Project name: 1063

Chain sequence(s)	H: DVQLQESGGGSVQAGGSLRLSCAASTYTYSRACMGWFRQAPGTEREGVAVIDRSGSTSYADSVKGRFTISKDSAKNTLYLQMNSLKPEDTAMYFCAAGPWEGPYCRRRSRDDFAYWGQGTQVTVSS
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                                          (00:01:26)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:27)

• Minimal score value: -3.1071
• Maximal score value: 0.7136
• Average score: -0.9955
• Total score value: -125.4269

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	D	H	-1.7906
2	V	H	-0.8666
3	Q	H	-1.6252
4	L	H	-1.2620
5	Q	H	-1.7714
6	E	H	-1.2839
7	S	H	-1.3440
8	G	H	-1.2214
9	G	H	-1.2040
11	G	H	-0.8860
12	S	H	-0.6955
13	V	H	-0.7907
14	Q	H	-1.6515
15	A	H	-1.7778
16	G	H	-1.4770
17	G	H	-1.1729
18	S	H	-1.4987
19	L	H	-1.3509
20	R	H	-2.3793
21	L	H	0.0000
22	S	H	-0.9762
23	C	H	0.0000
24	A	H	-1.0660
25	A	H	-0.6546
26	S	H	-0.7289
27	T	H	-0.0790
28	Y	H	0.7136
29	T	H	0.3647
30	Y	H	-0.5054
35	S	H	-1.1632
36	R	H	-2.2109
37	A	H	0.0000
38	C	H	-0.7543
39	M	H	0.0000
40	G	H	0.0000
41	W	H	0.0000
42	F	H	0.0000
43	R	H	0.0000
44	Q	H	-1.2161
45	A	H	-1.1868
46	P	H	-0.9026
47	G	H	-1.1219
48	T	H	-1.5392
49	E	H	-2.3865
50	R	H	-1.8417
51	E	H	-1.3681
52	G	H	-1.3515
53	V	H	0.0000
54	A	H	0.0000
55	V	H	-0.4555
56	I	H	0.0000
57	D	H	0.0000
58	R	H	-1.5898
59	S	H	-0.6587
63	G	H	-0.6520
64	S	H	-0.2719
65	T	H	-0.2385
66	S	H	-1.0949
67	Y	H	-1.5348
68	A	H	-1.7698
69	D	H	-2.5213
70	S	H	-1.9049
71	V	H	0.0000
72	K	H	-2.6784
74	G	H	-1.8621
75	R	H	-1.7149
76	F	H	0.0000
77	T	H	-1.0905
78	I	H	0.0000
79	S	H	-0.5182
80	K	H	-1.0264
81	D	H	-1.3400
82	S	H	-1.2195
83	A	H	-0.9959
84	K	H	-1.8918
85	N	H	-1.0019
86	T	H	0.0000
87	L	H	0.0000
88	Y	H	-0.6994
89	L	H	0.0000
90	Q	H	-1.8260
91	M	H	0.0000
92	N	H	-2.1570
93	S	H	-1.5071
94	L	H	0.0000
95	K	H	-2.4123
96	P	H	-1.8678
97	E	H	-2.3165
98	D	H	0.0000
99	T	H	-1.1240
100	A	H	0.0000
101	M	H	-0.5587
102	Y	H	0.0000
103	F	H	-0.3980
104	C	H	0.0000
105	A	H	0.0000
106	A	H	0.1681
107	G	H	0.0000
108	P	H	-1.2045
109	W	H	-1.5018
110	E	H	-2.0504
111	G	H	-1.2835
111A	P	H	-0.9320
111B	Y	H	0.1288
111C	C	H	0.0000
112D	R	H	-2.3975
112C	R	H	-3.1071
112B	R	H	-2.6627
112A	S	H	-2.4476
112	R	H	-2.5145
113	D	H	-2.9739
114	D	H	-3.0815
115	F	H	-1.3626
116	A	H	-0.3378
117	Y	H	0.4479
118	W	H	0.0159
119	G	H	-0.8874
120	Q	H	-1.6587
121	G	H	-1.0659
122	T	H	-1.1753
123	Q	H	-1.4753
124	V	H	0.0000
125	T	H	-1.0119
126	V	H	0.0000
127	S	H	-1.2399
128	S	H	-0.8933