Project name: 524

Chain sequence(s)	H: EVQLLESGGGLVQPGGSLRLSCAASGYTNRLKCMGWFRQAPGKERELASISTGTGNTYYADSVKGRFTISRDNSKNTLYLQMNSLKAEDTAVYYCAADVRPDGTTCHYNSRGQGTLVTVSS
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                                          (00:02:16)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:17)

• Minimal score value: -4.2255
• Maximal score value: 1.6705
• Average score: -1.0595
• Total score value: -128.1951

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	-1.9837
2	V	H	-1.5595
3	Q	H	-1.6095
4	L	H	0.0000
5	L	H	0.6769
6	E	H	0.0209
7	S	H	-0.3570
8	G	H	-0.7020
9	G	H	0.0727
11	G	H	0.7558
12	L	H	1.4264
13	V	H	-0.0581
14	Q	H	-1.3660
15	P	H	-1.5347
16	G	H	-1.6036
17	G	H	-1.0641
18	S	H	-1.2786
19	L	H	-1.1460
20	R	H	-2.3583
21	L	H	0.0000
22	S	H	-0.5286
23	C	H	0.0000
24	A	H	-0.3782
25	A	H	0.0000
26	S	H	-1.0549
27	G	H	-1.0941
28	Y	H	-1.0753
29	T	H	-1.4066
30	N	H	-2.7536
35	R	H	-3.0983
36	L	H	-1.7930
37	K	H	-1.7024
38	C	H	-0.9018
39	M	H	0.0000
40	G	H	0.0000
41	W	H	0.0000
42	F	H	-0.9373
43	R	H	-1.3441
44	Q	H	-2.2909
45	A	H	-1.7404
46	P	H	-1.5156
47	G	H	-2.0445
48	K	H	-3.7954
49	E	H	-4.2255
50	R	H	-3.7765
51	E	H	-2.2405
53	L	H	-0.3364
54	A	H	0.0000
55	S	H	0.0000
56	I	H	0.0000
57	S	H	-0.7988
58	T	H	-1.4727
59	G	H	-1.2762
62	T	H	-0.8879
63	G	H	-1.2413
64	N	H	-1.3520
65	T	H	-0.1024
66	Y	H	0.6803
67	Y	H	-0.2315
68	A	H	-1.0034
69	D	H	-2.3155
70	S	H	-1.8829
71	V	H	0.0000
72	K	H	-2.4373
74	G	H	-1.8270
75	R	H	-1.8255
76	F	H	0.0000
77	T	H	-0.9915
78	I	H	0.0000
79	S	H	-0.8528
80	R	H	-1.7428
81	D	H	-2.2779
82	N	H	-2.7521
83	S	H	-2.1297
84	K	H	-2.8975
85	N	H	-2.5798
86	T	H	-1.4559
87	L	H	0.0000
88	Y	H	-0.8379
89	L	H	0.0000
90	Q	H	-1.8542
91	M	H	0.0000
92	N	H	-2.2170
93	S	H	-1.6154
94	L	H	0.0000
95	K	H	-2.6032
96	A	H	-1.8309
97	E	H	-2.3165
98	D	H	0.0000
99	T	H	-0.4487
100	A	H	0.0000
101	V	H	0.3835
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	A	H	0.0000
107	D	H	0.0000
108	V	H	0.0000
109	R	H	-3.6899
110	P	H	-3.0753
111	D	H	-2.9076
111A	G	H	-1.4128
112A	T	H	-1.0614
112	T	H	-1.3118
113	C	H	-0.7185
114	H	H	-2.3281
115	Y	H	-1.7151
116	N	H	-2.2544
117	S	H	-1.9372
118	R	H	-2.0570
119	G	H	0.0000
120	Q	H	-1.4343
121	G	H	-0.3714
122	T	H	0.4024
123	L	H	1.6705
124	V	H	0.0000
125	T	H	0.3560
126	V	H	0.0000
127	S	H	-0.7929
128	S	H	-0.8596