Project name: 58db5749fd05571

Chain sequence(s)	H: EVQLVQSGAEVKKPGSSVKVSCKASGGTFSSYAISWVRQAPGQGLEWMGGIIPIFGTANYAQKFQGRVTITADKSTSTAYMELSSLRSEDTAVYYCARAPLRFLEWSTQDHYYYYYMDVWGKGTTVTVSS; L: SSELTQDPAVSVALGQTVRITCQGDSLRSYYATWYQQKPGQAPILVIYGENKRPSGIPDRFSGSSSGNTASLTITGAQAEDEADYYCKSRDGSGQHLVFGGGTKLTVL
Selected Chain(s)	H,L
Distance of aggregation	10 Å
FoldX usage	No
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]       runJob:   FoldX not utilized. Treating input pdb file as it was already optimized.    (00:00:00)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:01)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:03)

• Minimal score value: -3.1196
• Maximal score value: 2.782
• Average score: -0.482
• Total score value: -114.7047

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	-2.0588
2	V	H	-1.1489
3	Q	H	-1.0825
4	L	H	0.0000
5	V	H	0.7258
6	Q	H	-0.1342
7	S	H	-0.5938
8	G	H	-0.4438
9	A	H	-0.0241
10	E	H	-0.0034
11	V	H	1.0892
12	K	H	-0.6781
13	K	H	-1.8726
14	P	H	-2.2202
15	G	H	-1.6215
16	S	H	-1.2606
17	S	H	-1.4181
18	V	H	0.0000
19	K	H	-1.9971
20	V	H	0.0000
21	S	H	-0.4937
22	C	H	0.0000
23	K	H	-0.6362
24	A	H	-0.4641
25	S	H	-0.7881
26	G	H	-1.2783
27	G	H	-0.9812
28	T	H	-0.4851
29	F	H	0.0000
30	S	H	0.3672
31	S	H	0.8477
32	Y	H	0.6490
33	A	H	0.8550
34	I	H	0.0000
35	S	H	0.0000
36	W	H	0.0000
37	V	H	0.0000
38	R	H	0.0000
39	Q	H	-0.5859
40	A	H	-0.9874
41	P	H	-0.8087
42	G	H	-1.2378
43	Q	H	-1.7215
44	G	H	-1.1539
45	L	H	0.0000
46	E	H	-0.7631
47	W	H	0.0000
48	M	H	0.0000
49	G	H	0.0000
50	G	H	-0.0800
51	I	H	0.0000
52	I	H	1.4887
53	P	H	0.0000
54	I	H	2.4602
55	F	H	2.7820
56	G	H	0.9813
57	T	H	0.6834
58	A	H	0.0208
59	N	H	-0.9505
60	Y	H	-1.2353
61	A	H	-1.6406
62	Q	H	-2.5485
63	K	H	-2.7237
64	F	H	0.0000
65	Q	H	-2.4662
66	G	H	-1.6296
67	R	H	-1.4355
68	V	H	0.0000
69	T	H	-0.8272
70	I	H	0.0000
71	T	H	-0.3411
72	A	H	-0.3308
73	D	H	-1.3173
74	K	H	-1.7551
75	S	H	-1.2258
76	T	H	-0.9687
77	S	H	-1.2529
78	T	H	0.0000
79	A	H	0.0000
80	Y	H	-0.4899
81	M	H	0.0000
82	E	H	-1.4048
83	L	H	0.0000
84	S	H	-1.2145
85	S	H	-1.2569
86	L	H	0.0000
87	R	H	-3.1196
88	S	H	-2.3670
89	E	H	-2.6140
90	D	H	0.0000
91	T	H	-0.8555
92	A	H	0.0000
93	V	H	0.1334
94	Y	H	0.0000
95	Y	H	0.0000
96	C	H	0.0000
97	A	H	0.0000
98	R	H	-0.1497
99	A	H	0.0000
100	P	H	0.8743
101	L	H	1.9743
102	R	H	1.7574
103	F	H	2.4386
104	L	H	1.8895
105	E	H	-0.3873
106	W	H	-0.0449
107	S	H	-0.8648
108	T	H	-1.7304
109	Q	H	-2.5094
110	D	H	-2.7311
111	H	H	-1.3236
112	Y	H	1.1585
113	Y	H	1.2554
114	Y	H	1.3545
115	Y	H	0.7755
116	Y	H	0.0000
117	M	H	0.0000
118	D	H	-0.2611
119	V	H	-0.4191
120	W	H	0.0000
121	G	H	0.0000
122	K	H	-1.5550
123	G	H	-0.8152
124	T	H	0.0000
125	T	H	0.0056
126	V	H	0.0000
127	T	H	-0.2274
128	V	H	0.0000
129	S	H	-0.9900
130	S	H	-0.7301
1	S	L	-1.1722
2	S	L	-1.5346
3	E	L	-2.2490
4	L	L	0.0000
5	T	L	-1.0564
6	Q	L	0.0000
7	D	L	-0.7344
8	P	L	-0.7498
9	A	L	-0.5074
10	V	L	-0.3288
11	S	L	0.1705
12	V	L	0.0000
13	A	L	0.8434
14	L	L	1.2721
15	G	L	-0.3373
16	Q	L	-0.9322
17	T	L	-0.8654
18	V	L	0.0000
19	R	L	-1.0218
20	I	L	0.0000
21	T	L	-0.5262
22	C	L	0.0000
23	Q	L	-1.6071
24	G	L	-1.9008
25	D	L	-2.4105
26	S	L	0.0000
27	L	L	-1.4976
28	R	L	-2.4369
29	S	L	-1.2753
30	Y	L	-0.0181
31	Y	L	0.5470
32	A	L	0.0000
33	T	L	0.0000
34	W	L	0.0000
35	Y	L	0.0000
36	Q	L	0.0000
37	Q	L	0.0000
38	K	L	-1.1177
39	P	L	-1.0822
40	G	L	-1.0422
41	Q	L	-1.4473
42	A	L	-0.8003
43	P	L	0.0000
44	I	L	1.0059
45	L	L	0.0000
46	V	L	0.0000
47	I	L	0.0000
48	Y	L	-0.5392
49	G	L	-0.2301
50	E	L	-0.8087
51	N	L	-1.4673
52	K	L	-2.2361
53	R	L	-1.9745
54	P	L	-1.0967
55	S	L	-0.8968
56	G	L	-0.8090
57	I	L	-0.5247
58	P	L	-1.1175
59	D	L	-2.1506
60	R	L	0.0000
61	F	L	0.0000
62	S	L	-1.2303
63	G	L	-0.9518
64	S	L	-0.6741
65	S	L	-0.6982
66	S	L	-0.8728
67	G	L	-1.5059
68	N	L	-1.6862
69	T	L	-1.0450
70	A	L	0.0000
71	S	L	0.0000
72	L	L	0.0000
73	T	L	-0.6026
74	I	L	0.0000
75	T	L	-1.0328
76	G	L	-0.7128
77	A	L	0.0000
78	Q	L	-0.7776
79	A	L	-0.4783
80	E	L	-1.6672
81	D	L	0.0000
82	E	L	-1.2723
83	A	L	0.0000
84	D	L	-1.1178
85	Y	L	0.0000
86	Y	L	0.0000
87	C	L	0.0000
88	K	L	0.0000
89	S	L	0.0000
90	R	L	-0.4437
91	D	L	0.0000
92	G	L	-1.4366
93	S	L	-0.8128
94	G	L	-0.6825
95	Q	L	-1.3155
96	H	L	-0.9894
97	L	L	-0.3589
98	V	L	-0.5445
99	F	L	-0.3249
100	G	L	0.0000
101	G	L	-1.0372
102	G	L	0.0000
103	T	L	0.0000
104	K	L	-1.2453
105	L	L	0.0000
106	T	L	0.1851
107	V	L	0.6589
108	L	L	1.7976