Project name: 4.P2A10-1.pdb

Chain sequence(s)	H: EVQLVESGGGLVQAGGSLRLSCTASGITASYYDMGWYRQAPGKQREVVAIITAGGGITDYADSVKGRFTISRDIAKNTVYLHVNSLKPEDTAVYYCNLRSSKLFWGQGTQVTVSS
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                                          (00:01:05)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:06)

• Minimal score value: -2.7047
• Maximal score value: 1.3403
• Average score: -0.611
• Total score value: -70.2647

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	E	H	-2.1017
2	V	H	-1.1322
3	Q	H	-1.1986
4	L	H	0.0000
5	V	H	1.0998
6	E	H	0.1936
7	S	H	-0.4789
8	G	H	-1.0052
9	G	H	-0.5234
11	G	H	0.1551
12	L	H	1.1631
13	V	H	0.0670
14	Q	H	-1.2764
15	A	H	-1.7672
16	G	H	-1.5372
17	G	H	-1.0865
18	S	H	-1.2655
19	L	H	-0.7512
20	R	H	-1.5472
21	L	H	0.0000
22	S	H	-0.2433
23	C	H	0.0000
24	T	H	-0.3588
25	A	H	0.0000
26	S	H	-1.0302
27	G	H	-1.3004
28	I	H	-0.3959
29	T	H	0.1498
30	A	H	0.3461
35	S	H	0.5489
36	Y	H	1.1777
37	Y	H	0.3589
38	D	H	-0.2585
39	M	H	0.0000
40	G	H	0.0000
41	W	H	0.0000
42	Y	H	0.0000
43	R	H	0.0000
44	Q	H	-1.3846
45	A	H	-1.4573
46	P	H	-1.1298
47	G	H	-1.6202
48	K	H	-2.5683
49	Q	H	-2.5404
50	R	H	-1.7757
51	E	H	-1.0741
52	V	H	0.2239
53	V	H	0.0000
54	A	H	0.0000
55	I	H	0.2534
56	I	H	0.0000
57	T	H	0.2716
58	A	H	0.5214
59	G	H	-0.1020
62	G	H	0.0259
63	G	H	0.2534
64	I	H	1.3403
65	T	H	0.1676
66	D	H	-1.3086
67	Y	H	-1.4075
68	A	H	-1.4250
69	D	H	-2.6424
70	S	H	-1.7601
71	V	H	0.0000
72	K	H	-2.7047
74	G	H	-1.8084
75	R	H	-1.8543
76	F	H	0.0000
77	T	H	-1.0588
78	I	H	0.0000
79	S	H	-0.1351
80	R	H	-1.0288
81	D	H	-1.5783
82	I	H	-0.5242
83	A	H	-0.8340
84	K	H	-2.0508
85	N	H	-1.4367
86	T	H	0.0000
87	V	H	0.0000
88	Y	H	-0.5637
89	L	H	0.0000
90	H	H	-1.2975
91	V	H	0.0000
92	N	H	-2.1591
93	S	H	-1.6531
94	L	H	0.0000
95	K	H	-2.6791
96	P	H	-1.9814
97	E	H	-2.4142
98	D	H	0.0000
99	T	H	-0.8082
100	A	H	0.0000
101	V	H	-0.1720
102	Y	H	0.0000
103	Y	H	0.0504
104	C	H	0.0000
105	N	H	0.0000
106	L	H	0.0000
107	R	H	-1.1453
108	S	H	-0.8969
114	S	H	-1.1966
115	K	H	-1.6187
116	L	H	-0.1390
117	F	H	0.0563
118	W	H	0.5433
119	G	H	0.0087
120	Q	H	-0.7542
121	G	H	-0.3645
122	T	H	-0.5007
123	Q	H	-0.5119
124	V	H	0.0000
125	T	H	-0.1544
126	V	H	0.0000
127	S	H	-0.8579
128	S	H	-0.9041