Project name: 1291

Chain sequence(s)	H: DVQLQESGGGSVQAGGSLRLSCAASTYTYSRACMGWFRQAPGTEREGVAVIDRSGSTSYADSVKGRFTISKDSAKNTLYLQMNSLKPEDTAMYFCAAGPWEGPYCRRRSRDDFAYWGQGTQVTVSS
Selected Chain(s)	H
Distance of aggregation	10 Å
FoldX usage	No
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]       runJob:   FoldX not utilized. Treating input pdb file as it was already optimized.    (00:00:00)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:00)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:01)

• Minimal score value: -3.6579
• Maximal score value: 0.7346
• Average score: -0.9617
• Total score value: -121.1709

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	-1.9251
2	V	H	-1.1172
3	Q	H	-1.7939
4	L	H	0.0000
5	Q	H	-1.7357
6	E	H	0.0000
7	S	H	-1.1587
8	G	H	-1.1064
9	G	H	-1.0091
11	G	H	-0.7364
12	S	H	-0.6034
13	V	H	-0.7773
14	Q	H	-1.6469
15	A	H	-1.7191
16	G	H	-1.3988
17	G	H	-1.0982
18	S	H	-1.2478
19	L	H	-1.1231
20	R	H	-2.1141
21	L	H	0.0000
22	S	H	-0.8382
23	C	H	0.0000
24	A	H	-1.0225
25	A	H	-0.6894
26	S	H	-0.8094
27	T	H	-0.1331
28	Y	H	0.7346
29	T	H	0.3199
30	Y	H	-0.4455
35	S	H	-1.0384
36	R	H	-2.0404
37	A	H	-1.0224
38	C	H	-0.6815
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	-1.3361
45	A	H	-1.2280
46	P	H	-0.9484
47	G	H	-1.1537
48	T	H	-1.5933
49	E	H	-2.4762
50	R	H	-2.1620
51	E	H	-1.6421
52	G	H	-1.6119
53	V	H	0.0000
54	A	H	0.0000
55	V	H	-0.4800
56	I	H	0.0000
57	D	H	0.0000
58	R	H	-1.3137
59	S	H	-0.5695
63	G	H	-0.5930
64	S	H	-0.2802
65	T	H	-0.2281
66	S	H	-1.1047
67	Y	H	-1.4486
68	A	H	-1.7289
69	D	H	-2.4794
70	S	H	-1.8314
71	V	H	0.0000
72	K	H	-2.6036
74	G	H	-1.7099
75	R	H	-1.3122
76	F	H	0.0000
77	T	H	-0.7987
78	I	H	0.0000
79	S	H	-0.4719
80	K	H	-1.0620
81	D	H	-1.4113
82	S	H	-1.2101
83	A	H	-1.0171
84	K	H	-1.9026
85	N	H	-0.9857
86	T	H	0.0000
87	L	H	0.0000
88	Y	H	-0.5473
89	L	H	0.0000
90	Q	H	-1.1891
91	M	H	0.0000
92	N	H	-1.4764
93	S	H	-1.2502
94	L	H	0.0000
95	K	H	-2.3533
96	P	H	-1.8823
97	E	H	-2.3193
98	D	H	0.0000
99	T	H	-1.0617
100	A	H	0.0000
101	M	H	-0.4005
102	Y	H	0.0000
103	F	H	-0.2859
104	C	H	0.0000
105	A	H	0.0000
106	A	H	0.1311
107	G	H	0.0000
108	P	H	-1.1102
109	W	H	-1.3462
110	E	H	-1.6709
111	G	H	-1.0606
111A	P	H	-0.8550
111B	Y	H	0.1614
111C	C	H	0.0000
112D	R	H	-2.4279
112C	R	H	-3.3240
112B	R	H	-3.1857
112A	S	H	-3.2614
112	R	H	-3.6579
113	D	H	-3.5326
114	D	H	-3.4955
115	F	H	-1.7279
116	A	H	-0.4715
117	Y	H	0.4744
118	W	H	-0.1004
119	G	H	0.0000
120	Q	H	-1.5672
121	G	H	-0.9136
122	T	H	-0.8656
123	Q	H	-1.0042
124	V	H	0.0000
125	T	H	-0.8810
126	V	H	0.0000
127	S	H	-1.1788
128	S	H	-0.8619