Project name: a9f4b2eeea417ba

Chain sequence(s)	H: QVQLRESGPSLVKPSQTLFLTCTVSGFSLTSYSVNWVRQTPGKMLECLGGIATSGSTGYNPVLKSRLRITKDNSKSQVSLSVSNVTPEDTATYYCAKWSSRGGYDCGVHSSDYSYLDAWGQGLLVTVSS; L: AVLTQPSSVSASLGQRVSITCSGSSSNIGRYGATWYQQVPGSGLRTIIYGSSRRPSGVPDRFSGSKSGNTVTLTISSLQPEDEADYFCAAYDISTNAVFGSGTTLTLL
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                                          (00:02:15)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:17)

• Minimal score value: -3.1651
• Maximal score value: 1.7949
• Average score: -0.4908
• Total score value: -116.3155

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	-1.1291
2	V	H	-0.3136
3	Q	H	-1.6468
4	L	H	0.0000
5	R	H	-2.5318
6	E	H	-1.6082
7	S	H	-0.6136
8	G	H	0.3031
9	P	H	0.7000
11	S	H	0.6951
12	L	H	1.3550
13	V	H	-0.0871
14	K	H	-1.7939
15	P	H	-1.6823
16	S	H	-1.7104
17	Q	H	-1.8113
18	T	H	-0.7997
19	L	H	0.0000
20	F	H	1.5279
21	L	H	0.0000
22	T	H	0.0000
23	C	H	0.0000
24	T	H	-1.3937
25	V	H	0.0000
26	S	H	-1.1611
27	G	H	-0.6992
28	F	H	-0.1677
29	S	H	-0.4636
30	L	H	0.0000
35	T	H	-0.7211
36	S	H	-0.5583
37	Y	H	-0.3216
38	S	H	0.0000
39	V	H	0.0000
40	N	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	-0.2595
44	Q	H	-0.4414
45	T	H	-0.6964
46	P	H	-0.7090
47	G	H	-0.9535
48	K	H	-1.0440
49	M	H	-0.3320
50	L	H	0.0000
51	E	H	-0.5018
52	C	H	0.0000
53	L	H	0.0000
54	G	H	0.0000
55	G	H	0.0000
56	I	H	0.0000
57	A	H	0.0000
58	T	H	-0.9570
59	S	H	-0.7952
63	G	H	-0.6833
64	S	H	-0.4875
65	T	H	-0.4009
66	G	H	-0.5061
67	Y	H	-0.5346
68	N	H	0.0000
69	P	H	0.0064
70	V	H	1.0404
71	L	H	0.0000
72	K	H	-1.6703
74	S	H	-1.2730
75	R	H	-1.5394
76	L	H	-1.6543
77	R	H	-1.9540
78	I	H	0.0000
79	T	H	-0.9986
80	K	H	-1.3817
81	D	H	-1.9665
82	N	H	-2.3076
83	S	H	-1.9553
84	K	H	-2.4937
85	S	H	-1.8091
86	Q	H	-1.6596
87	V	H	0.0000
88	S	H	0.0000
89	L	H	0.0000
90	S	H	0.0000
91	V	H	0.0000
92	S	H	-1.2144
93	N	H	-2.0672
94	V	H	0.0000
95	T	H	-1.5794
96	P	H	-1.4950
97	E	H	-2.0035
98	D	H	0.0000
99	T	H	-0.3331
100	A	H	0.0000
101	T	H	0.3415
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	K	H	0.0000
107	W	H	-0.1379
108	S	H	-0.3057
109	S	H	-0.6972
110	R	H	-1.7973
111	G	H	-0.9841
111A	G	H	0.0000
111B	Y	H	-0.0514
111C	D	H	-0.2875
111D	C	H	0.0000
111E	G	H	0.0819
112E	V	H	0.0000
112D	H	H	0.0000
112C	S	H	0.0000
112B	S	H	-0.3346
112A	D	H	-1.3675
112	Y	H	-0.0439
113	S	H	0.0000
114	Y	H	-0.4504
115	L	H	-0.1984
116	D	H	-0.8849
117	A	H	-0.4549
118	W	H	-0.5290
119	G	H	0.0000
120	Q	H	-1.8194
121	G	H	-0.6603
122	L	H	0.2149
123	L	H	1.6348
124	V	H	0.0000
125	T	H	0.4014
126	V	H	0.0000
127	S	H	-0.8159
128	S	H	-0.7703
2	A	L	0.7442
3	V	L	1.7949
4	L	L	0.8304
5	T	L	0.1168
6	Q	L	-0.2634
7	P	L	-0.3729
8	S	L	-0.3937
9	S	L	-0.3076
11	V	L	0.0847
12	S	L	0.0653
13	A	L	0.0109
14	S	L	0.2600
15	L	L	0.3217
16	G	L	-1.0612
17	Q	L	-1.8564
18	R	L	-2.4123
19	V	L	0.0000
20	S	L	-0.7648
21	I	L	0.0000
22	T	L	-0.4562
23	C	L	0.0000
24	S	L	-0.6525
25	G	L	-0.3156
26	S	L	-0.6545
27	S	L	-0.8777
28	S	L	-0.3430
29	N	L	0.0000
30	I	L	0.0000
35	G	L	-2.0434
36	R	L	-1.8364
37	Y	L	-1.0098
38	G	L	-1.3978
39	A	L	0.0000
40	T	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	0.0000
45	V	L	0.2879
46	P	L	-0.1341
47	G	L	-0.5120
48	S	L	-0.5130
49	G	L	0.0000
50	L	L	0.0000
51	R	L	-0.6494
52	T	L	0.0000
53	I	L	0.0000
54	I	L	0.0000
55	Y	L	0.0000
56	G	L	-1.5673
57	S	L	0.0000
65	S	L	-2.1202
66	R	L	-2.9837
67	R	L	-3.1651
68	P	L	0.0000
69	S	L	-1.4760
70	G	L	-1.1943
71	V	L	0.0000
72	P	L	-1.5153
74	D	L	-2.4487
75	R	L	-1.7422
76	F	L	0.0000
77	S	L	-1.4870
78	G	L	0.0000
79	S	L	-1.5045
80	K	L	-2.2572
83	S	L	-1.6448
84	G	L	-1.7572
85	N	L	-1.9159
86	T	L	-1.2910
87	V	L	0.0000
88	T	L	-0.6602
89	L	L	0.0000
90	T	L	-0.7140
91	I	L	0.0000
92	S	L	-1.5737
93	S	L	-1.3975
94	L	L	0.0000
95	Q	L	-1.3375
96	P	L	-1.2302
97	E	L	-2.1686
98	D	L	0.0000
99	E	L	-1.2501
100	A	L	0.0000
101	D	L	-0.3005
102	Y	L	0.0000
103	F	L	0.0000
104	C	L	0.0000
105	A	L	0.0000
106	A	L	0.0000
107	Y	L	0.2125
108	D	L	0.4886
109	I	L	1.0984
113	S	L	0.5966
114	T	L	0.3826
115	N	L	0.1733
116	A	L	0.0000
117	V	L	0.0000
118	F	L	0.0000
119	G	L	0.0000
120	S	L	-0.1535
121	G	L	0.0000
122	T	L	0.0000
123	T	L	-0.3148
124	L	L	0.0000
125	T	L	0.1162
126	L	L	0.5222
127	L	L	1.7362