Project name: CMProt B1 Model5

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

• Minimal score value: -0.3832
• Maximal score value: 3.7664
• Average score: 2.0574
• Total score value: 41.1476

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	S	A	1.1458
2	S	A	1.4400
3	L	A	2.9945
4	F	A	3.2850
5	T	A	2.4315
6	F	A	3.2986
7	L	A	3.7664
8	C	A	3.2035
9	L	A	3.6099
10	A	A	0.0000
11	V	A	3.2684
12	F	A	3.7146
13	I	A	3.0997
14	N	A	0.9846
15	G	A	0.3918
16	C	A	1.5094
17	L	A	1.6685
18	S	A	0.1138
19	Q	A	-0.3832
20	I	A	1.6048