Project name: 7D85

Chain sequence(s)	H: EVQLLESGGGLVQPGGSLRLSCAASGFTFSDYDMSWVRQAPGKGLEWVSTIDLDSGSIYYADSVQGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCAKDLHMGPEGPFDYWGQGTLVTVSS; L: QSVLTQPPSASGTPGQRVTISCSGSSSNIGSNSVSWYQQLPGTAPKLLIYSDNHRPSGVPDRFSGSKSGTSASLAISGLRSEDEADYYCQGWDTSLSGHVFGGGTKLTVL
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                                          (00:00:37)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:38)

• Minimal score value: -2.5902
• Maximal score value: 1.4251
• Average score: -0.5368
• Total score value: -124.0065

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	-2.0440
2	V	H	-0.9459
3	Q	H	-0.9137
4	L	H	0.0000
5	L	H	0.8712
6	E	H	0.2643
7	S	H	-0.2204
8	G	H	-0.6254
9	G	H	0.1695
11	G	H	0.7661
12	L	H	1.3689
13	V	H	-0.0111
14	Q	H	-1.3066
15	P	H	-1.4815
16	G	H	-1.3322
17	G	H	-0.9539
18	S	H	-1.0175
19	L	H	-0.4725
20	R	H	-1.2840
21	L	H	0.0000
22	S	H	-0.2720
23	C	H	0.0000
24	A	H	-0.1719
25	A	H	0.0000
26	S	H	-1.0088
27	G	H	-1.2742
28	F	H	-0.7341
29	T	H	-0.6346
30	F	H	0.0000
35	S	H	-1.5168
36	D	H	-1.4726
37	Y	H	-0.6363
38	D	H	-0.6379
39	M	H	0.0000
40	S	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	-0.6312
45	A	H	-1.0128
46	P	H	-0.8126
47	G	H	-1.4525
48	K	H	-2.2462
49	G	H	-1.4657
50	L	H	0.0000
51	E	H	-0.9341
52	W	H	0.0000
53	V	H	0.0000
54	S	H	0.0000
55	T	H	0.0000
56	I	H	0.0000
57	D	H	-0.7106
58	L	H	-1.1392
59	D	H	-2.1550
62	S	H	-1.0385
63	G	H	-0.7805
64	S	H	0.0423
65	I	H	1.1845
66	Y	H	0.7476
67	Y	H	-0.2604
68	A	H	0.0000
69	D	H	-2.1386
70	S	H	-1.6310
71	V	H	0.0000
72	Q	H	-1.9166
74	G	H	-1.4531
75	R	H	-1.2768
76	F	H	0.0000
77	T	H	-0.4632
78	I	H	0.0000
79	S	H	-0.1853
80	R	H	-1.0726
81	D	H	-1.5851
82	N	H	-2.0009
83	S	H	-1.5673
84	K	H	-2.4104
85	N	H	-1.8993
86	T	H	-0.9976
87	L	H	0.0000
88	Y	H	-0.3409
89	L	H	0.0000
90	Q	H	-0.9512
91	M	H	0.0000
92	N	H	-1.2089
93	S	H	-1.1601
94	L	H	0.0000
95	R	H	-1.8397
96	A	H	-1.5153
97	E	H	-2.0905
98	D	H	0.0000
99	T	H	-0.3044
100	A	H	0.0000
101	V	H	0.6887
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	D	H	0.0000
108	L	H	-0.1544
109	H	H	-0.6134
110	M	H	0.1670
111	G	H	-0.3954
112A	P	H	-0.6182
112	E	H	-0.7571
113	G	H	-0.5912
114	P	H	0.0000
115	F	H	0.0000
116	D	H	0.0256
117	Y	H	0.6002
118	W	H	0.1259
119	G	H	0.0000
120	Q	H	-0.7779
121	G	H	-0.0546
122	T	H	0.4438
123	L	H	1.4251
124	V	H	0.0000
125	T	H	0.3521
126	V	H	0.0000
127	S	H	-0.6843
128	S	H	-0.6053
1	Q	L	-0.8958
2	S	L	-0.0733
3	V	L	1.1467
4	L	L	0.0000
5	T	L	0.0947
6	Q	L	-0.3712
7	P	L	-0.5962
8	P	L	-0.7689
9	S	L	-0.7694
11	A	L	-0.4858
12	S	L	-0.1019
13	G	L	0.0000
14	T	L	-0.3489
15	P	L	-1.1917
16	G	L	-1.8693
17	Q	L	-2.4447
18	R	L	-2.5902
19	V	L	0.0000
20	T	L	-0.6564
21	I	L	0.0000
22	S	L	-0.3886
23	C	L	0.0000
24	S	L	-0.2611
25	G	L	-0.0650
26	S	L	-0.2600
27	S	L	-0.6859
28	S	L	-0.3406
29	N	L	0.0000
30	I	L	0.0000
35	G	L	-1.0042
36	S	L	-0.6618
37	N	L	-0.5296
38	S	L	-0.7400
39	V	L	0.0000
40	S	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	-0.6154
45	L	L	-0.5837
46	P	L	-0.5422
47	G	L	-0.6452
48	T	L	-0.6097
49	A	L	-0.5528
50	P	L	0.0000
51	K	L	-0.7165
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-1.1247
56	S	L	-1.2783
57	D	L	-1.5588
65	N	L	-2.2275
66	H	L	-2.0832
67	R	L	-2.0215
68	P	L	-0.9171
69	S	L	-0.7593
70	G	L	-0.9563
71	V	L	0.0000
72	P	L	-1.4182
74	D	L	-2.2351
75	R	L	-1.7116
76	F	L	0.0000
77	S	L	-1.3640
78	G	L	-1.2749
79	S	L	-1.1412
80	K	L	-1.2305
83	S	L	-0.8469
84	G	L	-0.9568
85	T	L	-0.8195
86	S	L	-0.7149
87	A	L	0.0000
88	S	L	-0.6035
89	L	L	0.0000
90	A	L	-0.7359
91	I	L	0.0000
92	S	L	-1.9882
93	G	L	-1.9058
94	L	L	0.0000
95	R	L	-2.3823
96	S	L	-1.7413
97	E	L	-2.4409
98	D	L	0.0000
99	E	L	-1.3494
100	A	L	0.0000
101	D	L	-0.8946
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	Q	L	0.0000
106	G	L	0.0000
107	W	L	0.1333
108	D	L	0.0000
109	T	L	-0.1102
110	S	L	-0.0123
113	L	L	0.1385
114	S	L	-0.0406
115	G	L	0.0000
116	H	L	0.0556
117	V	L	0.0000
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-0.7315
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-1.1852
124	L	L	0.0000
125	T	L	-0.1916
126	V	L	0.0265
127	L	L	1.3428