Project name: b7a5b643a1be848

Chain sequence(s)	A: IRTFLFQPSVIPSGSMIPTLLVGDYTTTNKYSYGYSKYSFPFSYNLFNGRIFNNQPRRGDVVVFRYPKDPSIDYVKRVIGLPGDRISLEKGIIYINGAPVVRHMEGYFSYHYKEDWSSNVPIFQEKLSNGVLYNVLSQDFLAPSSNISEFLVPKGHYFMMGDNRDKSKDSRWVEVGFVPEENLVGRASYTQYSIGGDTPFSKVWLWIPNMRWDRLFKIL
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]                                                (00:00:00)
[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                                          (00:03:53)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:55)

• Minimal score value: -2.9791
• Maximal score value: 2.9688
• Average score: -0.1343
• Total score value: -29.4028

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	I	A	1.4398
2	R	A	-0.5701
3	T	A	0.0312
4	F	A	1.0341
5	L	A	0.9318
6	F	A	0.2651
7	Q	A	-0.7109
8	P	A	-0.1717
9	S	A	0.2754
10	V	A	1.4597
11	I	A	0.0000
12	P	A	-0.0404
13	S	A	-0.4852
14	G	A	0.0000
15	S	A	-0.7447
16	M	A	0.0000
17	I	A	0.0000
18	P	A	-0.0240
19	T	A	0.1075
20	L	A	0.0000
21	L	A	0.0000
22	V	A	0.0000
23	G	A	0.1691
24	D	A	0.0000
25	Y	A	0.9461
26	T	A	0.0000
27	T	A	0.0000
28	T	A	0.0000
29	N	A	0.2101
30	K	A	0.0000
31	Y	A	1.4601
32	S	A	0.1679
33	Y	A	0.0000
34	G	A	0.0000
35	Y	A	0.0000
36	S	A	0.0000
37	K	A	0.0101
38	Y	A	0.0951
39	S	A	0.0000
40	F	A	1.0997
41	P	A	1.1622
42	F	A	2.0756
43	S	A	1.2789
44	Y	A	1.7438
45	N	A	0.1665
46	L	A	1.3001
47	F	A	0.5583
48	N	A	-1.0756
49	G	A	-0.9857
50	R	A	-0.2295
51	I	A	1.1991
52	F	A	1.7864
53	N	A	-0.4092
54	N	A	-1.3492
55	Q	A	-2.1012
56	P	A	0.0000
57	R	A	-2.4850
58	R	A	-1.4765
59	G	A	0.0000
60	D	A	-0.9842
61	V	A	0.0000
62	V	A	0.0000
63	V	A	0.0000
64	F	A	0.0000
65	R	A	-1.0760
66	Y	A	0.0000
67	P	A	-1.3660
68	K	A	-2.2020
69	D	A	-1.7915
70	P	A	-1.0488
71	S	A	-0.3882
72	I	A	-0.2809
73	D	A	-1.3450
74	Y	A	-0.5207
75	V	A	-0.2035
76	K	A	0.0000
77	R	A	0.0000
78	V	A	0.0000
79	I	A	0.0000
80	G	A	0.0000
81	L	A	-0.7003
82	P	A	-0.9652
83	G	A	-1.0351
84	D	A	0.0000
85	R	A	-1.9871
86	I	A	0.0000
87	S	A	-1.4775
88	L	A	0.0000
89	E	A	-2.2215
90	K	A	-1.6115
91	G	A	0.0000
92	I	A	-0.1865
93	I	A	0.0000
94	Y	A	-0.6384
95	I	A	0.0000
96	N	A	-2.0929
97	G	A	-1.5335
98	A	A	-0.5016
99	P	A	-0.1357
100	V	A	0.0000
101	V	A	1.0292
102	R	A	-0.3268
103	H	A	-1.1684
104	M	A	-0.5116
105	E	A	-1.5387
106	G	A	-0.2971
107	Y	A	0.7720
108	F	A	0.3266
109	S	A	-0.1123
110	Y	A	-0.2051
111	H	A	-1.3551
112	Y	A	0.0000
113	K	A	-2.9791
114	E	A	-2.8443
115	D	A	-1.4697
116	W	A	-0.1936
117	S	A	-0.0138
118	S	A	-0.4229
119	N	A	-0.8586
120	V	A	-0.4521
121	P	A	0.0000
122	I	A	-0.2490
123	F	A	0.0000
124	Q	A	-1.0429
125	E	A	0.0000
126	K	A	-1.0257
127	L	A	0.0000
128	S	A	-0.8479
129	N	A	-1.7615
130	G	A	-0.9154
131	V	A	-0.2919
132	L	A	0.2421
133	Y	A	0.0000
134	N	A	-0.7731
135	V	A	0.0000
136	L	A	0.0000
137	S	A	0.0000
138	Q	A	-1.6782
139	D	A	-1.5205
140	F	A	-0.6162
141	L	A	0.5498
142	A	A	-0.1827
143	P	A	-0.3821
144	S	A	-0.6728
145	S	A	0.0000
146	N	A	-1.2784
147	I	A	-1.0969
148	S	A	-1.4757
149	E	A	-2.2012
150	F	A	-0.5270
151	L	A	0.1368
152	V	A	0.0000
153	P	A	-0.7572
154	K	A	-1.8330
155	G	A	-1.3969
156	H	A	-0.9490
157	Y	A	0.0000
158	F	A	0.0000
159	M	A	0.0000
160	M	A	0.0000
161	G	A	0.0000
162	D	A	0.0000
163	N	A	0.0000
164	R	A	0.0000
165	D	A	-2.1770
166	K	A	-1.6388
167	S	A	0.0000
168	K	A	-1.1510
169	D	A	0.0000
170	S	A	0.0000
171	R	A	0.3607
172	W	A	1.1966
173	V	A	1.8069
174	E	A	-0.0549
175	V	A	0.0000
176	G	A	0.5057
177	F	A	0.7410
178	V	A	0.0000
179	P	A	-0.7401
180	E	A	-1.3244
181	E	A	-1.3338
182	N	A	0.0000
183	L	A	0.0000
184	V	A	0.0000
185	G	A	0.0000
186	R	A	-0.4155
187	A	A	0.0000
188	S	A	0.6636
189	Y	A	1.5597
190	T	A	0.0000
191	Q	A	0.9146
192	Y	A	0.8239
193	S	A	0.0000
194	I	A	0.0000
195	G	A	0.0000
196	G	A	-1.4485
197	D	A	-1.8316
198	T	A	0.0185
199	P	A	0.5440
200	F	A	2.0728
201	S	A	1.1289
202	K	A	1.2204
203	V	A	2.9688
204	W	A	2.6563
205	L	A	2.0753
206	W	A	2.2106
207	I	A	2.6965
208	P	A	0.8640
209	N	A	0.3194
210	M	A	0.6814
211	R	A	0.0026
212	W	A	0.6961
213	D	A	-1.0973
214	R	A	0.0515
215	L	A	1.1505
216	F	A	2.2248
217	K	A	1.1536
218	I	A	2.4520
219	L	A	1.3961