Project name: 2-10E2

Chain sequence(s)	H: QVQLQQSGAELARPGASVKLSCKASGYTLSSYWMQWVKQRPGQGLEWIGAIYPGDGDTRYTQKFKGKATLTADKSSSTAYMQLSSLASEDSAVYYCARGGAYYFDYWGQGTTLTVSS; L: QIVLTQSPALMSASPGEKVTMTCSASSSVSHIYWYQQKPRSSPKPWIYLTSNLASGVPARFSGSGSGTSYSLTISSMEAEDVATYYCQQWRRNVTFGSGTKLEIK
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                                          (00:01:29)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:30)

• Minimal score value: -3.1895
• Maximal score value: 1.3102
• Average score: -0.5756
• Total score value: -127.7894

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	-1.4746
2	V	H	-0.8964
3	Q	H	-1.6741
4	L	H	0.0000
5	Q	H	-2.1626
6	Q	H	-1.4228
7	S	H	-1.1233
8	G	H	-1.0414
9	A	H	-0.3205
11	E	H	-0.4748
12	L	H	0.6439
13	A	H	-0.5911
14	R	H	-1.9175
15	P	H	-1.5403
16	G	H	-1.2296
17	A	H	-0.9914
18	S	H	-0.9805
19	V	H	-0.7557
20	K	H	-1.2575
21	L	H	0.0000
22	S	H	-0.7180
23	C	H	0.0000
24	K	H	-1.6369
25	A	H	0.0000
26	S	H	-1.1693
27	G	H	-0.9761
28	Y	H	-0.3584
29	T	H	-0.2844
30	L	H	0.0000
35	S	H	-0.8081
36	S	H	-0.1941
37	Y	H	0.4383
38	W	H	0.2065
39	M	H	0.0000
40	Q	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	K	H	0.0000
44	Q	H	-0.8935
45	R	H	-1.5319
46	P	H	-1.2679
47	G	H	-1.3897
48	Q	H	-1.9062
49	G	H	-1.2443
50	L	H	0.0000
51	E	H	-0.8428
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	A	H	0.0000
56	I	H	0.0000
57	Y	H	-0.5867
58	P	H	0.0000
59	G	H	-1.3752
62	D	H	-2.3697
63	G	H	-1.7494
64	D	H	-1.7456
65	T	H	-1.2847
66	R	H	-1.8897
67	Y	H	-1.6946
68	T	H	0.0000
69	Q	H	-2.8888
70	K	H	-2.8084
71	F	H	0.0000
72	K	H	-2.9205
74	G	H	-1.8602
75	K	H	-1.5796
76	A	H	0.0000
77	T	H	-0.7848
78	L	H	0.0000
79	T	H	-0.5239
80	A	H	-1.0395
81	D	H	-1.5335
82	K	H	-2.1705
83	S	H	-1.1630
84	S	H	-0.9866
85	S	H	-1.1506
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.3038
89	M	H	0.0000
90	Q	H	-1.0335
91	L	H	0.0000
92	S	H	-0.7936
93	S	H	-0.8658
94	L	H	0.0000
95	A	H	-1.2430
96	S	H	-1.4121
97	E	H	-1.9891
98	D	H	0.0000
99	S	H	-0.7039
100	A	H	0.0000
101	V	H	-0.1529
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	G	H	0.4134
109	A	H	0.6347
113	Y	H	1.1231
114	Y	H	0.8339
115	F	H	0.0000
116	D	H	0.1060
117	Y	H	0.1274
118	W	H	-0.4080
119	G	H	0.0000
120	Q	H	-1.7907
121	G	H	-1.0114
122	T	H	0.0000
123	T	H	-0.2152
124	L	H	0.0000
125	T	H	-0.2553
126	V	H	0.0000
127	S	H	-0.7151
128	S	H	-0.8636
1	Q	L	-1.5282
2	I	L	0.0000
3	V	L	1.3102
4	L	L	0.0000
5	T	L	0.1664
6	Q	L	0.0000
7	S	L	-0.0918
8	P	L	0.1693
9	A	L	0.4446
10	L	L	1.0420
11	M	L	0.3453
12	S	L	-0.4023
13	A	L	0.0000
14	S	L	-1.6118
15	P	L	-1.8059
16	G	L	-2.1647
17	E	L	-3.1895
18	K	L	-2.7526
19	V	L	0.0000
20	T	L	-0.6931
21	M	L	0.0000
22	T	L	-0.2574
23	C	L	0.0000
24	S	L	-0.1430
25	A	L	0.0000
26	S	L	0.0129
27	S	L	-0.4178
28	S	L	-0.7601
29	V	L	0.0000
37	S	L	-0.7382
38	H	L	-0.6255
39	I	L	0.0000
40	Y	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	-1.2944
46	P	L	-1.4218
47	R	L	-2.2872
48	S	L	-1.6149
49	S	L	-1.0195
50	P	L	0.0000
51	K	L	-0.7767
52	P	L	-0.2605
53	W	L	0.0000
54	I	L	0.0000
55	Y	L	0.2462
56	L	L	0.1574
57	T	L	0.0000
65	S	L	-0.5826
66	N	L	-0.6786
67	L	L	-0.0651
68	A	L	-0.2272
69	S	L	-0.4192
70	G	L	-0.4218
71	V	L	-0.2464
72	P	L	-0.1348
74	A	L	-0.1041
75	R	L	-0.7434
76	F	L	0.0000
77	S	L	-0.4067
78	G	L	0.0000
79	S	L	-0.6374
80	G	L	-0.7713
83	S	L	-0.7451
84	G	L	-0.7126
85	T	L	-0.6305
86	S	L	-0.6034
87	Y	L	0.0000
88	S	L	-0.3510
89	L	L	0.0000
90	T	L	-0.5816
91	I	L	0.0000
92	S	L	-1.4924
93	S	L	-2.0439
94	M	L	0.0000
95	E	L	-1.9944
96	A	L	-0.9111
97	E	L	-1.1340
98	D	L	0.0000
99	V	L	-0.2871
100	A	L	0.0000
101	T	L	-0.4275
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	W	L	-0.6179
108	R	L	-2.1328
114	R	L	-2.5972
115	N	L	-1.6942
116	V	L	0.0000
117	T	L	-0.3005
118	F	L	0.0000
119	G	L	0.0000
120	S	L	-0.4115
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-0.5114
124	L	L	0.0000
125	E	L	-0.4400
126	I	L	0.0358
127	K	L	-1.3929