Project name: d931dcdf81eb15d

Chain sequence(s)	H: QVQLVQSGAEVKKPGASVKVSCKASGYTFKSYEMHWVRQAPGQGLEWMGRINPSVGSTWYAQKFQGRVTMTRDTSTSTVYMELSSLRSEDTAVYYCARGKREGGTEYLRKWGQGTLVTVSS; L: EIVLTQSPGTLSLSPGERATLSCRASQSVASSYLAWYQQKPGQAPRLLIYGASNRHTGIPDRFSGSGSGTDFTLTISRLEPEDFAVYYCQQYHNAITFGGGTKVEIK
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:02:44)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:46)

• Minimal score value: -3.1425
• Maximal score value: 1.2727
• Average score: -0.6345
• Total score value: -144.6569

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	-1.3750
2	V	H	-0.9210
3	Q	H	-1.2192
4	L	H	0.0000
5	V	H	0.2649
6	Q	H	0.0000
7	S	H	-0.4147
8	G	H	-0.3844
9	A	H	0.4498
11	E	H	0.3397
12	V	H	1.2401
13	K	H	-0.7927
14	K	H	-2.1401
15	P	H	-2.2821
16	G	H	-1.6366
17	A	H	-1.2583
18	S	H	-1.4373
19	V	H	0.0000
20	K	H	-1.9879
21	V	H	0.0000
22	S	H	-0.4997
23	C	H	0.0000
24	K	H	-0.6955
25	A	H	0.0000
26	S	H	-0.7272
27	G	H	-0.9253
28	Y	H	-0.4851
29	T	H	-0.4146
30	F	H	0.0000
35	K	H	-1.1781
36	S	H	-1.0904
37	Y	H	-0.9455
38	E	H	-1.0574
39	M	H	0.0000
40	H	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	-0.4809
45	A	H	-0.8921
46	P	H	-0.9134
47	G	H	-1.2095
48	Q	H	-1.7281
49	G	H	-1.0807
50	L	H	0.0000
51	E	H	-0.7892
52	W	H	0.0000
53	M	H	0.0000
54	G	H	0.0000
55	R	H	-0.0184
56	I	H	0.0000
57	N	H	-0.1975
58	P	H	0.0000
59	S	H	-0.0410
62	V	H	1.2727
63	G	H	0.1004
64	S	H	0.3637
65	T	H	0.5351
66	W	H	0.8585
67	Y	H	-0.2504
68	A	H	0.0000
69	Q	H	-2.5384
70	K	H	-2.7150
71	F	H	0.0000
72	Q	H	-2.2472
74	G	H	-1.6206
75	R	H	-1.5073
76	V	H	0.0000
77	T	H	-0.6302
78	M	H	0.0000
79	T	H	-0.5455
80	R	H	-0.9581
81	D	H	-1.1593
82	T	H	-0.9108
83	S	H	-0.5660
84	T	H	-0.6217
85	S	H	-0.9198
86	T	H	0.0000
87	V	H	0.0000
88	Y	H	-0.5130
89	M	H	0.0000
90	E	H	-1.4517
91	L	H	0.0000
92	S	H	-1.2221
93	S	H	-1.2968
94	L	H	0.0000
95	R	H	-3.1425
96	S	H	-2.3929
97	E	H	-2.6054
98	D	H	0.0000
99	T	H	-0.6875
100	A	H	0.0000
101	V	H	0.5899
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	0.0000
107	G	H	0.0000
108	K	H	-1.6093
109	R	H	-2.2510
110	E	H	-2.2322
111	G	H	-1.5563
112A	G	H	-1.3087
112	T	H	-1.2253
113	E	H	-1.1900
114	Y	H	0.0000
115	L	H	0.0000
116	R	H	-1.1540
117	K	H	-1.1230
118	W	H	0.0000
119	G	H	0.0000
120	Q	H	-1.2394
121	G	H	-0.3846
122	T	H	0.0000
123	L	H	1.0299
124	V	H	0.0000
125	T	H	0.0031
126	V	H	0.0000
127	S	H	-0.9406
128	S	H	-1.2445
1	E	L	-1.9149
2	I	L	0.0000
3	V	L	0.6625
4	L	L	0.0000
5	T	L	-0.7139
6	Q	L	-0.8333
7	S	L	-0.9711
8	P	L	-0.6856
9	G	L	-0.9782
10	T	L	-0.8077
11	L	L	-0.2961
12	S	L	-0.2602
13	L	L	-0.3783
14	S	L	-0.7795
15	P	L	-1.1071
16	G	L	-1.6748
17	E	L	-2.2278
18	R	L	-2.8773
19	A	L	0.0000
20	T	L	-0.6295
21	L	L	0.0000
22	S	L	-0.9549
23	C	L	0.0000
24	R	L	-2.3503
25	A	L	0.0000
26	S	L	-1.0288
27	Q	L	-1.7198
28	S	L	-1.3437
29	V	L	0.0000
30	A	L	-0.3490
36	S	L	-0.4186
37	S	L	-0.3537
38	Y	L	-0.2324
39	L	L	0.0000
40	A	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	0.0000
45	K	L	-1.0735
46	P	L	-0.8883
47	G	L	-1.2854
48	Q	L	-1.7093
49	A	L	-1.1419
50	P	L	0.0000
51	R	L	-0.9375
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-0.5260
56	G	L	-0.4605
57	A	L	0.0000
65	S	L	-1.0091
66	N	L	-1.4350
67	R	L	-1.7950
68	H	L	-1.2255
69	T	L	-0.7249
70	G	L	-0.9050
71	I	L	0.0000
72	P	L	-1.3027
74	D	L	-2.3643
75	R	L	-1.9495
76	F	L	0.0000
77	S	L	-1.0462
78	G	L	-0.6487
79	S	L	-0.7445
80	G	L	-1.0045
83	S	L	-0.9772
84	G	L	-1.1751
85	T	L	-1.7429
86	D	L	-2.0898
87	F	L	0.0000
88	T	L	-0.7637
89	L	L	0.0000
90	T	L	-0.7967
91	I	L	0.0000
92	S	L	-2.1765
93	R	L	-2.8657
94	L	L	0.0000
95	E	L	-1.4974
96	P	L	-0.5586
97	E	L	-1.0312
98	D	L	0.0000
99	F	L	-0.0307
100	A	L	0.0000
101	V	L	-0.4360
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	Q	L	0.0000
106	Q	L	0.0000
107	Y	L	0.0000
108	H	L	-1.1304
114	N	L	-1.7829
115	A	L	-1.0725
116	I	L	0.0000
117	T	L	-0.2791
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-0.6765
121	G	L	-0.8930
122	T	L	0.0000
123	K	L	-1.1802
124	V	L	0.0000
125	E	L	-0.0535
126	I	L	0.8868
127	K	L	-0.8006