Project name: ba54083335a7000

Chain sequence(s)	A: IRTFLFQPSVIPSGSMIPTLLVGDYTTTNKYSYGYSKYSFPFSYNLFNGRIFNNQPRRGDVVVFRYPKDPSIDYVKRVIGLPGDRISLEKGIIYINGAPVVRHMEGYFSYHYKEDWSSNVPIFQEKLSNGVLYNVLSQDFLAPSSNISEFLVPKGHYFMMGDNRDKSKDSRWVEVGFVPEENLVGRASFVLFSIGGDTPFSKVWLWIPNMRWDRLFKIL
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]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:03:36)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:37)

• Minimal score value: -2.9243
• Maximal score value: 2.9521
• Average score: -0.0601
• Total score value: -13.1622

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	1.1882
2	R	A	-0.0960
3	T	A	0.8280
4	F	A	2.2478
5	L	A	1.9860
6	F	A	1.3512
7	Q	A	0.3965
8	P	A	0.2705
9	S	A	0.6120
10	V	A	1.8002
11	I	A	0.0000
12	P	A	0.0839
13	S	A	-0.3888
14	G	A	0.0000
15	S	A	-0.6765
16	M	A	0.0000
17	I	A	0.0000
18	P	A	0.0100
19	T	A	0.1531
20	L	A	0.0000
21	L	A	0.3235
22	V	A	0.0465
23	G	A	0.4144
24	D	A	0.0000
25	Y	A	1.3209
26	T	A	0.0000
27	T	A	0.5624
28	T	A	0.0000
29	N	A	0.6920
30	K	A	0.0000
31	Y	A	1.6619
32	S	A	0.0003
33	Y	A	0.0000
34	G	A	0.0000
35	Y	A	0.0000
36	S	A	0.0000
37	K	A	-0.0790
38	Y	A	0.0000
39	S	A	0.0000
40	F	A	0.9395
41	P	A	1.1470
42	F	A	1.8293
43	S	A	1.1703
44	Y	A	1.5642
45	N	A	0.0576
46	L	A	1.2525
47	F	A	0.5586
48	N	A	-1.0886
49	G	A	-1.0598
50	R	A	-0.3667
51	I	A	1.1363
52	F	A	1.6329
53	N	A	-0.7901
54	N	A	-1.7611
55	Q	A	-2.1339
56	P	A	0.0000
57	R	A	-2.4336
58	R	A	-1.4023
59	G	A	0.0000
60	D	A	-0.9909
61	V	A	0.0000
62	V	A	0.0000
63	V	A	0.0000
64	F	A	0.0000
65	R	A	-0.8216
66	Y	A	0.0000
67	P	A	-1.2660
68	K	A	-2.1365
69	D	A	-1.6041
70	P	A	-0.8936
71	S	A	-0.2167
72	I	A	0.0533
73	D	A	-0.6491
74	Y	A	-0.2022
75	V	A	-0.0752
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	-0.6472
82	P	A	-0.8513
83	G	A	-0.8115
84	D	A	0.0000
85	R	A	-1.5616
86	I	A	0.0000
87	S	A	-1.3293
88	L	A	0.0000
89	E	A	-1.9838
90	K	A	-1.0885
91	G	A	0.0000
92	I	A	-0.0006
93	I	A	0.0000
94	Y	A	-0.4568
95	I	A	-0.9317
96	N	A	-1.8398
97	G	A	-1.3889
98	A	A	-0.4357
99	P	A	-0.1545
100	V	A	0.0000
101	V	A	0.6506
102	R	A	-0.6068
103	H	A	-1.3270
104	M	A	-0.6124
105	E	A	-1.5638
106	G	A	-0.2920
107	Y	A	0.8048
108	F	A	0.3714
109	S	A	-0.1812
110	Y	A	0.0000
111	H	A	-1.4744
112	Y	A	0.0000
113	K	A	-2.9243
114	E	A	-2.8147
115	D	A	-1.5328
116	W	A	-0.2660
117	S	A	-0.1204
118	S	A	-0.4916
119	N	A	-0.8766
120	V	A	-0.4227
121	P	A	0.0000
122	I	A	-0.2116
123	F	A	-0.6212
124	Q	A	-1.1022
125	E	A	0.0000
126	K	A	-1.0301
127	L	A	0.0000
128	S	A	-0.7192
129	N	A	-1.4428
130	G	A	-0.8589
131	V	A	-0.2337
132	L	A	0.2408
133	Y	A	0.0000
134	N	A	-0.7966
135	V	A	0.0000
136	L	A	0.0000
137	S	A	0.0000
138	Q	A	-1.4107
139	D	A	-0.9816
140	F	A	0.4120
141	L	A	1.0438
142	A	A	0.1461
143	P	A	-0.2465
144	S	A	-0.5272
145	S	A	0.0000
146	N	A	-1.0737
147	I	A	-1.0905
148	S	A	-1.4514
149	E	A	-2.0770
150	F	A	-0.3846
151	L	A	0.3434
152	V	A	0.0000
153	P	A	-0.6808
154	K	A	-1.7901
155	G	A	-1.3671
156	H	A	-0.9423
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	-1.9088
166	K	A	-1.6709
167	S	A	0.0000
168	K	A	-1.1452
169	D	A	0.0000
170	S	A	0.0000
171	R	A	0.2439
172	W	A	0.9494
173	V	A	1.7030
174	E	A	-0.0391
175	V	A	0.0000
176	G	A	0.4442
177	F	A	0.7150
178	V	A	0.0000
179	P	A	-0.7473
180	E	A	-1.3118
181	E	A	-1.4841
182	N	A	0.0000
183	L	A	0.0000
184	V	A	0.0000
185	G	A	0.0000
186	R	A	-0.4910
187	A	A	0.0000
188	S	A	0.0000
189	F	A	2.1949
190	V	A	0.0000
191	L	A	1.8055
192	F	A	1.3427
193	S	A	0.0000
194	I	A	0.0000
195	G	A	-0.7317
196	G	A	-1.3533
197	D	A	-1.5890
198	T	A	0.1059
199	P	A	0.5672
200	F	A	2.2774
201	S	A	1.1201
202	K	A	1.2048
203	V	A	2.9521
204	W	A	2.6281
205	L	A	2.0036
206	W	A	2.1656
207	I	A	2.6631
208	P	A	0.8097
209	N	A	0.2977
210	M	A	0.6497
211	R	A	-0.0318
212	W	A	0.7311
213	D	A	-1.0462
214	R	A	0.3426
215	L	A	1.5922
216	F	A	2.7508
217	K	A	1.6292
218	I	A	2.7932
219	L	A	1.5616