Project name: 6ccfc18b17c1718

Chain sequence(s)	H: EVHLQQSGPVLVKPGPSVKISCKASGFTFTDSYMHWVKQSHGKSLEWIGLVYPYNGGTTYNQKFKGKATLTVDTSSSTAYMELYSLTSEDSAVYYCARWGHYYDGVFWGQGTLVTVSS; L: DVVLTQTPLSLPVNIGDQASISCKSIKSLLNSDGFTYLDWYLQKPGQSPQLLIYLVSNRFSGVPDRFSGSGSGTDFTLKISRVEAEDLGVYYCFQNNYLPYTFGGGTKLEIK
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                                          (00:02:26)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:28)

• Minimal score value: -2.8811
• Maximal score value: 1.5883
• Average score: -0.4033
• Total score value: -92.7647

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	E	H	-1.9837
2	V	H	-1.0814
3	H	H	-1.4644
4	L	H	0.0000
5	Q	H	-1.7732
6	Q	H	0.0000
7	S	H	-0.8556
8	G	H	-0.6319
9	P	H	0.3226
11	V	H	1.0010
12	L	H	1.4796
13	V	H	-0.0332
14	K	H	-1.7258
15	P	H	-1.5952
16	G	H	-1.1370
17	P	H	-0.8423
18	S	H	-0.7690
19	V	H	0.0000
20	K	H	-1.2572
21	I	H	0.0000
22	S	H	-0.7208
23	C	H	0.0000
24	K	H	-1.7068
25	A	H	0.0000
26	S	H	-1.1293
27	G	H	-1.0635
28	F	H	-0.5994
29	T	H	-0.5733
30	F	H	0.0000
35	T	H	-0.4758
36	D	H	-1.5318
37	S	H	0.0000
38	Y	H	-0.0315
39	M	H	0.0000
40	H	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	K	H	0.0000
44	Q	H	0.0000
45	S	H	-1.5138
46	H	H	-1.6637
47	G	H	-1.7595
48	K	H	-2.4325
49	S	H	-1.4493
50	L	H	0.0000
51	E	H	-1.1493
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	L	H	0.0000
56	V	H	0.0000
57	Y	H	0.1231
58	P	H	0.0000
59	Y	H	0.3198
62	N	H	-0.7257
63	G	H	-0.5216
64	G	H	-0.3711
65	T	H	-0.1636
66	T	H	-0.0654
67	Y	H	-0.5880
68	N	H	0.0000
69	Q	H	-2.5311
70	K	H	-2.8811
71	F	H	0.0000
72	K	H	-2.7920
74	G	H	-1.7507
75	K	H	-1.4375
76	A	H	0.0000
77	T	H	-0.5957
78	L	H	0.0000
79	T	H	-0.1079
80	V	H	-0.1162
81	D	H	-0.5800
82	T	H	-0.3700
83	S	H	-0.4530
84	S	H	-0.6076
85	S	H	-0.6821
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.2155
89	M	H	0.0000
90	E	H	-0.7943
91	L	H	0.0000
92	Y	H	-0.2995
93	S	H	-0.6347
94	L	H	0.0000
95	T	H	-1.2519
96	S	H	-1.4617
97	E	H	-1.9893
98	D	H	0.0000
99	S	H	-0.4893
100	A	H	0.0000
101	V	H	0.1039
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	G	H	0.0000
109	H	H	-0.3102
110	Y	H	1.4010
113	Y	H	1.5883
114	D	H	0.7064
115	G	H	0.0000
116	V	H	0.0000
117	F	H	0.2766
118	W	H	-0.2751
119	G	H	0.0000
120	Q	H	-1.4859
121	G	H	-0.7085
122	T	H	0.0000
123	L	H	0.5578
124	V	H	0.0000
125	T	H	0.2526
126	V	H	0.0000
127	S	H	-0.5540
128	S	H	-0.7505
1	D	L	-0.9629
2	V	L	0.0000
3	V	L	1.4508
4	L	L	0.0000
5	T	L	0.0647
6	Q	L	0.0000
7	T	L	0.0176
8	P	L	0.3772
9	L	L	1.1428
10	S	L	0.0756
11	L	L	-0.2560
12	P	L	-1.0171
13	V	L	0.0000
14	N	L	-0.9312
15	I	L	0.5529
16	G	L	-0.6865
17	D	L	-1.3571
18	Q	L	-1.9567
19	A	L	0.0000
20	S	L	-0.7746
21	I	L	0.0000
22	S	L	-0.7105
23	C	L	0.0000
24	K	L	-1.5293
25	S	L	0.0000
26	I	L	1.2411
27	K	L	-0.2985
28	S	L	-0.3641
29	L	L	0.0000
30	L	L	0.8835
31	N	L	-0.0753
32	S	L	-0.6616
34	D	L	-1.1328
35	G	L	-0.1805
36	F	L	1.3686
37	T	L	0.9717
38	Y	L	0.9123
39	L	L	0.0000
40	D	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	L	L	0.0000
44	Q	L	-0.9390
45	K	L	-1.5132
46	P	L	-1.0151
47	G	L	-1.4369
48	Q	L	-1.9764
49	S	L	-1.1706
50	P	L	0.0000
51	Q	L	-0.5373
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-0.0944
56	L	L	0.6177
57	V	L	0.0000
65	S	L	-0.7390
66	N	L	-1.2233
67	R	L	-1.6856
68	F	L	-0.5287
69	S	L	-0.5319
70	G	L	-0.9051
71	V	L	0.0000
72	P	L	-1.2406
74	D	L	-2.1840
75	R	L	0.0000
76	F	L	0.0000
77	S	L	-1.1427
78	G	L	0.0000
79	S	L	-0.6822
80	G	L	-1.0678
83	S	L	-0.7476
84	G	L	-0.5564
85	T	L	-0.9421
86	D	L	-1.8795
87	F	L	0.0000
88	T	L	-0.8775
89	L	L	0.0000
90	K	L	-1.1903
91	I	L	0.0000
92	S	L	-1.8624
93	R	L	-1.8365
94	V	L	0.0000
95	E	L	-0.8974
96	A	L	-0.6418
97	E	L	-1.9290
98	D	L	0.0000
99	L	L	-0.6350
100	G	L	0.0000
101	V	L	-0.4677
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	F	L	0.0000
106	Q	L	0.0000
107	N	L	0.2975
108	N	L	0.5950
109	Y	L	0.4097
114	L	L	1.1513
115	P	L	0.0000
116	Y	L	0.4436
117	T	L	0.0903
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-0.5130
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-0.8301
124	L	L	0.0000
125	E	L	-0.9986
126	I	L	-0.2675
127	K	L	-1.4695