Project name: 2.P2D11-1.pdb

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

• Minimal score value: -3.1402
• Maximal score value: 1.5357
• Average score: -0.6019
• Total score value: -76.4468

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	-1.8268
2	V	H	0.0000
3	Q	H	-1.3083
4	L	H	0.0000
5	V	H	0.9634
6	E	H	0.0000
7	S	H	-0.4324
8	G	H	-0.8870
9	G	H	-0.4726
11	G	H	0.1485
12	L	H	1.1718
13	V	H	0.0918
14	Q	H	-1.2401
15	A	H	-1.4874
16	G	H	-1.3622
17	G	H	-0.8995
18	S	H	-1.0050
19	L	H	-0.4549
20	R	H	-1.2694
21	L	H	0.0000
22	S	H	-0.1813
23	C	H	0.0000
24	A	H	-0.2702
25	A	H	0.0000
26	S	H	-1.4473
27	G	H	-1.9971
28	R	H	-2.0329
29	L	H	-0.9162
30	F	H	0.0000
35	L	H	0.6459
36	T	H	0.5028
37	Y	H	0.0000
38	A	H	0.3003
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	-1.5022
45	A	H	-1.5933
46	P	H	-1.2765
47	G	H	-1.8441
48	K	H	-3.0390
49	E	H	-3.1402
50	R	H	-2.0030
51	E	H	-1.3345
52	F	H	-0.2395
53	V	H	0.0000
54	T	H	0.0000
55	G	H	0.1211
56	I	H	0.0000
57	S	H	-0.2599
58	W	H	0.3002
59	S	H	-0.4856
62	G	H	-1.1364
63	D	H	-2.1289
64	N	H	-1.3249
65	T	H	-0.1814
66	Y	H	0.4379
67	Y	H	-0.3944
68	A	H	-1.1192
69	D	H	-2.4237
70	S	H	-1.7914
71	V	H	0.0000
72	K	H	-2.4982
74	G	H	-1.8007
75	R	H	-1.7167
76	F	H	0.0000
77	T	H	-0.5890
78	I	H	0.0000
79	S	H	-0.5574
80	R	H	-0.8089
81	D	H	-1.1406
82	N	H	-0.8827
83	A	H	-1.0786
84	K	H	-2.2157
85	N	H	-1.5040
86	T	H	-0.7982
87	V	H	0.0000
88	Y	H	-0.3034
89	L	H	0.0000
90	Q	H	-0.8541
91	M	H	0.0000
92	N	H	-1.2695
93	S	H	-1.2470
94	L	H	0.0000
95	K	H	-2.5273
96	P	H	-1.9497
97	E	H	-2.3861
98	D	H	0.0000
99	T	H	-0.7995
100	A	H	0.0000
101	V	H	-0.1341
102	Y	H	0.0000
103	Y	H	0.0574
104	C	H	0.0000
105	A	H	0.0000
106	A	H	0.0000
107	H	H	0.0000
108	Q	H	-0.5280
109	G	H	-0.1046
110	L	H	1.1452
111	L	H	0.1814
111A	H	H	-0.5996
111B	G	H	-0.6774
111C	T	H	-1.0688
112D	R	H	-1.6120
112C	W	H	-0.4858
112B	S	H	-0.1953
112A	S	H	0.2101
112	P	H	0.5198
113	F	H	1.5357
114	E	H	0.1992
115	Y	H	0.0000
116	N	H	-1.0208
117	Y	H	-0.7065
118	W	H	-0.0442
119	G	H	-0.1141
120	Q	H	-0.8498
121	G	H	-0.3443
122	T	H	-0.4541
123	Q	H	-0.5034
124	V	H	0.0000
125	T	H	-0.1856
126	V	H	0.0000
127	S	H	-0.8085
128	S	H	-0.9064