Project name: gp63_004

Chain sequence(s)	H: QVQLVESGGGLVQPGGSLRLSCAASGLGGKSFSEYSLGWFRQAPGQGLEAVAAISGDGSTTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCAAELGTSLAPPEASSYTYWGQGTLVTVS
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                                          (00:01:52)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:53)

• Minimal score value: -2.9536
• Maximal score value: 1.7774
• Average score: -0.6377
• Total score value: -80.9847

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	-1.6508
2	V	H	0.0000
3	Q	H	-1.1494
4	L	H	0.0000
5	V	H	0.9101
6	E	H	0.0000
7	S	H	-0.2689
8	G	H	-0.6309
9	G	H	0.1719
10	G	H	0.7295
11	L	H	1.4282
12	V	H	-0.0811
13	Q	H	-1.4151
14	P	H	-1.8000
15	G	H	-1.5702
16	G	H	-1.0565
17	S	H	-1.3321
18	L	H	-0.8745
19	R	H	-2.1723
20	L	H	0.0000
21	S	H	-0.5161
22	C	H	0.0000
23	A	H	-0.2180
24	A	H	0.0000
25	S	H	-0.8245
26	G	H	-1.4537
27	L	H	-1.5168
28	G	H	-1.4649
29	G	H	-1.3573
30	K	H	-1.8770
31	S	H	-1.3978
32	F	H	0.0000
33	S	H	-1.8025
34	E	H	-1.8726
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	-0.5804
42	Q	H	-0.9522
43	A	H	-1.1127
44	P	H	-0.9913
45	G	H	-1.2801
46	Q	H	-1.9548
47	G	H	-1.4005
48	L	H	-0.9337
49	E	H	-1.9854
50	A	H	-1.0351
51	V	H	0.0000
52	A	H	0.0000
53	A	H	0.0000
54	I	H	0.0000
55	S	H	0.0000
56	G	H	0.0000
57	D	H	-2.4093
58	G	H	-1.4421
59	S	H	-0.9090
60	T	H	-0.1089
61	T	H	0.4627
62	Y	H	1.0119
63	Y	H	-0.2824
64	A	H	-1.3065
65	D	H	-2.3917
66	S	H	-1.8697
67	V	H	0.0000
68	K	H	-2.4996
69	G	H	-1.8362
70	R	H	-1.6802
71	F	H	0.0000
72	T	H	-0.7933
73	I	H	0.0000
74	S	H	-0.5682
75	R	H	-1.4318
76	D	H	-2.1219
77	N	H	-2.2840
78	S	H	-1.7155
79	K	H	-2.4442
80	N	H	-1.8011
81	T	H	-1.1270
82	L	H	0.0000
83	Y	H	0.0000
84	L	H	0.0000
85	Q	H	-1.3450
86	M	H	0.0000
87	N	H	-1.6236
88	S	H	-1.4578
89	L	H	0.0000
90	R	H	-2.9536
91	A	H	-2.0490
92	E	H	-2.4798
93	D	H	0.0000
94	T	H	-0.5363
95	A	H	0.0000
96	V	H	0.8870
97	Y	H	0.0000
98	Y	H	0.2480
99	C	H	0.0000
100	A	H	0.0000
101	A	H	0.0000
102	E	H	-0.2437
103	L	H	-0.1664
104	G	H	-0.1940
105	T	H	-0.2003
106	S	H	0.4791
107	L	H	1.5408
108	A	H	0.4846
109	P	H	-0.1091
110	P	H	-0.8147
111	E	H	-2.1324
112	A	H	-1.2001
113	S	H	-0.9063
114	S	H	-0.6259
115	Y	H	0.0000
116	T	H	0.0816
117	Y	H	-0.0072
118	W	H	0.2142
119	G	H	-0.0997
120	Q	H	-0.8199
121	G	H	0.0000
122	T	H	0.6564
123	L	H	1.7774
124	V	H	0.0000
125	T	H	0.3193
126	V	H	0.0000
127	S	H	-0.8708