Project name: 5cc09b8b9e1b26e

Chain sequence(s)	B: GSGTTVSISVSGSLVTVTITSQSQRSFRGALVSISSSGSTEVLATFTVET
Selected Chain(s)	B
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 B 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                                          (00:00:09)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:09)

• Minimal score value: -2.9285
• Maximal score value: 2.8987
• Average score: 0.2546
• Total score value: 12.7276

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	G	B	-0.6010
2	S	B	-1.1139
3	G	B	-0.7806
4	T	B	-0.3616
5	T	B	0.3737
6	V	B	1.8665
7	S	B	1.5759
8	I	B	2.8987
9	S	B	2.0329
10	V	B	2.6373
11	S	B	0.9725
12	G	B	0.3161
13	S	B	0.7575
14	L	B	2.0569
15	V	B	2.5883
16	T	B	1.8747
17	V	B	2.1406
18	T	B	1.2876
19	I	B	1.2859
20	T	B	0.1676
21	S	B	-0.8922
22	Q	B	-1.8739
23	S	B	-1.9835
24	Q	B	-2.6691
25	R	B	-2.9285
26	S	B	-2.1654
27	F	B	-1.2595
28	R	B	-1.5847
29	G	B	-0.3949
30	A	B	0.4793
31	L	B	1.7746
32	V	B	1.5807
33	S	B	1.1608
34	I	B	1.6462
35	S	B	0.1761
36	S	B	-0.1232
37	S	B	-0.3249
38	G	B	-0.4538
39	S	B	-0.2341
40	T	B	0.2501
41	E	B	-0.0649
42	V	B	1.9434
43	L	B	2.2665
44	A	B	1.3091
45	T	B	0.6773
46	F	B	0.1788
47	T	B	-0.6073
48	V	B	-0.9292
49	E	B	-2.3133
50	T	B	-1.8885