Project name: 2G2

Chain sequence(s)	H: QVQLQQSGAELARPGTSVKVSCKASGYAFTNYLIEWVKQRPGQGLEWIGVISPGSGIINYNEKFKGKATLTADKSSSTAYMQLSSLTSDDSAVYFCAAIDYSGPYAVDDWGQGTSVTVSS; L: DIVMTQSHKFMSTSVGDRVSVTCKASQAVNTAVAWYQQKPGQSPKLLIYSASYGYTGVPDRFTGSGSGTDFTLTISSVQAEDLAVYYCQHHYGVPWTFGGGTKLEIK
Selected Chain(s)	H,L
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 all 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                                          (00:01:45)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:47)

• Minimal score value: -3.3968
• Maximal score value: 1.8633
• Average score: -0.5254
• Total score value: -119.2682

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	-1.2993
2	V	H	-0.6823
3	Q	H	-1.3890
4	L	H	0.0000
5	Q	H	-1.7061
6	Q	H	-1.2040
7	S	H	-0.9553
8	G	H	-0.7337
9	A	H	-0.1081
11	E	H	-0.0219
12	L	H	0.7693
13	A	H	-0.5535
14	R	H	-1.9704
15	P	H	-1.7869
16	G	H	-1.2604
17	T	H	-1.1006
18	S	H	-1.0584
19	V	H	0.0000
20	K	H	-1.1179
21	V	H	0.0000
22	S	H	-0.6262
23	C	H	0.0000
24	K	H	-1.3301
25	A	H	0.0000
26	S	H	-0.8828
27	G	H	-0.8072
28	Y	H	-0.4038
29	A	H	-0.3104
30	F	H	0.0000
35	T	H	-1.2027
36	N	H	-1.0321
37	Y	H	-0.0837
38	L	H	0.4373
39	I	H	0.0000
40	E	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	K	H	-0.6664
44	Q	H	-1.0788
45	R	H	-1.8420
46	P	H	-1.2155
47	G	H	-1.3907
48	Q	H	-1.9163
49	G	H	-1.1577
50	L	H	0.0000
51	E	H	-1.0259
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	V	H	0.0000
56	I	H	0.0000
57	S	H	0.1158
58	P	H	0.0000
59	G	H	-0.8448
62	S	H	-0.1247
63	G	H	0.2892
64	I	H	1.8633
65	I	H	1.1486
66	N	H	-0.1921
67	Y	H	-1.1494
68	N	H	0.0000
69	E	H	-3.3968
70	K	H	-3.1854
71	F	H	0.0000
72	K	H	-3.1466
74	G	H	-1.9921
75	K	H	-1.7365
76	A	H	0.0000
77	T	H	-0.6768
78	L	H	0.0000
79	T	H	-0.1434
80	A	H	-0.8623
81	D	H	-1.5881
82	K	H	-2.1975
83	S	H	-1.2526
84	S	H	-1.0091
85	S	H	-1.1476
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.2438
89	M	H	0.0000
90	Q	H	-0.9948
91	L	H	0.0000
92	S	H	-0.8523
93	S	H	-0.9435
94	L	H	0.0000
95	T	H	-1.3894
96	S	H	-1.5134
97	D	H	-2.0863
98	D	H	0.0000
99	S	H	-0.7984
100	A	H	0.0000
101	V	H	-0.1177
102	Y	H	0.0000
103	F	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	A	H	0.0000
107	I	H	0.0000
108	D	H	0.0000
109	Y	H	0.7992
110	S	H	0.2698
111	G	H	0.2003
112	P	H	0.0950
113	Y	H	0.3357
114	A	H	0.0000
115	V	H	0.0000
116	D	H	-0.2965
117	D	H	-0.6906
118	W	H	0.0000
119	G	H	0.0000
120	Q	H	-1.8722
121	G	H	-1.0194
122	T	H	0.0000
123	S	H	-0.1980
124	V	H	0.0000
125	T	H	-0.2018
126	V	H	0.0000
127	S	H	-0.6601
128	S	H	-0.7687
1	D	L	-1.3876
2	I	L	0.2101
3	V	L	0.9705
4	M	L	0.0000
5	T	L	-0.5271
6	Q	L	0.0000
7	S	L	-1.1304
8	H	L	-1.3674
9	K	L	-1.3905
10	F	L	0.4762
11	M	L	0.0955
12	S	L	-0.3980
13	T	L	0.0000
14	S	L	-0.7761
15	V	L	-0.0367
16	G	L	-0.5677
17	D	L	-1.5584
18	R	L	-2.1027
19	V	L	-1.0356
20	S	L	-0.4619
21	V	L	0.0000
22	T	L	-0.9773
23	C	L	0.0000
24	K	L	-2.1536
25	A	L	0.0000
26	S	L	-0.7499
27	Q	L	-1.3471
28	A	L	-1.0744
29	V	L	0.0000
36	N	L	-1.5246
37	T	L	-0.7346
38	A	L	-0.1487
39	V	L	0.0000
40	A	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	-0.5740
44	Q	L	-0.8580
45	K	L	-1.2439
46	P	L	-0.9151
47	G	L	-1.4191
48	Q	L	-2.0321
49	S	L	-1.3796
50	P	L	0.0000
51	K	L	-1.0776
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.3979
56	S	L	0.1166
57	A	L	0.0000
65	S	L	0.2382
66	Y	L	1.0386
67	G	L	-0.1166
68	Y	L	0.1308
69	T	L	-0.1411
70	G	L	-0.6524
71	V	L	-0.6843
72	P	L	-1.1876
74	D	L	-2.0943
75	R	L	-1.5221
76	F	L	0.0000
77	T	L	-0.4583
78	G	L	0.0000
79	S	L	-0.4973
80	G	L	-1.3540
83	S	L	-1.4980
84	G	L	-1.6011
85	T	L	-2.0002
86	D	L	-2.7868
87	F	L	0.0000
88	T	L	-0.8103
89	L	L	0.0000
90	T	L	-0.5154
91	I	L	0.0000
92	S	L	-1.4331
93	S	L	-1.2514
94	V	L	0.0000
95	Q	L	-0.6634
96	A	L	-0.7708
97	E	L	-1.5775
98	D	L	0.0000
99	L	L	-0.3609
100	A	L	0.0000
101	V	L	-0.0760
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	Q	L	0.0000
106	H	L	0.0000
107	H	L	0.3755
108	Y	L	0.9654
109	G	L	0.6681
114	V	L	0.7054
115	P	L	-0.3403
116	W	L	0.0000
117	T	L	0.2796
118	F	L	0.2846
119	G	L	0.0000
120	G	L	-0.7613
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-0.4596
124	L	L	0.0000
125	E	L	-0.5224
126	I	L	-0.7382
127	K	L	-1.5075