Project name: 6e1495798f61cc3

Chain sequence(s)	A: EDEDEDEDEDEDGGKGHFG; C: EDEDEDEDEDEDGGKGHFG; B: EDEDEDEDEDEDGGKGHFG; D: EDEDEDEDEDEDGGKGHFG
Selected Chain(s)	A,C,B,D
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                                          (00:01:49)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:50)

• Minimal score value: -6.9805
• Maximal score value: 1.7658
• Average score: -4.0431
• Total score value: -307.2718

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	E	A	-4.6167
2	D	A	-5.6165
3	E	A	-6.5253
4	D	A	-6.4784
5	E	A	-6.3690
6	D	A	-5.5839
7	E	A	-5.7088
8	D	A	-5.3017
9	E	A	-5.3729
10	D	A	-4.9246
11	E	A	-4.7282
12	D	A	-4.1575
13	G	A	-2.8612
14	G	A	-3.0612
15	K	A	-3.0573
16	G	A	-1.2684
17	H	A	-0.5850
18	F	A	1.7658
19	G	A	-0.0975
1	E	B	-4.3718
2	D	B	-5.9228
3	E	B	-6.4657
4	D	B	-6.7399
5	E	B	-6.4964
6	D	B	-6.2206
7	E	B	-6.0202
8	D	B	-5.5024
9	E	B	-5.8109
10	D	B	-5.7452
11	E	B	-5.3473
12	D	B	-4.8705
13	G	B	-3.4353
14	G	B	-2.6410
15	K	B	-2.6634
16	G	B	-1.0713
17	H	B	-0.3831
18	F	B	1.6047
19	G	B	0.4534
1	E	C	-4.4200
2	D	C	-5.9742
3	E	C	-6.5093
4	D	C	-6.9805
5	E	C	-6.6864
6	D	C	-6.5542
7	E	C	-6.0777
8	D	C	-5.3352
9	E	C	-5.5733
10	D	C	-5.7172
11	E	C	-5.3265
12	D	C	-4.9405
13	G	C	-3.3635
14	G	C	-2.7797
15	K	C	-2.8602
16	G	C	-1.1329
17	H	C	-0.3852
18	F	C	1.6326
19	G	C	0.6486
1	E	D	-4.6007
2	D	D	-5.6667
3	E	D	-6.6823
4	D	D	-6.8181
5	E	D	-6.8659
6	D	D	-6.5545
7	E	D	-6.0887
8	D	D	-5.3575
9	E	D	-5.3619
10	D	D	-4.8335
11	E	D	-4.8007
12	D	D	-4.3635
13	G	D	-2.9935
14	G	D	-3.3298
15	K	D	-2.9517
16	G	D	-1.3419
17	H	D	-0.3478
18	F	D	1.7399
19	G	D	0.4803