Project name: 12073916ab8f1

Chain sequence(s)	A: FFGHKFG; C: FFGHKFG; B: FFGHKFG; E: FFGHKFG; D: FFGHKFG; G: FFGHKFG; F: FFGHKFG; I: FFGHKFG; H: FFGHKFG; K: FFGHKFG; J: FFGHKFG; M: FFGHKFG; L: FFGHKFG; O: FFGHKFG; N: FFGHKFG; Q: FFGHKFG; P: FFGHKFG; S: FFGHKFG; R: FFGHKFG; T: FFGHKFG
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]                                                (00:00:00)
[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                                          (00:07:09)
[INFO]       Main:     Simulation completed successfully.                                          (00:07:13)

• Minimal score value: -0.9673
• Maximal score value: 3.8821
• Average score: 0.5707
• Total score value: 79.8951

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	2.4964
2	F	A	2.2305
3	G	A	0.0000
4	H	A	0.0000
5	K	A	-0.5810
6	F	A	-0.2958
7	G	A	-0.9190
1	F	B	2.6729
2	F	B	2.6879
3	G	B	0.0000
4	H	B	0.0000
5	K	B	-0.2812
6	F	B	-0.0886
7	G	B	-0.4505
1	F	C	3.7107
2	F	C	3.7371
3	G	C	0.0000
4	H	C	0.7661
5	K	C	0.0740
6	F	C	0.1569
7	G	C	-0.3570
1	F	D	3.1470
2	F	D	3.2210
3	G	D	1.1545
4	H	D	-0.0178
5	K	D	0.0024
6	F	D	0.9634
7	G	D	-0.0213
1	F	E	3.8821
2	F	E	3.3787
3	G	E	0.0000
4	H	E	0.0000
5	K	E	0.0225
6	F	E	-0.1918
7	G	E	-0.6693
1	F	F	2.8666
2	F	F	2.5643
3	G	F	0.0000
4	H	F	0.0000
5	K	F	-0.3290
6	F	F	-0.3156
7	G	F	-0.8918
1	F	G	2.0434
2	F	G	1.9946
3	G	G	0.0000
4	H	G	0.0000
5	K	G	-0.3969
6	F	G	-0.3886
7	G	G	-0.8789
1	F	H	2.0656
2	F	H	2.0599
3	G	H	0.0000
4	H	H	0.0000
5	K	H	-0.4277
6	F	H	-0.4139
7	G	H	-0.9220
1	F	I	1.8994
2	F	I	1.9249
3	G	I	0.0000
4	H	I	0.0000
5	K	I	-0.5235
6	F	I	0.0000
7	G	I	-0.9673
1	F	J	2.2760
2	F	J	2.2444
3	G	J	0.0000
4	H	J	0.0000
5	K	J	-0.5903
6	F	J	-0.3973
7	G	J	-0.9314
1	F	K	2.4197
2	F	K	2.5169
3	G	K	0.0000
4	H	K	0.0000
5	K	K	-0.5308
6	F	K	-0.5750
7	G	K	-0.8858
1	F	L	2.9458
2	F	L	2.6318
3	G	L	1.2960
4	H	L	0.0000
5	K	L	-0.9010
6	F	L	-0.4691
7	G	L	-0.7077
1	F	M	3.0468
2	F	M	2.8953
3	G	M	0.8403
4	H	M	0.1403
5	K	M	-0.1984
6	F	M	0.9519
7	G	M	-0.0354
1	F	N	2.4742
2	F	N	2.5065
3	G	N	0.0000
4	H	N	0.3339
5	K	N	-0.2440
6	F	N	0.0060
7	G	N	-0.4534
1	F	O	2.2829
2	F	O	2.3101
3	G	O	0.0000
4	H	O	0.0000
5	K	O	-0.4359
6	F	O	-0.1558
7	G	O	-0.8204
1	F	P	2.1747
2	F	P	2.0522
3	G	P	0.0000
4	H	P	0.0000
5	K	P	-0.2576
6	F	P	-0.3791
7	G	P	-0.8302
1	F	Q	2.1646
2	F	Q	2.0842
3	G	Q	0.0000
4	H	Q	0.0000
5	K	Q	-0.2639
6	F	Q	-0.4151
7	G	Q	-0.8490
1	F	R	2.1587
2	F	R	2.1078
3	G	R	0.0000
4	H	R	0.0000
5	K	R	-0.2889
6	F	R	-0.3876
7	G	R	-0.8638
1	F	S	2.1366
2	F	S	1.9909
3	G	S	0.0000
4	H	S	0.0000
5	K	S	-0.3875
6	F	S	-0.4146
7	G	S	-0.8706
1	F	T	1.9249
2	F	T	1.9991
3	G	T	0.0000
4	H	T	0.0000
5	K	T	-0.4775
6	F	T	-0.4724
7	G	T	-0.9222