	-0.1	-0.0124	View	CSV	PDB
AK2A	-0.3965	-0.0062	View	CSV	PDB
FK333A	0.0527	-0.0177	View	CSV	PDB
FR333A	0.1106	-0.0229	View	CSV	PDB
VR360A	0.0937	-0.0142	View	CSV	PDB
IK147A	0.2929	-0.0318	View	CSV	PDB

Project name: 6M-30-660-TSA1

Status: done

Started: 2025-02-11 05:13:13

Automated mutations analysis

Mutant

Energetic effect

Score comparison