Project name: 6FOE VHVL

Chain sequence(s)	H: EVQLLESGGGLVQPGGSLRLSCAASGFTFSIYSMNWVRQAPGKGLEWVSSIGSSGGTTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCAGSQWLYGMDVWGQGTTVTVSS; L: DIQMTQSPSSLSASVGDRVTITCRSSQRIMTYLNWYQQKPGKAPKLLIFVASHSQSGVPSRFRGSGSETDFTLTISGLQPEDSATYYCQQSFWTPLTFGGGTKVEIK
Selected Chain(s)	H,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                                          (00:00:59)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:00)

• Minimal score value: -2.8653
• Maximal score value: 1.8056
• Average score: -0.5883
• Total score value: -132.37

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	H	-1.5360
2	V	H	-0.1642
3	Q	H	-0.5543
4	L	H	0.0000
5	L	H	0.5235
6	E	H	0.0000
7	S	H	-0.5225
8	G	H	-0.9011
9	G	H	-0.3369
11	G	H	0.3047
12	L	H	1.1918
13	V	H	-0.0373
14	Q	H	-1.3552
15	P	H	-1.6515
16	G	H	-1.4816
17	G	H	-1.0334
18	S	H	-1.1212
19	L	H	-0.7199
20	R	H	-1.5989
21	L	H	0.0000
22	S	H	-0.3564
23	C	H	0.0000
24	A	H	-0.2682
25	A	H	0.0000
26	S	H	-0.6886
27	G	H	-0.7845
28	F	H	0.0629
29	T	H	0.4594
30	F	H	0.0000
35	S	H	0.2021
36	I	H	1.8056
37	Y	H	0.0000
38	S	H	0.3718
39	M	H	0.0000
40	N	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	-0.8697
45	A	H	-1.2612
46	P	H	-1.0039
47	G	H	-1.4588
48	K	H	-2.2725
49	G	H	-1.4159
50	L	H	0.0000
51	E	H	-0.9221
52	W	H	0.0000
53	V	H	0.0000
54	S	H	0.0000
55	S	H	0.0000
56	I	H	0.0000
57	G	H	-0.0091
58	S	H	0.3147
59	S	H	-0.2369
62	G	H	-0.5460
63	G	H	-0.6804
64	T	H	-0.3157
65	T	H	0.0563
66	Y	H	0.1229
67	Y	H	-0.6668
68	A	H	-1.5047
69	D	H	-2.6420
70	S	H	-1.7769
71	V	H	0.0000
72	K	H	-2.5258
74	G	H	-1.7101
75	R	H	-1.5908
76	F	H	0.0000
77	T	H	-0.7100
78	I	H	0.0000
79	S	H	-0.4469
80	R	H	-0.9692
81	D	H	-1.4944
82	N	H	-1.4360
83	S	H	-1.5772
84	K	H	-2.3851
85	N	H	-1.8200
86	T	H	-1.0328
87	L	H	0.0000
88	Y	H	-0.4285
89	L	H	0.0000
90	Q	H	-1.0334
91	M	H	0.0000
92	N	H	-1.2727
93	S	H	-1.2521
94	L	H	0.0000
95	R	H	-2.3437
96	A	H	-1.7347
97	E	H	-2.2468
98	D	H	0.0000
99	T	H	-0.6610
100	A	H	0.0000
101	V	H	0.0114
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	G	H	0.0000
107	S	H	0.0000
108	Q	H	0.4298
109	W	H	1.5302
110	L	H	1.6422
113	Y	H	1.3231
114	G	H	0.0000
115	M	H	0.0000
116	D	H	-0.6844
117	V	H	0.0000
118	W	H	-0.3056
119	G	H	0.0000
120	Q	H	-1.4217
121	G	H	-0.7213
122	T	H	-0.2919
123	T	H	0.0701
124	V	H	0.0000
125	T	H	-0.0452
126	V	H	0.0000
127	S	H	-0.5562
128	S	H	-0.5776
1	D	L	-2.2381
2	I	L	0.0000
3	Q	L	-2.2127
4	M	L	0.0000
5	T	L	-1.2738
6	Q	L	0.0000
7	S	L	-0.8426
8	P	L	-0.6583
9	S	L	-0.9043
10	S	L	-1.3301
11	L	L	-1.0733
12	S	L	-1.5307
13	A	L	0.0000
14	S	L	-0.8268
15	V	L	0.2811
16	G	L	-0.7176
17	D	L	-1.7390
18	R	L	-2.3041
19	V	L	0.0000
20	T	L	-0.8124
21	I	L	0.0000
22	T	L	-0.7668
23	C	L	0.0000
24	R	L	-2.8653
25	S	L	0.0000
26	S	L	-2.3155
27	Q	L	-2.7412
28	R	L	-2.4955
29	I	L	0.0000
36	M	L	-0.0897
37	T	L	0.2118
38	Y	L	0.8562
39	L	L	0.0000
40	N	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	0.0000
45	K	L	-1.9312
46	P	L	-1.3025
47	G	L	-1.6932
48	K	L	-2.5724
49	A	L	-1.5803
50	P	L	0.0000
51	K	L	-1.3784
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	F	L	0.2565
56	V	L	0.5294
57	A	L	0.0000
65	S	L	-1.0038
66	H	L	-1.1577
67	S	L	-1.1655
68	Q	L	-0.7990
69	S	L	-0.7430
70	G	L	-0.6143
71	V	L	-0.6654
72	P	L	-0.6467
74	S	L	-0.9332
75	R	L	-1.2357
76	F	L	0.0000
77	R	L	-2.2384
78	G	L	0.0000
79	S	L	-0.9759
80	G	L	-0.8035
83	S	L	-0.9400
84	E	L	-1.5726
85	T	L	-2.0483
86	D	L	-2.0194
87	F	L	0.0000
88	T	L	-0.9031
89	L	L	0.0000
90	T	L	-1.2154
91	I	L	0.0000
92	S	L	-1.6335
93	G	L	-1.1084
94	L	L	0.0000
95	Q	L	-0.7792
96	P	L	-1.3039
97	E	L	-1.9318
98	D	L	0.0000
99	S	L	-1.7635
100	A	L	0.0000
101	T	L	-1.3250
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	Q	L	0.0000
106	Q	L	0.0000
107	S	L	0.0000
108	F	L	1.0953
109	W	L	0.9100
114	T	L	0.4744
115	P	L	-0.1841
116	L	L	0.1654
117	T	L	-0.3911
118	F	L	-0.2648
119	G	L	0.0000
120	G	L	-1.1822
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-2.4244
124	V	L	0.0000
125	E	L	-2.4924
126	I	L	-1.2405
127	K	L	-1.7017