Project name: 146f8c03894f951

Chain sequence(s)	H: QVQLVQSGAEVKKPGESVKVSCKASGYTFTNYGMNWVKQAPGQGLEWMGWINTYTGEPTYADKFQGRVTMTTDTSTSTAYMEIRNLGGDDTAVYYCARWSWSDGYYVYFDYWGQGTSVTVSS; L: DIVMTQSPDSLTVSLGERTTINCKSSQSVLDSSTNKNSLAWYQQKPGQPPKLLLSWASTRESGIPDRFSGSGSGTDFTLTIDSPQPEDSATYYCQQSAHFPITFGQGTRLEIK
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                                          (00:01:18)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:19)

• Minimal score value: -2.9963
• Maximal score value: 0.8748
• Average score: -0.6407
• Total score value: -150.5582

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	-1.3648
2	V	H	-0.6410
3	Q	H	-0.6707
4	L	H	0.0000
5	V	H	0.2388
6	Q	H	0.0000
7	S	H	-0.5663
8	G	H	-0.6359
9	A	H	-0.0497
11	E	H	0.0534
12	V	H	0.8748
13	K	H	-0.9207
14	K	H	-2.3495
15	P	H	-2.4734
16	G	H	-2.4494
17	E	H	-2.5610
18	S	H	-2.1616
19	V	H	0.0000
20	K	H	-1.4054
21	V	H	0.0000
22	S	H	-0.3971
23	C	H	0.0000
24	K	H	-0.7466
25	A	H	0.0000
26	S	H	-0.6797
27	G	H	-0.8807
28	Y	H	-0.4859
29	T	H	-0.4269
30	F	H	0.0000
35	T	H	-0.1983
36	N	H	-0.8295
37	Y	H	-0.0575
38	G	H	0.0000
39	M	H	0.0000
40	N	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	K	H	0.0000
44	Q	H	-0.6225
45	A	H	-1.0001
46	P	H	-0.8231
47	G	H	-1.2130
48	Q	H	-1.7998
49	G	H	-1.2676
50	L	H	0.0000
51	E	H	-0.8379
52	W	H	0.0000
53	M	H	0.0000
54	G	H	0.0000
55	W	H	-0.1498
56	I	H	0.0000
57	N	H	-0.6243
58	T	H	0.0000
59	Y	H	0.5707
62	T	H	-0.2126
63	G	H	-0.8983
64	E	H	-1.7911
65	P	H	-0.9928
66	T	H	-0.5803
67	Y	H	-0.8210
68	A	H	0.0000
69	D	H	-2.9963
70	K	H	-2.9875
71	F	H	0.0000
72	Q	H	-2.6660
74	G	H	-1.9486
75	R	H	-2.0602
76	V	H	0.0000
77	T	H	-0.6725
78	M	H	0.0000
79	T	H	-0.4598
80	T	H	-0.4586
81	D	H	-0.5095
82	T	H	-0.2043
83	S	H	-0.4160
84	T	H	-0.5120
85	S	H	-0.5773
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.2970
89	M	H	0.0000
90	E	H	-1.0004
91	I	H	0.0000
92	R	H	-2.1977
93	N	H	-2.6681
94	L	H	0.0000
95	G	H	-2.0528
96	G	H	-1.8333
97	D	H	-2.1003
98	D	H	0.0000
99	T	H	-0.6646
100	A	H	0.0000
101	V	H	0.1379
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	W	H	0.0000
108	S	H	0.1250
109	W	H	-0.0290
110	S	H	-0.6495
111	D	H	-1.5648
111A	G	H	-0.7183
112A	Y	H	0.2996
112	Y	H	0.6246
113	V	H	0.0000
114	Y	H	0.4683
115	F	H	0.0000
116	D	H	-0.1334
117	Y	H	0.1765
118	W	H	0.0000
119	G	H	0.0000
120	Q	H	-1.2337
121	G	H	-0.6487
122	T	H	0.0000
123	S	H	-0.0360
124	V	H	0.0000
125	T	H	-0.1504
126	V	H	0.0000
127	S	H	-0.7431
128	S	H	-0.7792
1	D	L	-1.4177
2	I	L	0.0000
3	V	L	0.8117
4	M	L	0.0000
5	T	L	-0.5838
6	Q	L	0.0000
7	S	L	-1.0542
8	P	L	-1.2645
9	D	L	-2.3080
10	S	L	-1.3740
11	L	L	-0.5186
12	T	L	-0.4961
13	V	L	0.0000
14	S	L	-0.9892
15	L	L	-0.5188
16	G	L	-1.2404
17	E	L	-2.2901
18	R	L	-2.8089
19	T	L	0.0000
20	T	L	-0.6343
21	I	L	0.0000
22	N	L	-1.2228
23	C	L	0.0000
24	K	L	-1.6087
25	S	L	0.0000
26	S	L	-0.8312
27	Q	L	-1.5387
28	S	L	-1.1515
29	V	L	0.0000
30	L	L	-0.5520
31	D	L	-1.0487
32	S	L	-0.9826
33	S	L	-0.8751
34	T	L	-1.1241
35	N	L	-1.7487
36	K	L	-1.3347
37	N	L	-0.9082
38	S	L	0.0000
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	-1.2484
45	K	L	-1.5043
46	P	L	-0.9590
47	G	L	-1.2951
48	Q	L	-1.8862
49	P	L	-1.3604
50	P	L	0.0000
51	K	L	-1.8433
52	L	L	0.0000
53	L	L	0.0000
54	L	L	0.0000
55	S	L	0.0000
56	W	L	-0.3774
57	A	L	0.0000
65	S	L	-0.6895
66	T	L	-0.6225
67	R	L	-1.4014
68	E	L	-1.3963
69	S	L	-0.8152
70	G	L	-1.0274
71	I	L	0.0000
72	P	L	-1.3607
74	D	L	-2.3432
75	R	L	-1.8770
76	F	L	0.0000
77	S	L	-0.9930
78	G	L	-0.5030
79	S	L	-0.7749
80	G	L	-1.2178
83	S	L	-1.1156
84	G	L	-1.1713
85	T	L	-1.5949
86	D	L	-2.5582
87	F	L	0.0000
88	T	L	-0.8863
89	L	L	0.0000
90	T	L	0.0000
91	I	L	0.0000
92	D	L	-2.5029
93	S	L	-1.7467
94	P	L	0.0000
95	Q	L	-1.2739
96	P	L	-1.0986
97	E	L	-1.9365
98	D	L	0.0000
99	S	L	-0.9840
100	A	L	0.0000
101	T	L	-1.0594
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	S	L	0.2292
108	A	L	-0.2392
109	H	L	-0.6151
114	F	L	0.1625
115	P	L	-0.5565
116	I	L	0.0000
117	T	L	-0.0703
118	F	L	0.0000
119	G	L	0.0000
120	Q	L	-1.3915
121	G	L	0.0000
122	T	L	0.0000
123	R	L	-1.8083
124	L	L	0.0000
125	E	L	-0.5930
126	I	L	-0.3540
127	K	L	-1.2987