Project name: LVS

Chain sequence(s)	H: EVQLLESGGGLVQPGGSLRLSCAASGYTNRLKCMGWFRQAPGKERELVSISTGTGNTYYADSVKGRFTISRDNSKNTLYLQMNSLKAEDTAVYYCAADVRPDGTTCHYNSRGQGTLVTVSS
Selected Chain(s)	H
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 H 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                                          (00:00:35)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:35)

• Minimal score value: -3.0191
• Maximal score value: 1.6991
• Average score: -0.859
• Total score value: -103.9441

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	-1.9887
2	V	H	-1.4975
3	Q	H	-1.6658
4	L	H	0.0000
5	L	H	0.3735
6	E	H	0.0000
7	S	H	-0.3059
8	G	H	-0.8411
9	G	H	0.0760
11	G	H	0.7687
12	L	H	1.5422
13	V	H	0.0574
14	Q	H	-1.3464
15	P	H	-1.8317
16	G	H	-1.4761
17	G	H	-0.9270
18	S	H	-1.2363
19	L	H	-0.8875
20	R	H	-2.0935
21	L	H	0.0000
22	S	H	0.0000
23	C	H	0.0000
24	A	H	-0.4025
25	A	H	0.0000
26	S	H	-1.1023
27	G	H	-1.1326
28	Y	H	-1.0191
29	T	H	-1.2171
30	N	H	-2.3141
35	R	H	-2.6940
36	L	H	-1.5691
37	K	H	-1.5154
38	C	H	-0.7069
39	M	H	0.0000
40	G	H	0.0000
41	W	H	0.0000
42	F	H	-0.2756
43	R	H	0.0000
44	Q	H	-1.1615
45	A	H	-1.1465
46	P	H	-1.0319
47	G	H	-1.5933
48	K	H	-2.5603
49	E	H	-3.0191
50	R	H	-2.1554
51	E	H	-1.4559
53	L	H	0.0024
54	V	H	0.0000
55	S	H	0.0000
56	I	H	0.4413
57	S	H	0.0000
58	T	H	-0.7497
59	G	H	-1.4971
62	T	H	-0.9766
63	G	H	-1.3165
64	N	H	-1.3715
65	T	H	-0.2408
66	Y	H	0.4846
67	Y	H	-0.3608
68	A	H	-0.9703
69	D	H	-2.3790
70	S	H	-1.8373
71	V	H	0.0000
72	K	H	-2.4999
74	G	H	-1.7975
75	R	H	-1.8462
76	F	H	0.0000
77	T	H	-0.7452
78	I	H	0.0000
79	S	H	-0.5992
80	R	H	-1.5193
81	D	H	-2.1596
82	N	H	-2.6618
83	S	H	-2.0875
84	K	H	-2.8606
85	N	H	-2.3902
86	T	H	-1.3794
87	L	H	0.0000
88	Y	H	-0.5298
89	L	H	0.0000
90	Q	H	-1.3104
91	M	H	0.0000
92	N	H	-1.4457
93	S	H	-1.3677
94	L	H	0.0000
95	K	H	-2.6296
96	A	H	-1.8879
97	E	H	-2.3418
98	D	H	0.0000
99	T	H	-0.3908
100	A	H	0.0000
101	V	H	0.8473
102	Y	H	0.0000
103	Y	H	-0.2022
104	C	H	0.0000
105	A	H	0.0000
106	A	H	0.0000
107	D	H	0.0000
108	V	H	-1.4286
109	R	H	-2.6919
110	P	H	-1.9780
111	D	H	-2.4276
111A	G	H	-1.5289
112A	T	H	-1.0881
112	T	H	-0.7413
113	C	H	-0.3044
114	H	H	-0.8142
115	Y	H	-0.9179
116	N	H	-1.6636
117	S	H	0.0000
118	R	H	-2.0511
119	G	H	0.0000
120	Q	H	-1.2500
121	G	H	-0.1904
122	T	H	0.6071
123	L	H	1.6991
124	V	H	0.0000
125	T	H	0.3623
126	V	H	0.0000
127	S	H	-0.6895
128	S	H	-0.9185