Project name: IVIVKGHE8

Chain sequence(s)	A: IVIVKGHE; C: IVIVKGHE; B: IVIVKGHE; E: IVIVKGHE; D: IVIVKGHE; G: IVIVKGHE; F: IVIVKGHE; H: IVIVKGHE
Selected Chain(s)	A,C,B,E,D,G,F,H
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 all 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                                          (00:02:16)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:18)

• Minimal score value: -3.8066
• Maximal score value: 4.392
• Average score: -0.0077
• Total score value: -0.4897

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	I	A	4.0554
2	V	A	3.7138
3	I	A	2.3706
4	V	A	0.3210
5	K	A	-2.4621
6	G	A	-3.4730
7	H	A	-3.6957
8	E	A	-3.7607
1	I	B	3.9893
2	V	B	3.8825
3	I	B	3.4403
4	V	B	0.7064
5	K	B	-1.9815
6	G	B	-3.1091
7	H	B	-3.3860
8	E	B	-3.5622
1	I	C	4.2239
2	V	C	4.0698
3	I	C	3.2857
4	V	C	0.8547
5	K	C	-1.9574
6	G	C	-3.0818
7	H	C	-3.3322
8	E	C	-3.5146
1	I	D	4.1378
2	V	D	4.3920
3	I	D	3.5903
4	V	D	0.9521
5	K	D	-1.9355
6	G	D	-3.2374
7	H	D	-3.8066
8	E	D	-3.7011
1	I	E	4.3094
2	V	E	4.1458
3	I	E	3.3024
4	V	E	0.7728
5	K	E	-1.9836
6	G	E	-3.3212
7	H	E	-3.6065
8	E	E	-3.7280
1	I	F	4.1342
2	V	F	4.1297
3	I	F	3.5387
4	V	F	0.8967
5	K	F	-1.8146
6	G	F	-3.0527
7	H	F	-3.1330
8	E	F	-3.4887
1	I	G	4.3539
2	V	G	4.2020
3	I	G	3.4075
4	V	G	0.9656
5	K	G	-1.7234
6	G	G	-3.0341
7	H	G	-3.2735
8	E	G	-3.4999
1	I	H	3.9909
2	V	H	3.8010
3	I	H	3.4044
4	V	H	0.6538
5	K	H	-2.0409
6	G	H	-3.1953
7	H	H	-3.8061
8	E	H	-3.7857