Project name: gp63_004

Chain sequence(s)	H: QVQLVESGGGLVQPGGSLRLSCAASGDSTFDFSKLSLGWFRQAPGQGLEAVAAIDSDGTKTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCAARYSRNIPSLVPSSFEYWGQGTLVTVS
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with H chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:02:15)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:16)

• Minimal score value: -3.0223
• Maximal score value: 1.8318
• Average score: -0.7073
• Total score value: -89.8322

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	Q	H	-2.0331
2	V	H	0.0000
3	Q	H	-1.4434
4	L	H	0.0000
5	V	H	1.1431
6	E	H	0.0000
7	S	H	-0.2129
8	G	H	-0.8117
9	G	H	0.0970
10	G	H	0.6773
11	L	H	1.4327
12	V	H	-0.0885
13	Q	H	-1.4073
14	P	H	-1.8547
15	G	H	-1.6875
16	G	H	-1.2063
17	S	H	-1.6408
18	L	H	-1.1262
19	R	H	-2.4033
20	L	H	0.0000
21	S	H	-0.4875
22	C	H	0.0000
23	A	H	-0.1247
24	A	H	0.0000
25	S	H	-1.4320
26	G	H	-2.1905
27	D	H	-2.5989
28	S	H	-1.4511
29	T	H	-1.0936
30	F	H	-1.6123
31	D	H	-1.8184
32	F	H	0.0000
33	S	H	-2.3244
34	K	H	-2.9909
35	L	H	0.0000
36	S	H	0.0000
37	L	H	0.0000
38	G	H	0.0000
39	W	H	0.0000
40	F	H	0.0000
41	R	H	0.0000
42	Q	H	-0.7329
43	A	H	-1.0010
44	P	H	-0.9276
45	G	H	-1.2986
46	Q	H	-1.8336
47	G	H	-1.2104
48	L	H	-0.2470
49	E	H	-0.5682
50	A	H	0.1715
51	V	H	0.0000
52	A	H	0.0000
53	A	H	0.0000
54	I	H	0.0000
55	D	H	0.0000
56	S	H	-2.2915
57	D	H	-2.8818
58	G	H	-1.7654
59	T	H	-1.4554
60	K	H	-1.5557
61	T	H	0.0849
62	Y	H	0.8893
63	Y	H	-0.1422
64	A	H	-1.0435
65	D	H	-2.3241
66	S	H	-1.8262
67	V	H	0.0000
68	K	H	-2.4718
69	G	H	-1.9214
70	R	H	-1.9646
71	F	H	0.0000
72	T	H	-1.0263
73	I	H	0.0000
74	S	H	-0.9356
75	R	H	-1.3930
76	D	H	-2.0304
77	N	H	-2.3183
78	S	H	-1.6214
79	K	H	-2.3846
80	N	H	-1.8433
81	T	H	-1.0239
82	L	H	0.0000
83	Y	H	0.0000
84	L	H	0.0000
85	Q	H	-1.8268
86	M	H	0.0000
87	N	H	-2.3437
88	S	H	-1.7490
89	L	H	0.0000
90	R	H	-3.0223
91	A	H	-2.0461
92	E	H	-2.4560
93	D	H	0.0000
94	T	H	-0.5484
95	A	H	0.0000
96	V	H	0.7437
97	Y	H	0.0000
98	Y	H	0.3381
99	C	H	0.0000
100	A	H	0.0000
101	A	H	0.0000
102	R	H	-1.3170
103	Y	H	-1.0088
104	S	H	-1.3046
105	R	H	-2.4456
106	N	H	-1.7620
107	I	H	0.5680
108	P	H	0.5937
109	S	H	1.2819
110	L	H	1.6514
111	V	H	1.8318
112	P	H	0.6089
113	S	H	-0.0207
114	S	H	-0.0056
115	F	H	0.0000
116	E	H	-1.7454
117	Y	H	-0.9814
118	W	H	-0.2388
119	G	H	-0.0755
120	Q	H	-0.6823
121	G	H	0.1043
122	T	H	0.6182
123	L	H	1.5780
124	V	H	0.0000
125	T	H	0.2856
126	V	H	0.0000
127	S	H	-0.8719