Project name: 1350a68c0fa3392

Chain sequence(s)	L: KLLLGENYPEFQD
Selected Chain(s)	L
Distance of aggregation	5 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 L chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:15)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:16)

• Minimal score value: -2.1194
• Maximal score value: 1.9756
• Average score: -0.4725
• Total score value: -6.1425

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
52	K	L	-1.4183
53	L	L	1.5202
54	L	L	1.9756
55	L	L	1.0135
56	G	L	-0.5741
57	E	L	-2.1194
58	N	L	-1.4106
59	Y	L	0.7829
60	P	L	-0.3990
61	E	L	-1.8088
62	F	L	-0.2310
63	Q	L	-1.4662
64	D	L	-2.0073