Project name: 11G9D6-1

Chain sequence(s)	H: QVQLQQSGAELMKPGASVKISCKATGYTFSNYWIEWVKQRPGHGLEWIGQILPGSGSINYNEEFKGKATFIAGTSSNTAYMHLSSLTSEDSAVYFCARSYGSSFDSWGQGTTLTVSS; L: DIVLTQSPATLSVTPGDSVSLSCRASQSISNDLHWYQQKSHESPRLLIKYASQSFSGIPSRFSGSGSGTDFTLSINSVETEDFGMYFCQQSNNWPLTFGAGTKLELK
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                                          (00:01:58)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:00)

• Minimal score value: -3.2306
• Maximal score value: 1.1346
• Average score: -0.5238
• Total score value: -117.3395

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	-1.4143
2	V	H	-0.9482
3	Q	H	-1.8205
4	L	H	0.0000
5	Q	H	-2.1179
6	Q	H	0.0000
7	S	H	-1.0244
8	G	H	-0.6460
9	A	H	0.0621
11	E	H	0.1544
12	L	H	1.0264
13	M	H	-0.2008
14	K	H	-1.7056
15	P	H	-1.4107
16	G	H	-1.1116
17	A	H	-0.8874
18	S	H	-0.9503
19	V	H	0.0000
20	K	H	-1.4940
21	I	H	0.0000
22	S	H	-0.7149
23	C	H	0.0000
24	K	H	-1.9149
25	A	H	0.0000
26	T	H	-1.2807
27	G	H	-0.9231
28	Y	H	-0.5712
29	T	H	-0.5494
30	F	H	0.0000
35	S	H	-0.9638
36	N	H	-1.2139
37	Y	H	-0.0348
38	W	H	0.3469
39	I	H	0.0000
40	E	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	K	H	0.0000
44	Q	H	-0.6355
45	R	H	-1.3281
46	P	H	-1.0095
47	G	H	-1.2267
48	H	H	-1.4995
49	G	H	-0.8269
50	L	H	0.0000
51	E	H	0.0000
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	Q	H	0.0000
56	I	H	0.0000
57	L	H	0.0471
58	P	H	0.0000
59	G	H	-0.9381
62	S	H	-0.7045
63	G	H	-0.3121
64	S	H	0.0251
65	I	H	0.6201
66	N	H	-0.2773
67	Y	H	-0.9172
68	N	H	0.0000
69	E	H	-3.1271
70	E	H	-3.2306
71	F	H	0.0000
72	K	H	-3.0785
74	G	H	-1.8902
75	K	H	-1.4207
76	A	H	0.0000
77	T	H	-0.3908
78	F	H	0.0000
79	I	H	1.0886
80	A	H	0.1741
81	G	H	-0.3380
82	T	H	-0.4981
83	S	H	-0.5538
84	S	H	-0.8286
85	N	H	-1.1693
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	0.0811
89	M	H	0.0000
90	H	H	-0.7715
91	L	H	0.0000
92	S	H	-0.7595
93	S	H	-0.8386
94	L	H	0.0000
95	T	H	-1.2986
96	S	H	-1.3850
97	E	H	-1.9444
98	D	H	0.0000
99	S	H	-0.6409
100	A	H	0.0000
101	V	H	0.0669
102	Y	H	0.0000
103	F	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	0.0000
107	S	H	0.0000
108	Y	H	1.1346
109	G	H	0.2193
113	S	H	0.0000
114	S	H	0.0000
115	F	H	0.0000
116	D	H	0.0463
117	S	H	-0.2885
118	W	H	0.0000
119	G	H	0.0000
120	Q	H	-1.6908
121	G	H	-0.9081
122	T	H	0.0000
123	T	H	0.0101
124	L	H	0.0000
125	T	H	-0.0310
126	V	H	0.0000
127	S	H	-0.6499
128	S	H	-0.7898
1	D	L	-1.4701
2	I	L	0.0000
3	V	L	0.7566
4	L	L	0.0000
5	T	L	-0.4360
6	Q	L	0.0000
7	S	L	-0.5654
8	P	L	-0.2815
9	A	L	-0.1903
10	T	L	-0.4408
11	L	L	-0.2552
12	S	L	-0.5345
13	V	L	0.0000
14	T	L	-0.8680
15	P	L	-1.1194
16	G	L	-1.3168
17	D	L	-1.2473
18	S	L	-1.0892
19	V	L	-0.4702
20	S	L	-0.4088
21	L	L	0.0000
22	S	L	-0.8213
23	C	L	0.0000
24	R	L	-2.2418
25	A	L	0.0000
26	S	L	-1.0052
27	Q	L	-1.8862
28	S	L	-1.5419
29	I	L	0.0000
36	S	L	-1.1149
37	N	L	-1.2094
38	D	L	-0.9750
39	L	L	0.0000
40	H	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	-0.7903
45	K	L	-1.1159
46	S	L	-1.0393
47	H	L	-1.6764
48	E	L	-1.6752
49	S	L	-1.0935
50	P	L	0.0000
51	R	L	-0.5851
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	K	L	-0.5703
56	Y	L	-0.4455
57	A	L	0.0000
65	S	L	-1.0132
66	Q	L	-1.2584
67	S	L	-0.6680
68	F	L	-0.2144
69	S	L	-0.3576
70	G	L	-0.4098
71	I	L	-0.1342
72	P	L	-0.2374
74	S	L	-0.5337
75	R	L	-1.0028
76	F	L	0.0000
77	S	L	-0.8304
78	G	L	-0.6497
79	S	L	-0.8436
80	G	L	-1.1194
83	S	L	-1.2135
84	G	L	-1.3538
85	T	L	-1.7729
86	D	L	-2.0673
87	F	L	0.0000
88	T	L	-0.7657
89	L	L	0.0000
90	S	L	-0.6267
91	I	L	0.0000
92	N	L	-1.8212
93	S	L	-1.4826
94	V	L	0.0000
95	E	L	-1.7682
96	T	L	-0.8582
97	E	L	-1.1626
98	D	L	0.0000
99	F	L	-0.2854
100	G	L	0.0000
101	M	L	-0.3040
102	Y	L	0.0000
103	F	L	0.0000
104	C	L	0.0000
105	Q	L	0.0000
106	Q	L	0.0000
107	S	L	-0.6208
108	N	L	-1.3064
109	N	L	-1.1496
114	W	L	-0.0129
115	P	L	-0.6466
116	L	L	0.0000
117	T	L	0.0288
118	F	L	0.0000
119	G	L	0.0000
120	A	L	-0.1012
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-0.6856
124	L	L	0.0000
125	E	L	-0.4767
126	L	L	0.2962
127	K	L	-1.1929