Project name: 5ca7422162b745f

Chain sequence(s)	A: MSLLIIGMGGTIASVKGESGYESALSIEEIIEISGIREKIGSSIDTIDLMNVDSTLIQPSDWKTLAEEIERNIWDYDGIVITHGTDTMAYTASMLSFMLRNPPVPIVFTGSMLPASEKNSDAPLNLYTALKFAETGIRSIYIAFNGKVMLGVRASKVRSMNFDAFESINYPLIAKLEDDIKILHIPRIYGDEFSSDFRYNHKVLVLKLIPGLSGDVFEAALKIGYRGIVIEGYGVGGIPYRGTNLFEVISKISREIPIVLTTQALYDGVDLERYKVGRMALNAGIIPAGDMTKEATVTKLMWILGHTRKIEEVRELMGKNLAGELTRVF
Selected Chain(s)	A
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

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 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                                          (00:06:43)
[INFO]       Main:     Simulation completed successfully.                                          (00:06:46)

• Minimal score value: -3.5897
• Maximal score value: 1.7601
• Average score: -0.6323
• Total score value: -208.0163

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
1	M	A	0.4970
2	S	A	-0.5326
3	L	A	0.0000
4	L	A	0.0000
5	I	A	0.0000
6	I	A	0.0000
7	G	A	0.0000
8	M	A	0.0000
9	G	A	0.0000
10	G	A	0.0000
11	T	A	-0.3267
12	I	A	0.0000
13	A	A	0.0000
14	S	A	0.0000
15	V	A	-0.7469
16	K	A	-2.1630
17	G	A	-2.0007
18	E	A	-2.4552
19	S	A	-1.5425
20	G	A	-1.2029
21	Y	A	-0.9265
22	E	A	-2.1969
23	S	A	-1.1909
24	A	A	-0.6237
25	L	A	-0.7809
26	S	A	-1.0173
27	I	A	0.0000
28	E	A	-1.9649
29	E	A	-1.8754
30	I	A	0.0000
31	I	A	0.0000
32	E	A	-2.2610
33	I	A	-0.1386
34	S	A	0.0000
35	G	A	-1.4451
36	I	A	0.0000
37	R	A	-2.6979
38	E	A	-3.1677
39	K	A	-2.4406
40	I	A	0.0000
41	G	A	-1.1888
42	S	A	-0.7881
43	S	A	-0.4782
44	I	A	0.0000
45	D	A	-1.1592
46	T	A	-0.8180
47	I	A	-0.5109
48	D	A	-1.3216
49	L	A	-0.4023
50	M	A	-0.5158
51	N	A	-1.1891
52	V	A	-0.5212
53	D	A	-1.3442
54	S	A	0.0000
55	T	A	-0.3487
56	L	A	0.6427
57	I	A	0.0000
58	Q	A	-1.2008
59	P	A	-1.1547
60	S	A	-1.0630
61	D	A	-0.8958
62	W	A	0.0000
63	K	A	-1.6343
64	T	A	-0.9193
65	L	A	0.0000
66	A	A	0.0000
67	E	A	-1.9909
68	E	A	-1.6029
69	I	A	0.0000
70	E	A	-1.5229
71	R	A	-2.4944
72	N	A	-1.5566
73	I	A	0.0000
74	W	A	-0.2171
75	D	A	-1.6894
76	Y	A	-0.8552
77	D	A	-1.0857
78	G	A	0.0000
79	I	A	0.0000
80	V	A	0.0000
81	I	A	0.0000
82	T	A	0.0000
83	H	A	0.0000
84	G	A	0.0000
85	T	A	0.0000
86	D	A	-1.9717
87	T	A	-0.9674
88	M	A	0.0000
89	A	A	0.0000
90	Y	A	-0.1977
91	T	A	0.0000
92	A	A	0.0000
93	S	A	0.0000
94	M	A	0.0000
95	L	A	0.0000
96	S	A	0.0000
97	F	A	0.0000
98	M	A	0.0000
99	L	A	0.0000
100	R	A	-0.8622
101	N	A	-1.2666
102	P	A	0.0000
103	P	A	-0.6967
104	V	A	-0.6408
105	P	A	0.0000
106	I	A	0.0000
107	V	A	0.0000
108	F	A	0.0000
109	T	A	0.0000
110	G	A	0.0000
111	S	A	0.0000
112	M	A	0.2891
113	L	A	0.1859
114	P	A	0.0000
115	A	A	0.0000
116	S	A	-0.9248
117	E	A	-1.7742
118	K	A	-2.6062
119	N	A	-2.2232
120	S	A	-1.0620
121	D	A	0.0000
122	A	A	0.0000
123	P	A	0.1340
124	L	A	0.6040
125	N	A	0.0000
126	L	A	0.0000
127	Y	A	0.1116
128	T	A	0.0000
129	A	A	0.0000
130	L	A	0.0000
131	K	A	-0.7018
132	F	A	0.0000
133	A	A	0.0000
134	E	A	-0.4563
135	T	A	-0.5893
136	G	A	-0.7762
137	I	A	-0.2943
138	R	A	-1.6283
139	S	A	-0.7352
140	I	A	0.0000
141	Y	A	0.0000
142	I	A	0.0000
143	A	A	0.0000
144	F	A	0.0000
145	N	A	-0.4501
146	G	A	-0.6344
147	K	A	-0.9257
148	V	A	0.0000
149	M	A	0.0000
150	L	A	0.0000
151	G	A	0.0000
152	V	A	0.0000
153	R	A	0.0000
154	A	A	0.0000
155	S	A	0.0000
156	K	A	-0.8487
157	V	A	-0.0251
158	R	A	-0.8772
159	S	A	-0.4743
160	M	A	0.5383
161	N	A	-0.3783
162	F	A	0.0887
163	D	A	-0.6148
164	A	A	0.0000
165	F	A	0.0000
166	E	A	-0.4203
167	S	A	0.0000
168	I	A	0.0000
169	N	A	-0.3130
170	Y	A	0.0384
171	P	A	0.2510
172	L	A	0.4377
173	I	A	0.0000
174	A	A	0.0000
175	K	A	-1.6168
176	L	A	-2.1007
177	E	A	-3.5648
178	D	A	-3.5897
179	D	A	-3.3017
180	I	A	-1.9420
181	K	A	-1.8790
182	I	A	0.7248
183	L	A	1.2015
184	H	A	1.0600
185	I	A	1.7601
186	P	A	0.0000
187	R	A	-1.0178
188	I	A	-0.3508
189	Y	A	-0.6212
190	G	A	-1.6970
191	D	A	-2.6900
192	E	A	-2.7061
193	F	A	-1.4080
194	S	A	-1.1263
195	S	A	-0.7223
196	D	A	-1.0810
197	F	A	-1.1541
198	R	A	-1.9768
199	Y	A	-1.3064
200	N	A	-1.4125
201	H	A	-1.6177
202	K	A	-1.1335
203	V	A	0.0000
204	L	A	0.0722
205	V	A	0.2617
206	L	A	0.0000
207	K	A	-1.0796
208	L	A	0.0000
209	I	A	0.8916
210	P	A	0.2468
211	G	A	-0.4842
212	L	A	-0.1195
213	S	A	-0.7247
214	G	A	0.0000
215	D	A	-1.9077
216	V	A	-0.6848
217	F	A	0.0000
218	E	A	-1.6530
219	A	A	-0.6846
220	A	A	0.0000
221	L	A	-0.8040
222	K	A	-0.7892
223	I	A	0.9811
224	G	A	0.1446
225	Y	A	-0.4034
226	R	A	-1.4673
227	G	A	0.0000
228	I	A	0.0000
229	V	A	0.0000
230	I	A	0.0000
231	E	A	-0.7224
232	G	A	0.0000
233	Y	A	0.1744
234	G	A	-0.3174
235	V	A	-0.3385
236	G	A	0.0000
237	G	A	0.0180
238	I	A	0.0000
239	P	A	-0.5850
240	Y	A	-1.0994
241	R	A	-2.0911
242	G	A	-1.5232
243	T	A	-1.4301
244	N	A	-1.9222
245	L	A	0.0000
246	F	A	0.0000
247	E	A	-2.4158
248	V	A	0.0000
249	I	A	0.0000
250	S	A	-2.1418
251	K	A	-3.1566
252	I	A	0.0000
253	S	A	0.0000
254	R	A	-3.1844
255	E	A	-3.4776
256	I	A	0.0000
257	P	A	0.0000
258	I	A	0.0000
259	V	A	0.0000
260	L	A	0.0000
261	T	A	0.0000
262	T	A	-0.4476
263	Q	A	-0.4153
264	A	A	0.1496
265	L	A	0.7811
266	Y	A	0.2811
267	D	A	-1.4443
268	G	A	0.0000
269	V	A	0.0000
270	D	A	-0.9035
271	L	A	0.0000
272	E	A	-2.6713
273	R	A	-2.4504
274	Y	A	-1.1582
275	K	A	-1.9962
276	V	A	-0.9516
277	G	A	0.0000
278	R	A	-2.4972
279	M	A	-0.9760
280	A	A	0.0000
281	L	A	-0.9861
282	N	A	-1.2886
283	A	A	-1.4281
284	G	A	-1.2738
285	I	A	0.0000
286	I	A	0.0000
287	P	A	0.2996
288	A	A	0.0000
289	G	A	0.0000
290	D	A	0.0000
291	M	A	0.0000
292	T	A	0.0000
293	K	A	-0.7050
294	E	A	-0.5081
295	A	A	0.0000
296	T	A	0.0000
297	V	A	0.0000
298	T	A	0.0000
299	K	A	0.0000
300	L	A	0.0000
301	M	A	-0.7702
302	W	A	0.0000
303	I	A	0.0000
304	L	A	0.0000
305	G	A	-1.4418
306	H	A	-1.5050
307	T	A	-1.9283
308	R	A	-3.3838
309	K	A	-3.4929
310	I	A	-3.1314
311	E	A	-3.4735
312	E	A	-3.3938
313	V	A	0.0000
314	R	A	-2.5916
315	E	A	-3.0478
316	L	A	-1.7495
317	M	A	0.0000
318	G	A	-1.1205
319	K	A	-1.6392
320	N	A	-0.7000
321	L	A	0.0000
322	A	A	-0.3181
323	G	A	0.0000
324	E	A	0.0000
325	L	A	0.0000
326	T	A	-0.4974
327	R	A	-0.7979
328	V	A	1.1874
329	F	A	0.7412