Project name: Lactiplantibacillus

Chain sequence(s)	A: ILMVWRANGAWCVQINGLQKRVYDI
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                                          (00:00:13)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:14)

• Minimal score value: -2.1275
• Maximal score value: 2.6459
• Average score: 0.144
• Total score value: 3.6007

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	2.6459
2	L	A	2.3643
3	M	A	1.9278
4	V	A	0.8670
5	W	A	0.4681
6	R	A	-1.4736
7	A	A	-0.8515
8	N	A	-1.2208
9	G	A	0.0000
10	A	A	0.0194
11	W	A	0.4903
12	C	A	-0.2943
13	V	A	0.5194
14	Q	A	0.2108
15	I	A	0.8318
16	N	A	-0.4563
17	G	A	-0.0961
18	L	A	0.3017
19	Q	A	-1.2425
20	K	A	-2.1275
21	R	A	-1.8888
22	V	A	0.4660
23	Y	A	0.8445
24	D	A	-0.1346
25	I	A	1.4297