Project name: gp63_002

Chain sequence(s)	H: QVQLVESGGGLVQPGGSLRLSCAASGLSGRPFSDYSLGWFRQAPGQGLEAVAAINGQGGETYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCAARYSRDLQLPAPENYQYWGQGTLVTVS
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]                                                (00:00:08)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:08)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with H chain(s) selected             (00:00:08)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:08)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:08)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:01:56)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:57)

• Minimal score value: -3.2165
• Maximal score value: 1.6132
• Average score: -0.7738
• Total score value: -98.2721

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	-1.6367
2	V	H	0.0000
3	Q	H	-1.1909
4	L	H	0.0000
5	V	H	0.8759
6	E	H	0.0000
7	S	H	-0.2576
8	G	H	-0.6129
9	G	H	0.1471
10	G	H	0.7003
11	L	H	1.4087
12	V	H	-0.0405
13	Q	H	-1.4124
14	P	H	-1.8682
15	G	H	-1.6831
16	G	H	-1.1884
17	S	H	-1.4212
18	L	H	-1.0440
19	R	H	-2.3229
20	L	H	0.0000
21	S	H	-0.4934
22	C	H	0.0000
23	A	H	-0.2023
24	A	H	0.0000
25	S	H	-0.8762
26	G	H	-1.4973
27	L	H	0.0000
28	S	H	-1.1928
29	G	H	-1.2161
30	R	H	-1.3902
31	P	H	-1.0430
32	F	H	0.0000
33	S	H	-1.2658
34	D	H	0.0000
35	Y	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	-0.6346
42	Q	H	-1.0216
43	A	H	-1.1649
44	P	H	-0.9383
45	G	H	-1.3121
46	Q	H	-1.9833
47	G	H	-1.4796
48	L	H	-0.9484
49	E	H	-1.7184
50	A	H	-0.4598
51	V	H	0.0000
52	A	H	0.0000
53	A	H	0.0000
54	I	H	0.0000
55	N	H	0.0000
56	G	H	0.0000
57	Q	H	-2.5519
58	G	H	-2.1680
59	G	H	-2.0365
60	E	H	-2.4785
61	T	H	-0.7302
62	Y	H	0.2563
63	Y	H	-0.5080
64	A	H	-1.4083
65	D	H	-2.4267
66	S	H	-1.8780
67	V	H	0.0000
68	K	H	-2.5491
69	G	H	-1.9091
70	R	H	-1.8875
71	F	H	0.0000
72	T	H	-1.0226
73	I	H	0.0000
74	S	H	-0.8551
75	R	H	0.0000
76	D	H	-1.8502
77	N	H	-1.9042
78	S	H	-1.6493
79	K	H	-2.3588
80	N	H	-1.7069
81	T	H	-1.0102
82	L	H	0.0000
83	Y	H	0.0000
84	L	H	0.0000
85	Q	H	-1.7378
86	M	H	0.0000
87	N	H	-2.2071
88	S	H	-1.7040
89	L	H	0.0000
90	R	H	-3.0112
91	A	H	-2.0429
92	E	H	-2.4668
93	D	H	0.0000
94	T	H	-0.5447
95	A	H	0.0000
96	V	H	0.7288
97	Y	H	0.0000
98	Y	H	0.2025
99	C	H	0.0000
100	A	H	0.0000
101	A	H	0.0000
102	R	H	-1.1852
103	Y	H	-0.1520
104	S	H	-1.3003
105	R	H	-3.0308
106	D	H	-3.2165
107	L	H	-1.9406
108	Q	H	-1.2558
109	L	H	0.5609
110	P	H	0.0726
111	A	H	-0.6681
112	P	H	-1.1805
113	E	H	-2.1101
114	N	H	-1.5508
115	Y	H	0.0000
116	Q	H	-1.4492
117	Y	H	-0.5926
118	W	H	-0.1075
119	G	H	-0.1162
120	Q	H	-0.8347
121	G	H	0.0000
122	T	H	0.5760
123	L	H	1.6132
124	V	H	0.0000
125	T	H	0.2804
126	V	H	0.0000
127	S	H	-0.8834