Project name: query_structure

Chain sequence(s)	A: GLPVCGETCFGGRCNTPGCTCSYPICTRN
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                                          (00:00:22)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:23)

• Minimal score value: -2.1598
• Maximal score value: 1.6806
• Average score: -0.2849
• Total score value: -8.2611

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	0.3214
2	L	A	1.1523
3	P	A	-0.2071
4	V	A	0.2749
5	C	A	-0.4556
6	G	A	-0.2624
7	E	A	-0.2883
8	T	A	0.3994
9	C	A	0.0000
10	F	A	1.6806
11	G	A	0.0465
12	G	A	-0.3845
13	R	A	-1.6793
14	C	A	-1.2638
15	N	A	-1.7439
16	T	A	-1.3327
17	P	A	-0.9984
18	G	A	-1.4981
19	C	A	-1.5777
20	T	A	-0.8357
21	C	A	0.1152
22	S	A	0.8305
23	Y	A	1.6802
24	P	A	1.3654
25	I	A	1.1590
26	C	A	0.0000
27	T	A	-0.4501
28	R	A	-2.1491
29	N	A	-2.1598