Project name: Acidic peptide_12

Chain sequence(s)	A: EDEDEDEDEDED; C: EDEDEDEDEDED; B: EDEDEDEDEDED; E: EDEDEDEDEDED; D: EDEDEDEDEDED; G: EDEDEDEDEDED; F: EDEDEDEDEDED; I: EDEDEDEDEDED; H: EDEDEDEDEDED; K: EDEDEDEDEDED; J: EDEDEDEDEDED; L: EDEDEDEDEDED
Selected Chain(s)	A,C,B,E,D,G,F,I,H,K,J,L
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                                          (00:04:58)
[INFO]       Main:     Simulation completed successfully.                                          (00:05:00)

• Minimal score value: -7.3953
• Maximal score value: 0.0
• Average score: -4.931
• Total score value: -710.0603

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	-4.1173
2	D	A	-4.7747
3	E	A	-6.0404
4	D	A	-5.6153
5	E	A	-6.1865
6	D	A	-6.1229
7	E	A	-6.0036
8	D	A	0.0000
9	E	A	-5.6309
10	D	A	-5.5288
11	E	A	-4.6916
12	D	A	-4.2298
1	E	B	-3.5470
2	D	B	-4.3333
3	E	B	-4.8848
4	D	B	-5.1577
5	E	B	-5.9191
6	D	B	-6.8925
7	E	B	-7.3953
8	D	B	-7.0471
9	E	B	-6.0007
10	D	B	-5.1169
11	E	B	-4.1987
12	D	B	-3.3982
1	E	C	-3.7771
2	D	C	-4.2702
3	E	C	-4.7274
4	D	C	-4.9099
5	E	C	-5.0886
6	D	C	-5.5535
7	E	C	-5.5465
8	D	C	-5.5175
9	E	C	-5.2237
10	D	C	-5.3498
11	E	C	-5.2520
12	D	C	-4.1948
1	E	D	-3.0926
2	D	D	-4.2347
3	E	D	-4.4472
4	D	D	-5.6990
5	E	D	-5.3595
6	D	D	0.0000
7	E	D	-6.0527
8	D	D	-4.9803
9	E	D	-4.8657
10	D	D	-4.4069
11	E	D	-4.8703
12	D	D	-3.8932
1	E	E	-3.4353
2	D	E	-3.8845
3	E	E	-4.9486
4	D	E	-5.3789
5	E	E	-5.7020
6	D	E	-5.7887
7	E	E	-5.5889
8	D	E	-5.7725
9	E	E	-5.6264
10	D	E	-5.3341
11	E	E	-4.7877
12	D	E	-3.5587
1	E	F	-6.1359
2	D	F	-5.7696
3	E	F	-5.7848
4	D	F	-4.5365
5	E	F	-4.7622
6	D	F	0.0000
7	E	F	-5.1281
8	D	F	-5.6997
9	E	F	-5.3759
10	D	F	-5.4125
11	E	F	-4.1485
12	D	F	-3.6191
1	E	G	-4.1858
2	D	G	-4.2587
3	E	G	-5.4212
4	D	G	-5.4124
5	E	G	-5.1372
6	D	G	-4.7525
7	E	G	-4.9717
8	D	G	-5.5081
9	E	G	-5.3097
10	D	G	-5.1935
11	E	G	-4.5538
12	D	G	-4.0069
1	E	H	-4.1158
2	D	H	-5.0145
3	E	H	-5.8606
4	D	H	-6.4449
5	E	H	-6.2150
6	D	H	-5.4460
7	E	H	-5.6161
8	D	H	-5.3576
9	E	H	-5.3977
10	D	H	-5.0438
11	E	H	-4.5212
12	D	H	-3.4949
1	E	I	-4.6665
2	D	I	-5.5830
3	E	I	-5.6871
4	D	I	-5.7153
5	E	I	-5.5360
6	D	I	-5.1244
7	E	I	-5.6667
8	D	I	-5.0758
9	E	I	-5.8256
10	D	I	-4.8841
11	E	I	-5.3024
12	D	I	-3.6157
1	E	J	-6.0883
2	D	J	-5.7972
3	E	J	0.0000
4	D	J	-5.8002
5	E	J	-5.4258
6	D	J	-4.8552
7	E	J	-4.9392
8	D	J	-5.0379
9	E	J	-5.9827
10	D	J	-6.7800
11	E	J	-7.2961
12	D	J	-6.2427
1	E	K	-3.9199
2	D	K	-5.9058
3	E	K	-5.7022
4	D	K	-6.5777
5	E	K	-6.1943
6	D	K	-6.3156
7	E	K	-6.2339
8	D	K	-5.7068
9	E	K	0.0000
10	D	K	-4.5301
11	E	K	-3.9906
12	D	K	-3.3763
1	E	L	-4.0342
2	D	L	-4.4739
3	E	L	-5.1236
4	D	L	-4.5485
5	E	L	-4.7293
6	D	L	-4.7859
7	E	L	-4.9216
8	D	L	-5.1020
9	E	L	-4.6830
10	D	L	-4.1077
11	E	L	-3.7366
12	D	L	-2.8680