Project name: m17

Chain sequence(s)	A: MPPILRFDHPFLFIIFE
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                                          (00:00:07)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:07)

• Minimal score value: -0.7764
• Maximal score value: 4.0155
• Average score: 1.4911
• Total score value: 25.3485

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	M	A	1.3052
2	P	A	0.6286
3	P	A	0.6858
4	I	A	1.8226
5	L	A	0.7549
6	R	A	0.1034
7	F	A	0.8961
8	D	A	-0.7764
9	H	A	0.0828
10	P	A	0.9900
11	F	A	2.9297
12	L	A	2.3902
13	F	A	2.2949
14	I	A	3.6254
15	I	A	4.0155
16	F	A	3.1587
17	E	A	0.4411