Project name: d8e67453cd0a76a

Chain sequence(s)	A: LAERLKAKLPEATPTELAKLVNKRSDFASNCCSI
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:54)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:55)

• Minimal score value: -3.5366
• Maximal score value: 2.1881
• Average score: -1.4722
• Total score value: -50.0531

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	L	A	-0.6213
2	A	A	-1.4515
3	E	A	-2.7457
4	R	A	-2.8605
5	L	A	-1.6818
6	K	A	-2.4278
7	A	A	-2.3090
8	K	A	-2.6802
9	L	A	-1.8988
10	P	A	-1.6106
11	E	A	-2.2855
12	A	A	-1.4268
13	T	A	-0.9960
14	P	A	-1.0533
15	T	A	-0.9483
16	E	A	-1.5813
17	L	A	-1.4270
18	A	A	-1.6192
19	K	A	-2.8233
20	L	A	-1.9014
21	V	A	-2.1208
22	N	A	-3.0697
23	K	A	-3.5366
24	R	A	-2.9281
25	S	A	-2.2117
26	D	A	-2.6255
27	F	A	-0.5835
28	A	A	-0.6449
29	S	A	-0.6063
30	N	A	-0.7707
31	C	A	0.8580
32	C	A	1.2267
33	S	A	1.1212
34	I	A	2.1881