Project name: c57f611504a66db [mutate: LV105H]

Chain sequence(s)	H: EVQLLESGGGLVQPGGSLRLSCAMSGHFFNLYIMAWFRQAPGKEREFVAGVSTSGRTSLYADSVKGRFTISRDNSKTTGYLQMNSLKSEDTAVYYCAARSSASELWVPSGDEYYAWWGQGTTVTVSS
Selected Chain(s)	H
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No
Mutated residues	LV105H
Energy difference between WT (input) and mutated protein (by FoldX)	0.444293 kcal/mol

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]       FoldX:    Building mutant model                                                       (00:00:26)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:28)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:54)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:55)

• Minimal score value: -3.7361
• Maximal score value: 1.6628
• Average score: -0.688
• Total score value: -87.3799

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	-2.3343
2	V	H	0.0000
3	Q	H	-1.3923
4	L	H	0.0000
5	L	H	0.8653
6	E	H	-0.0055
7	S	H	-0.4594
8	G	H	-1.0872
9	G	H	-0.4952
10	G	H	0.2269
11	L	H	1.1259
12	V	H	0.0000
13	Q	H	-1.4659
14	P	H	-1.7294
15	G	H	-1.4683
16	G	H	-0.9786
17	S	H	-1.2719
18	L	H	-0.9337
19	R	H	-2.1334
20	L	H	0.0000
21	S	H	-0.4624
22	C	H	0.0000
23	A	H	-0.0996
24	M	H	0.0000
25	S	H	-0.8043
26	G	H	-1.3056
27	H	H	-0.7024
28	F	H	0.8831
29	F	H	0.0000
30	N	H	-0.6009
31	L	H	0.7353
32	Y	H	0.5058
33	I	H	0.0000
34	M	H	0.0000
35	A	H	0.0000
36	W	H	0.0000
37	F	H	0.0000
38	R	H	-1.5658
39	Q	H	-2.2219
40	A	H	-1.9715
41	P	H	-1.4197
42	G	H	-1.9722
43	K	H	-3.4680
44	E	H	-3.7361
45	R	H	-3.2352
46	E	H	-3.2014
47	F	H	0.0000
48	V	H	0.0000
49	A	H	0.0000
50	G	H	0.0000
51	V	H	0.0000
52	S	H	0.0000
53	T	H	-0.4111
54	S	H	-0.8977
55	G	H	-1.7023
56	R	H	-1.9224
57	T	H	-0.5911
58	S	H	-0.2891
59	L	H	0.1380
60	Y	H	-0.7315
61	A	H	-1.5419
62	D	H	-2.4955
63	S	H	-1.8511
64	V	H	0.0000
65	K	H	-2.6142
66	G	H	-1.8032
67	R	H	-1.5571
68	F	H	0.0000
69	T	H	-0.8256
70	I	H	0.0000
71	S	H	-0.7957
72	R	H	-1.4619
73	D	H	-1.9447
74	N	H	-2.1559
75	S	H	-1.9375
76	K	H	-2.3695
77	T	H	-1.6905
78	T	H	0.0000
79	G	H	0.0000
80	Y	H	-0.6473
81	L	H	0.0000
82	Q	H	-1.2565
83	M	H	0.0000
84	N	H	-1.4023
85	S	H	-1.2691
86	L	H	0.0000
87	K	H	-2.4851
88	S	H	-2.0143
89	E	H	-2.3187
90	D	H	0.0000
91	T	H	-0.7810
92	A	H	0.0000
93	V	H	-0.0390
94	Y	H	0.0000
95	Y	H	-0.2873
96	C	H	0.0000
97	A	H	0.0000
98	A	H	0.0000
99	R	H	-0.0334
100	S	H	0.2092
101	S	H	0.3344
102	A	H	0.1954
103	S	H	0.0070
104	E	H	0.4535
105	V	H	1.6628	mutated: LV105H
106	W	H	1.5416
107	V	H	0.0000
108	P	H	0.0000
109	S	H	-0.5905
110	G	H	-1.3024
111	D	H	-1.9951
112	E	H	-1.9180
113	Y	H	-0.4249
114	Y	H	0.0000
115	A	H	-0.0597
116	W	H	0.1171
117	W	H	0.0244
118	G	H	-0.2762
119	Q	H	-0.9699
120	G	H	-0.4201
121	T	H	-0.2710
122	T	H	0.0682
123	V	H	0.0000
124	T	H	-0.1022
125	V	H	0.0000
126	S	H	-0.5654
127	S	H	-0.9328