Project name: 197

Chain sequence(s)	H: QVQLQESGGGSAQAGGSLKLSCTVSGNPNSSNCMGWFRQAPGKQREEVASISTHTGKTYYRDAVKGRFTISLNNAKNTLYLQMNSLKPEDTAIYYCAAAPPYSVSCRYNTAGQGTQVTVSS
Selected Chain(s)	H
Distance of aggregation	5 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 H 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                                          (00:00:00)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:01)

• Minimal score value: -2.0953
• Maximal score value: 1.7159
• Average score: -0.3552
• Total score value: -42.9834

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	-1.1033
2	V	H	0.0458
3	Q	H	-1.1028
4	L	H	0.0000
5	Q	H	-1.2352
6	E	H	-0.4500
7	S	H	-0.2678
8	G	H	-0.4500
9	G	H	-0.2899
11	G	H	-0.2905
12	S	H	-0.2548
13	A	H	-0.2523
14	Q	H	-1.2015
15	A	H	-0.2732
16	G	H	-0.5167
17	G	H	-0.2885
18	S	H	-0.2810
19	L	H	-0.0982
20	K	H	-1.6941
21	L	H	0.0000
22	S	H	0.0145
23	C	H	0.0000
24	T	H	-0.0183
25	V	H	0.1397
26	S	H	-0.1864
27	G	H	-0.5138
28	N	H	-0.5953
29	P	H	-0.4944
30	N	H	-0.9333
35	S	H	-0.3722
36	S	H	-0.1602
37	N	H	-0.4525
38	C	H	0.0098
39	M	H	0.0000
40	G	H	0.0000
41	W	H	0.0000
42	F	H	0.0000
43	R	H	0.0000
44	Q	H	-0.5109
45	A	H	0.0000
46	P	H	-0.3391
47	G	H	-0.6509
48	K	H	-1.0872
49	Q	H	-1.5354
50	R	H	-1.4001
51	E	H	-0.7253
52	E	H	-0.8469
53	V	H	0.0000
54	A	H	0.0000
55	S	H	-0.0249
56	I	H	0.0000
57	S	H	-0.0187
58	T	H	-0.1991
59	H	H	-1.0056
62	T	H	-0.3303
63	G	H	-0.7806
64	K	H	-1.7881
65	T	H	-0.0992
66	Y	H	1.3663
67	Y	H	0.4081
68	R	H	-1.0327
69	D	H	-2.0953
70	A	H	-0.2612
71	V	H	0.0000
72	K	H	-1.9707
74	G	H	-0.8329
75	R	H	-0.4236
76	F	H	0.0000
77	T	H	-0.0588
78	I	H	0.0000
79	S	H	-0.0515
80	L	H	0.1365
81	N	H	-1.0207
82	N	H	-1.4970
83	A	H	-0.4702
84	K	H	-1.8009
85	N	H	-1.0943
86	T	H	-0.1252
87	L	H	0.0000
88	Y	H	0.3608
89	L	H	0.0000
90	Q	H	-0.5181
91	M	H	0.0000
92	N	H	-0.8031
93	S	H	-0.3810
94	L	H	0.0000
95	K	H	-1.3358
96	P	H	-0.6612
97	E	H	-1.8388
98	D	H	0.0000
99	T	H	-0.0160
100	A	H	0.0000
101	I	H	0.8656
102	Y	H	0.0000
103	Y	H	0.1327
104	C	H	0.0000
105	A	H	0.0000
106	A	H	0.0115
107	A	H	0.0000
108	P	H	-0.3322
109	P	H	0.0772
110	Y	H	1.2553
111	S	H	0.3401
112A	V	H	1.7159
112	S	H	0.3083
113	C	H	0.0981
114	R	H	-1.7267
115	Y	H	-0.3518
116	N	H	-1.2402
117	T	H	-0.2510
118	A	H	0.0213
119	G	H	-0.2905
120	Q	H	-1.2314
121	G	H	-0.2925
122	T	H	-0.1426
123	Q	H	-0.4885
124	V	H	0.0000
125	T	H	-0.0528
126	V	H	0.0000
127	S	H	-0.2532
128	S	H	-0.2300