Project name: query_structure

Chain sequence(s)	A: GLPVCGETCVGGTCNTPGCTCSWPVCTRN
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                                          (00:00:10)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:11)

• Minimal score value: -2.2955
• Maximal score value: 1.7824
• Average score: -0.034
• Total score value: -0.9864

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	A	0.4457
2	L	A	1.5922
3	P	A	0.6520
4	V	A	1.2841
5	C	A	0.0000
6	G	A	-0.3235
7	E	A	-0.2096
8	T	A	0.4659
9	C	A	0.0000
10	V	A	1.7824
11	G	A	0.4283
12	G	A	0.2256
13	T	A	-0.0522
14	C	A	-0.4993
15	N	A	-1.4325
16	T	A	-0.9753
17	P	A	-0.9989
18	G	A	-1.2996
19	C	A	-1.2326
20	T	A	-0.7880
21	C	A	0.2363
22	S	A	0.6593
23	W	A	1.6634
24	P	A	1.3503
25	V	A	1.1721
26	C	A	0.0000
27	T	A	-0.7960
28	R	A	-2.2955
29	N	A	-2.0410