Project name: 9b82839b736e7c

Chain sequence(s)	A: FGGHKGF; C: FGGHKGF; B: FGGHKGF; E: FGGHKGF; D: FGGHKGF; G: FGGHKGF; F: FGGHKGF; I: FGGHKGF; H: FGGHKGF; K: FGGHKGF; J: FGGHKGF; M: FGGHKGF; L: FGGHKGF; O: FGGHKGF; N: FGGHKGF; Q: FGGHKGF; P: FGGHKGF; S: FGGHKGF; R: FGGHKGF; T: FGGHKGF
Selected Chain(s)	A,C,B,E,D,G,F,I,H,K,J,M,L,O,N,Q,P,S,R,T
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                                          (00:06:29)
[INFO]       Main:     Simulation completed successfully.                                          (00:06:35)

• Minimal score value: -2.8494
• Maximal score value: 3.241
• Average score: 0.4307
• Total score value: 60.3045

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	F	A	2.6112
2	G	A	0.9050
3	G	A	-0.3208
4	H	A	0.0000
5	K	A	-1.0089
6	G	A	0.0000
7	F	A	1.6060
1	F	B	2.7423
2	G	B	1.0993
3	G	B	-0.1167
4	H	B	0.0000
5	K	B	-1.0804
6	G	B	0.0000
7	F	B	1.7395
1	F	C	3.2410
2	G	C	1.2170
3	G	C	-0.2272
4	H	C	0.0000
5	K	C	-1.2634
6	G	C	0.0000
7	F	C	1.7084
1	F	D	2.6157
2	G	D	1.0081
3	G	D	-0.4166
4	H	D	0.0000
5	K	D	-1.6700
6	G	D	0.0000
7	F	D	1.6742
1	F	E	2.4250
2	G	E	0.6845
3	G	E	-0.7490
4	H	E	0.0000
5	K	E	-1.4649
6	G	E	0.0000
7	F	E	1.8404
1	F	F	2.6135
2	G	F	0.7473
3	G	F	-0.9429
4	H	F	0.0000
5	K	F	-1.7218
6	G	F	0.0000
7	F	F	1.6942
1	F	G	2.4225
2	G	G	0.4662
3	G	G	-1.0903
4	H	G	-2.5327
5	K	G	-2.2850
6	G	G	-0.5245
7	F	G	1.6482
1	F	H	2.5149
2	G	H	0.8571
3	G	H	-0.8184
4	H	H	-1.8877
5	K	H	-1.5979
6	G	H	0.6317
7	F	H	2.3204
1	F	I	2.3908
2	G	I	0.8089
3	G	I	-0.5732
4	H	I	0.0000
5	K	I	-1.0480
6	G	I	0.0000
7	F	I	2.0020
1	F	J	2.5315
2	G	J	1.0131
3	G	J	-0.3467
4	H	J	0.0000
5	K	J	-0.7392
6	G	J	0.0000
7	F	J	2.1814
1	F	K	3.0871
2	G	K	1.3075
3	G	K	-0.0855
4	H	K	0.0000
5	K	K	-0.7687
6	G	K	0.8461
7	F	K	1.8944
1	F	L	2.5507
2	G	L	1.1155
3	G	L	-0.1200
4	H	L	0.0000
5	K	L	-0.9450
6	G	L	0.7209
7	F	L	1.8303
1	F	M	2.4529
2	G	M	1.0442
3	G	M	-0.2559
4	H	M	0.0000
5	K	M	-0.9386
6	G	M	0.0000
7	F	M	1.6797
1	F	N	3.1791
2	G	N	1.4988
3	G	N	-0.3504
4	H	N	0.0000
5	K	N	-1.1793
6	G	N	0.0000
7	F	N	1.7290
1	F	O	3.0248
2	G	O	1.0687
3	G	O	-0.6388
4	H	O	-1.8646
5	K	O	-1.6737
6	G	O	0.3768
7	F	O	2.1731
1	F	P	1.8723
2	G	P	0.6109
3	G	P	-0.3803
4	H	P	0.0000
5	K	P	-0.9054
6	G	P	0.0000
7	F	P	1.8327
1	F	Q	2.2647
2	G	Q	0.8292
3	G	Q	-0.6774
4	H	Q	0.0000
5	K	Q	-0.8864
6	G	Q	1.1263
7	F	Q	2.3218
1	F	R	2.5265
2	G	R	1.1189
3	G	R	-0.7002
4	H	R	-1.9226
5	K	R	-1.2812
6	G	R	0.0000
7	F	R	2.5025
1	F	S	2.4253
2	G	S	0.3275
3	G	S	-1.3137
4	H	S	-2.8429
5	K	S	-2.4356
6	G	S	-0.3910
7	F	S	1.9161
1	F	T	2.8477
2	G	T	0.8049
3	G	T	-0.9792
4	H	T	-2.8494
5	K	T	-1.9245
6	G	T	0.0172
7	F	T	2.1556