Project name: query_structure

Chain sequence(s)	A: GLPVCGETCFGGTCNTPGCSCTDPICTRD
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                                          (00:00:06)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:06)

• Minimal score value: -2.4393
• Maximal score value: 1.1835
• Average score: -0.5351
• Total score value: -15.518

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	0.3006
2	L	A	1.1835
3	P	A	-0.2386
4	V	A	0.1400
5	C	A	-0.4542
6	G	A	-0.2738
7	E	A	-0.2206
8	T	A	0.0160
9	C	A	0.0000
10	F	A	1.1329
11	G	A	-0.0513
12	G	A	-0.5354
13	T	A	-0.4988
14	C	A	-0.7387
15	N	A	-1.3956
16	T	A	-1.0847
17	P	A	-0.9293
18	G	A	-1.3477
19	C	A	-1.2733
20	S	A	-1.1245
21	C	A	-0.5205
22	T	A	-0.6443
23	D	A	-1.3847
24	P	A	-0.4451
25	I	A	0.1591
26	C	A	0.0000
27	T	A	-0.9035
28	R	A	-1.9462
29	D	A	-2.4393