Project name: 4a2b2ab0390e231

Chain sequence(s)	A: IVIVKGHE; C: IVIVKGHE; B: IVIVKGHE; E: IVIVKGHE; D: IVIVKGHE; G: IVIVKGHE; F: IVIVKGHE; I: IVIVKGHE; H: IVIVKGHE; K: IVIVKGHE; J: IVIVKGHE; L: IVIVKGHE
Selected Chain(s)	A,C,B,E,D,G,F,I,H,K,J,L
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 all 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                                          (00:03:29)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:32)

• Minimal score value: -3.6762
• Maximal score value: 2.7895
• Average score: -0.4486
• Total score value: -43.0634

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	1.6742
2	V	A	0.0000
3	I	A	1.3441
4	V	A	0.0000
5	K	A	-1.6713
6	G	A	0.0000
7	H	A	-3.0013
8	E	A	-3.3988
1	I	B	2.0004
2	V	B	1.4058
3	I	B	1.8283
4	V	B	0.6594
5	K	B	-1.0700
6	G	B	-1.1729
7	H	B	-2.2038
8	E	B	-2.6010
1	I	C	2.7689
2	V	C	2.6065
3	I	C	2.2110
4	V	C	0.7998
5	K	C	-1.2450
6	G	C	-1.5634
7	H	C	-2.4489
8	E	C	-2.5137
1	I	D	1.7762
2	V	D	0.0000
3	I	D	1.6933
4	V	D	0.0000
5	K	D	-1.3815
6	G	D	0.0000
7	H	D	-2.3963
8	E	D	-2.5615
1	I	E	1.1120
2	V	E	0.0000
3	I	E	1.0519
4	V	E	0.0000
5	K	E	-1.4262
6	G	E	0.0000
7	H	E	-2.2533
8	E	E	-2.4523
1	I	F	1.3130
2	V	F	0.0000
3	I	F	1.1300
4	V	F	0.0000
5	K	F	-1.3832
6	G	F	0.0000
7	H	F	-2.3995
8	E	F	-3.1683
1	I	G	1.8886
2	V	G	0.0000
3	I	G	1.6154
4	V	G	0.0000
5	K	G	-1.7226
6	G	G	0.0000
7	H	G	-2.9329
8	E	G	-3.3582
1	I	H	2.1173
2	V	H	1.3220
3	I	H	2.0991
4	V	H	0.0000
5	K	H	-1.8742
6	G	H	-1.4303
7	H	H	-2.5040
8	E	H	-2.6477
1	I	I	2.7895
2	V	I	2.2426
3	I	I	2.4901
4	V	I	0.7231
5	K	I	-1.7899
6	G	I	-1.6927
7	H	I	-3.0343
8	E	I	-2.9496
1	I	J	1.9917
2	V	J	0.0000
3	I	J	1.5207
4	V	J	0.0000
5	K	J	-1.7660
6	G	J	0.0000
7	H	J	-3.1534
8	E	J	-3.4886
1	I	K	1.2552
2	V	K	0.0000
3	I	K	0.9538
4	V	K	0.0000
5	K	K	-2.1584
6	G	K	0.0000
7	H	K	-2.9397
8	E	K	-3.6762
1	I	L	1.2357
2	V	L	0.0000
3	I	L	0.8203
4	V	L	0.0000
5	K	L	-1.6833
6	G	L	0.0000
7	H	L	-3.0261
8	E	L	-3.3630