Project name: dc28

Chain sequence(s)	H: DVQLQESGGGSVQAGGSLRLSCEASGNTYCVGWFRQGPGKEREGVAAIARLTGRALYDDSVKGRFTISQDNAKNTLYLQMNDLKPEDTAMYYCAADRCPAGTWLRADEYKYWGQGTQVTVSS
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                                          (00:01:08)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:09)

• Minimal score value: -3.2252
• Maximal score value: 1.0143
• Average score: -0.9784
• Total score value: -119.3626

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	-2.2726
2	V	H	0.0000
3	Q	H	-2.1252
4	L	H	0.0000
5	Q	H	-1.9538
6	E	H	0.0000
7	S	H	-1.0430
8	G	H	-0.9782
9	G	H	-0.8612
11	G	H	-0.6472
12	S	H	-0.5353
13	V	H	-0.6330
14	Q	H	-1.6679
15	A	H	-1.7796
16	G	H	-1.8536
17	G	H	-1.4155
18	S	H	-1.3382
19	L	H	-0.9023
20	R	H	-1.3920
21	L	H	0.0000
22	S	H	-0.9040
23	C	H	0.0000
24	E	H	-2.2233
25	A	H	0.0000
26	S	H	-1.8685
27	G	H	-1.7129
28	N	H	-1.7521
29	T	H	0.0000
37	Y	H	-0.1540
38	C	H	0.0000
39	V	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	-1.6985
45	G	H	-1.7615
46	P	H	-1.3063
47	G	H	-1.9242
48	K	H	-3.1570
49	E	H	-3.2252
50	R	H	-2.6020
51	E	H	-1.7705
52	G	H	-0.8800
53	V	H	0.0000
54	A	H	0.0000
55	A	H	0.0000
56	I	H	0.0000
57	A	H	0.0000
58	R	H	-0.0781
59	L	H	1.0143
62	T	H	-0.0872
63	G	H	-0.8254
64	R	H	-1.6443
65	A	H	-0.6806
66	L	H	-0.2554
67	Y	H	-0.7116
68	D	H	-1.7396
69	D	H	-2.7381
70	S	H	-2.0042
71	V	H	0.0000
72	K	H	-2.7365
74	G	H	-2.0337
75	R	H	-2.1607
76	F	H	0.0000
77	T	H	-0.6687
78	I	H	0.0000
79	S	H	-0.6774
80	Q	H	-1.2153
81	D	H	-1.7541
82	N	H	-2.1737
83	A	H	-1.5506
84	K	H	-2.4778
85	N	H	-2.3126
86	T	H	-1.6092
87	L	H	0.0000
88	Y	H	-0.5261
89	L	H	0.0000
90	Q	H	-0.8525
91	M	H	0.0000
92	N	H	-1.9819
93	D	H	-2.7125
94	L	H	0.0000
95	K	H	-2.2847
96	P	H	-1.6351
97	E	H	-2.1658
98	D	H	0.0000
99	T	H	-0.9160
100	A	H	0.0000
101	M	H	-0.3517
102	Y	H	0.0000
103	Y	H	-0.4184
104	C	H	0.0000
105	A	H	0.0000
106	A	H	0.0000
107	D	H	0.0000
108	R	H	-1.6862
109	C	H	-0.6246
110	P	H	-0.5464
111	A	H	-0.6227
111A	G	H	-0.3405
111B	T	H	-0.4529
112C	W	H	0.0356
112B	L	H	-0.7308
112A	R	H	-2.3734
112	A	H	-2.3824
113	D	H	-2.8094
114	E	H	-1.9230
115	Y	H	0.0000
116	K	H	-2.2266
117	Y	H	-1.1462
118	W	H	-0.6231
119	G	H	-1.0015
120	Q	H	-1.5049
121	G	H	-0.8927
122	T	H	-0.8221
123	Q	H	-0.7412
124	V	H	0.0000
125	T	H	-0.7591
126	V	H	0.0000
127	S	H	-1.0855
128	S	H	-0.7992