Project name: FTGHKT20

Chain sequence(s)	A: FTGHKTF; C: FTGHKTF; B: FTGHKTF; E: FTGHKTF; D: FTGHKTF; G: FTGHKTF; F: FTGHKTF; I: FTGHKTF; H: FTGHKTF; K: FTGHKTF; J: FTGHKTF; M: FTGHKTF; L: FTGHKTF; O: FTGHKTF; N: FTGHKTF; Q: FTGHKTF; P: FTGHKTF; S: FTGHKTF; R: FTGHKTF; T: FTGHKTF
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                                          (00:10:42)
[INFO]       Main:     Simulation completed successfully.                                          (00:10:48)

• Minimal score value: -1.1336
• Maximal score value: 2.9369
• Average score: 0.4071
• Total score value: 56.9883

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	1.8409
2	T	A	0.8952
3	G	A	0.0000
4	H	A	0.0000
5	K	A	-1.0570
6	T	A	0.6185
7	F	A	1.7932
1	F	B	0.1750
2	T	B	-0.2797
3	G	B	0.0000
4	H	B	-0.4648
5	K	B	-0.2591
6	T	B	1.3425
7	F	B	2.1268
1	F	C	0.7682
2	T	C	0.6396
3	G	C	0.0000
4	H	C	0.0000
5	K	C	-0.0139
6	T	C	0.9349
7	F	C	2.0630
1	F	D	0.3013
2	T	D	-0.1790
3	G	D	0.0000
4	H	D	0.0000
5	K	D	0.8384
6	T	D	1.3962
7	F	D	2.3394
1	F	E	0.0000
2	T	E	-0.3571
3	G	E	0.0000
4	H	E	0.0000
5	K	E	-0.6310
6	T	E	0.5565
7	F	E	1.8562
1	F	F	-0.0918
2	T	F	-0.5567
3	G	F	0.0000
4	H	F	-0.8322
5	K	F	0.0817
6	T	F	0.0000
7	F	F	2.3068
1	F	G	0.3284
2	T	G	0.4445
3	G	G	0.0000
4	H	G	-0.0813
5	K	G	-0.8459
6	T	G	-0.0093
7	F	G	1.2312
1	F	H	0.2227
2	T	H	-0.5198
3	G	H	0.0000
4	H	H	0.6157
5	K	H	1.5598
6	T	H	1.6955
7	F	H	2.4739
1	F	I	2.9369
2	T	I	0.0000
3	G	I	0.0715
4	H	I	0.0000
5	K	I	-1.1336
6	T	I	0.1177
7	F	I	1.3275
1	F	J	1.9001
2	T	J	0.2896
3	G	J	-0.2724
4	H	J	-0.2395
5	K	J	0.1054
6	T	J	0.7842
7	F	J	2.0416
1	F	K	-0.2556
2	T	K	-0.1725
3	G	K	0.0000
4	H	K	0.0000
5	K	K	-0.9377
6	T	K	0.4458
7	F	K	1.6758
1	F	L	0.0424
2	T	L	-0.2804
3	G	L	0.0000
4	H	L	-0.1805
5	K	L	-0.0153
6	T	L	0.8423
7	F	L	1.9182
1	F	M	1.1148
2	T	M	0.0487
3	G	M	0.0000
4	H	M	0.0000
5	K	M	-0.5356
6	T	M	0.5928
7	F	M	1.7616
1	F	N	-0.4270
2	T	N	-0.4789
3	G	N	-0.5735
4	H	N	0.0000
5	K	N	-0.0914
6	T	N	0.6334
7	F	N	1.6801
1	F	O	0.0803
2	T	O	-0.1086
3	G	O	0.0000
4	H	O	-0.6334
5	K	O	-0.8342
6	T	O	0.2515
7	F	O	1.5825
1	F	P	0.2137
2	T	P	0.1349
3	G	P	0.0000
4	H	P	-0.0263
5	K	P	0.0660
6	T	P	0.3120
7	F	P	1.4077
1	F	Q	0.3463
2	T	Q	0.0736
3	G	Q	-0.0378
4	H	Q	0.3002
5	K	Q	1.0310
6	T	Q	1.0775
7	F	Q	2.1867
1	F	R	1.0606
2	T	R	0.4985
3	G	R	0.2032
4	H	R	0.1540
5	K	R	-0.5800
6	T	R	0.1341
7	F	R	1.0898
1	F	S	0.8687
2	T	S	0.4575
3	G	S	0.0000
4	H	S	-0.0103
5	K	S	0.3778
6	T	S	0.9257
7	F	S	1.6833
1	F	T	1.3549
2	T	T	0.3558
3	G	T	0.0000
4	H	T	0.0000
5	K	T	-0.7176
6	T	T	0.3638
7	F	T	1.3410