Project name: ef11f3962824a3e

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]                                                (00:00:01)
[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                                          (00:02:54)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:56)

• Minimal score value: -4.1054
• Maximal score value: 4.1278
• Average score: -0.1227
• Total score value: -7.8535

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	3.3306
2	V	A	3.7731
3	I	A	2.3925
4	V	A	1.4635
5	K	A	-1.5728
6	G	A	-2.2376
7	H	A	-3.3109
8	E	A	-3.4012
1	I	B	3.3159
2	V	B	3.9647
3	I	B	0.0000
4	V	B	1.3621
5	K	B	-1.1513
6	G	B	-2.6541
7	H	B	-4.0195
8	E	B	-4.1054
1	I	C	3.1966
2	V	C	3.7225
3	I	C	0.0000
4	V	C	1.7214
5	K	C	-1.2793
6	G	C	-2.2132
7	H	C	-3.3241
8	E	C	-3.4251
1	I	D	3.3497
2	V	D	3.9526
3	I	D	2.7730
4	V	D	1.9034
5	K	D	-0.8398
6	G	D	-1.9964
7	H	D	-3.0470
8	E	D	-3.1491
1	I	E	2.5423
2	V	E	3.2075
3	I	E	0.0000
4	V	E	1.2924
5	K	E	-0.9580
6	G	E	-2.1695
7	H	E	-3.3393
8	E	E	-3.7803
1	I	F	2.1883
2	V	F	2.6402
3	I	F	0.0000
4	V	F	1.2084
5	K	F	-0.9996
6	G	F	-1.9440
7	H	F	-3.2056
8	E	F	-3.6617
1	I	G	2.8069
2	V	G	3.4223
3	I	G	0.0000
4	V	G	1.4663
5	K	G	-0.7584
6	G	G	-2.2323
7	H	G	-3.4340
8	E	G	-3.8195
1	I	H	3.6179
2	V	H	4.1278
3	I	H	3.1658
4	V	H	1.8174
5	K	H	-1.2070
6	G	H	-2.0836
7	H	H	-3.1165
8	E	H	-3.1425