Project name: 10A_distance

Chain sequence(s)	B: GTNLSVPNPLGFFPDHQLDPAFKANSENPDWDLNPHKDNWPDANKVG
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]                                                (00:00:07)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:07)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with B chain(s) selected             (00:00:07)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:07)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:07)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:22)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:23)

• Minimal score value: -3.3732
• Maximal score value: 2.684
• Average score: -0.8443
• Total score value: -39.6802

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
2	G	B	-0.6034
3	T	B	-0.5465
4	N	B	-0.8217
5	L	B	0.8187
6	S	B	0.2742
7	V	B	1.0584
8	P	B	0.6995
9	N	B	0.5130
10	P	B	0.6548
11	L	B	1.7110
12	G	B	1.5669
13	F	B	2.6840
14	F	B	2.3193
15	P	B	0.3370
16	D	B	-0.7260
17	H	B	0.3756
18	Q	B	0.0000
19	L	B	0.9338
20	D	B	-0.0704
21	P	B	0.0073
22	A	B	0.0908
23	F	B	0.3487
24	K	B	-2.4956
25	A	B	-2.4976
26	N	B	-2.3426
27	S	B	-2.6008
28	E	B	-3.3399
29	N	B	-3.3234
30	P	B	-2.8296
31	D	B	-2.5712
32	W	B	-1.0369
33	D	B	-1.0061
34	L	B	-0.6092
35	N	B	-1.7199
36	P	B	-1.6724
37	H	B	-2.6072
38	K	B	-3.3732
39	D	B	-3.2130
40	N	B	-2.4147
41	W	B	-1.0919
42	P	B	-1.6283
43	D	B	-2.4677
44	A	B	-1.7826
45	N	B	-2.1428
46	K	B	-2.2198
47	V	B	0.1407
48	G	B	-0.4595