Project name: 1064

Chain sequence(s)	H: DVQLQESGGGLVQPGGSLRLSCAASGVTDSNGCMGWFRQAPGKERERVASIDSDGQTLYADSVKGRFTISQDNTENTLYLQMNTLKPEDTATYYCAAGATSQPGFSCRILGPGWYTYWGQGTQVTVSS
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                                          (00:00:40)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:40)

• Minimal score value: -2.9369
• Maximal score value: 1.3296
• Average score: -0.7728
• Total score value: -98.9129

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	-2.1241
2	V	H	0.0000
3	Q	H	-1.8964
4	L	H	0.0000
5	Q	H	-1.7288
6	E	H	0.0000
7	S	H	-1.0171
8	G	H	-0.8765
9	G	H	-0.5883
11	G	H	0.2084
12	L	H	1.1045
13	V	H	-0.0463
14	Q	H	-1.4080
15	P	H	-1.8509
16	G	H	-1.4371
17	G	H	-0.9383
18	S	H	-1.0070
19	L	H	-0.4493
20	R	H	-1.1907
21	L	H	0.0000
22	S	H	-0.6519
23	C	H	0.0000
24	A	H	-1.1914
25	A	H	-1.2652
26	S	H	-1.4656
27	G	H	-1.4879
28	V	H	-1.2244
29	T	H	-1.3297
30	D	H	-2.0572
35	S	H	-1.6416
36	N	H	-1.4134
37	G	H	-1.0450
38	C	H	-0.7819
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	-1.7387
45	A	H	-1.6130
46	P	H	-1.1003
47	G	H	-1.4619
48	K	H	-2.4019
49	E	H	-2.9369
50	R	H	-2.0075
51	E	H	-1.1760
52	R	H	0.0000
53	V	H	0.0000
54	A	H	0.0000
55	S	H	0.0000
56	I	H	0.0000
57	D	H	-1.4105
58	S	H	-2.0300
59	D	H	-2.6475
63	G	H	-1.8958
64	Q	H	-1.7692
65	T	H	-0.5000
66	L	H	0.4858
67	Y	H	-0.2467
68	A	H	-0.9081
69	D	H	-2.3539
70	S	H	-1.7334
71	V	H	0.0000
72	K	H	-2.4710
74	G	H	-1.7556
75	R	H	-1.5235
76	F	H	0.0000
77	T	H	-0.6208
78	I	H	0.0000
79	S	H	-0.7499
80	Q	H	-1.8467
81	D	H	-2.4542
82	N	H	-2.6527
83	T	H	-2.0398
84	E	H	-2.8674
85	N	H	-2.3434
86	T	H	0.0000
87	L	H	0.0000
88	Y	H	-0.4981
89	L	H	0.0000
90	Q	H	-0.8384
91	M	H	0.0000
92	N	H	-1.2235
93	T	H	-1.2137
94	L	H	0.0000
95	K	H	-2.6781
96	P	H	-2.1038
97	E	H	-2.4632
98	D	H	0.0000
99	T	H	-1.0162
100	A	H	0.0000
101	T	H	-0.8126
102	Y	H	0.0000
103	Y	H	-0.4993
104	C	H	0.0000
105	A	H	0.0000
106	A	H	0.0000
107	G	H	0.1864
108	A	H	-0.6388
109	T	H	-0.0403
110	S	H	-0.2962
111	Q	H	-0.2858
111A	P	H	-0.3165
111B	G	H	-0.0889
111C	F	H	1.2732
111D	S	H	0.4828
112E	C	H	0.4167
112D	R	H	0.2130
112C	I	H	0.0000
112B	L	H	1.3296
112A	G	H	0.4366
112	P	H	0.1082
113	G	H	0.0681
114	W	H	1.0004
115	Y	H	0.0000
116	T	H	0.0862
117	Y	H	-0.0583
118	W	H	-0.2369
119	G	H	-1.0237
120	Q	H	-1.4895
121	G	H	-1.0206
122	T	H	-1.0401
123	Q	H	-0.9788
124	V	H	0.0000
125	T	H	-0.3500
126	V	H	0.0000
127	S	H	-0.9403
128	S	H	-0.7909