Project name: 773f30ef1feac2a

Chain sequence(s)	A: RADARADARADARADA; C: RADARADARADARADA; B: RADARADARADARADA; E: RADARADARADARADA; D: RADARADARADARADA; G: RADARADARADARADA; F: RADARADARADARADA; I: RADARADARADARADA; H: RADARADARADARADA; K: RADARADARADARADA; J: RADARADARADARADA; L: RADARADARADARADA
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                                          (00:09:37)
[INFO]       Main:     Simulation completed successfully.                                          (00:09:40)

• Minimal score value: -3.4254
• Maximal score value: 0.0
• Average score: -2.0026
• Total score value: -384.5014

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	R	A	-2.6203
2	A	A	-1.9373
3	D	A	-2.9183
4	A	A	-1.9270
5	R	A	-3.0100
6	A	A	-2.0091
7	D	A	-2.9534
8	A	A	-1.9005
9	R	A	-2.9107
10	A	A	-1.9017
11	D	A	-3.0135
12	A	A	-2.0331
13	R	A	-3.3367
14	A	A	-2.3539
15	D	A	-2.9807
16	A	A	-1.2324
1	R	B	-3.3589
2	A	B	-2.4542
3	D	B	-2.7875
4	A	B	-1.8955
5	R	B	-2.5991
6	A	B	-1.6624
7	D	B	0.0000
8	A	B	-1.5569
9	R	B	-2.4698
10	A	B	-1.6758
11	D	B	-2.1119
12	A	B	-1.4818
13	R	B	-2.4731
14	A	B	-1.8377
15	D	B	-1.8860
16	A	B	-0.8564
1	R	C	-2.4193
2	A	C	-1.3991
3	D	C	0.0000
4	A	C	-0.6614
5	R	C	-1.4604
6	A	C	-0.8618
7	D	C	0.0000
8	A	C	-1.0183
9	R	C	-1.5751
10	A	C	-1.3103
11	D	C	-1.6781
12	A	C	-1.2516
13	R	C	-2.2815
14	A	C	-1.6352
15	D	C	-2.0831
16	A	C	-0.9243
1	R	D	-2.7858
2	A	D	-1.6244
3	D	D	-2.0659
4	A	D	-1.0834
5	R	D	-1.7962
6	A	D	-0.9923
7	D	D	-1.4071
8	A	D	-0.8930
9	R	D	-1.3800
10	A	D	-1.2164
11	D	D	-1.4469
12	A	D	-1.1311
13	R	D	-2.0084
14	A	D	-1.4516
15	D	D	-1.9129
16	A	D	-0.8757
1	R	E	-3.3110
2	A	E	-2.3993
3	D	E	-2.7353
4	A	E	-2.0375
5	R	E	-3.1636
6	A	E	-1.9640
7	D	E	-2.3150
8	A	E	-1.7005
9	R	E	-2.5782
10	A	E	-1.8488
11	D	E	-2.4846
12	A	E	-1.9805
13	R	E	-3.1021
14	A	E	-2.2275
15	D	E	-2.1777
16	A	E	-0.9387
1	R	F	-2.7343
2	A	F	-2.0602
3	D	F	-3.1540
4	A	F	-2.0831
5	R	F	-3.1155
6	A	F	-2.0196
7	D	F	-3.0371
8	A	F	-1.9856
9	R	F	-3.1259
10	A	F	-2.1811
11	D	F	-3.2863
12	A	F	-2.1632
13	R	F	-3.3823
14	A	F	-2.3129
15	D	F	-2.9759
16	A	F	-1.2339
1	R	G	-2.6934
2	A	G	-2.0184
3	D	G	-3.0401
4	A	G	-2.0236
5	R	G	-3.1142
6	A	G	-2.0428
7	D	G	-3.1098
8	A	G	-2.0086
9	R	G	-3.0879
10	A	G	-2.0245
11	D	G	-2.9988
12	A	G	-1.9077
13	R	G	-3.0225
14	A	G	-2.0198
15	D	G	-2.6759
16	A	G	-1.0979
1	R	H	-2.6675
2	A	H	-1.7696
3	D	H	0.0000
4	A	H	-1.5856
5	R	H	-2.6151
6	A	H	-1.7583
7	D	H	-2.3893
8	A	H	-1.8653
9	R	H	-2.8780
10	A	H	-1.9372
11	D	H	-2.4341
12	A	H	-1.6848
13	R	H	-2.8140
14	A	H	-2.0423
15	D	H	-2.0209
16	A	H	-0.9296
1	R	I	-2.5034
2	A	I	-1.3410
3	D	I	0.0000
4	A	I	-0.9004
5	R	I	-1.8684
6	A	I	-1.2237
7	D	I	-2.0356
8	A	I	-1.1238
9	R	I	-1.7723
10	A	I	-0.9183
11	D	I	-1.3538
12	A	I	-0.7772
13	R	I	-1.8538
14	A	I	-1.3794
15	D	I	-1.8851
16	A	I	-0.8509
1	R	J	-2.9397
2	A	J	-1.7848
3	D	J	-1.5551
4	A	J	-0.6942
5	R	J	-1.1659
6	A	J	-0.7029
7	D	J	-1.2749
8	A	J	-1.1792
9	R	J	-2.1262
10	A	J	-1.3126
11	D	J	-1.8496
12	A	J	-1.0904
13	R	J	-2.1183
14	A	J	-1.4231
15	D	J	-1.7392
16	A	J	-0.6777
1	R	K	-3.4254
2	A	K	-2.3896
3	D	K	-2.4248
4	A	K	-1.4258
5	R	K	-1.9637
6	A	K	-1.4028
7	D	K	-2.1564
8	A	K	-2.0022
9	R	K	-3.2570
10	A	K	-2.1259
11	D	K	-2.6524
12	A	K	-2.0657
13	R	K	-3.2352
14	A	K	-2.2291
15	D	K	-2.4882
16	A	K	-0.8730
1	R	L	-2.9280
2	A	L	-2.2437
3	D	L	-3.0370
4	A	L	-1.8894
5	R	L	-2.8339
6	A	L	-1.8614
7	D	L	-2.9330
8	A	L	-2.1359
9	R	L	-3.3027
10	A	L	-2.1724
11	D	L	-3.2012
12	A	L	-2.1491
13	R	L	-3.3974
14	A	L	-2.2707
15	D	L	-2.7300
16	A	L	-1.0086