Project name: cl3

Chain sequence(s)	H: QVQLQESGGGVVQPGRSLRLSCAASGFTFSSYAIHWVRQAPGKGLEWVAVISYDGSNRYYADSVKGRFTISRDNSKNTLYLQMNSLRPEDTAVYYCARDRFSAVASTPTYHNYFYMDVWGKGTTVTVSS
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: -1.9897
• Maximal score value: 2.275
• Average score: -0.2331
• Total score value: -30.0663

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	-1.1158
2	V	H	-0.0475
3	Q	H	-1.1156
4	L	H	0.0000
5	Q	H	-0.5993
6	E	H	0.0000
7	S	H	-0.2243
8	G	H	-0.4582
9	G	H	-0.2960
11	G	H	0.0772
12	V	H	1.7317
13	V	H	0.0000
14	Q	H	-1.2271
15	P	H	-0.4597
16	G	H	-0.8501
17	R	H	-1.9564
18	S	H	-0.5204
19	L	H	0.0189
20	R	H	-1.0459
21	L	H	0.0000
22	S	H	-0.0070
23	C	H	0.0000
24	A	H	0.0458
25	A	H	0.0000
26	S	H	-0.2631
27	G	H	-0.3870
28	F	H	0.1878
29	T	H	-0.0197
30	F	H	0.0000
35	S	H	-0.1533
36	S	H	-0.1836
37	Y	H	0.3118
38	A	H	0.0000
39	I	H	0.0000
40	H	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	-0.4093
45	A	H	0.0000
46	P	H	-0.3389
47	G	H	-0.7115
48	K	H	-1.2958
49	G	H	-0.5920
50	L	H	0.2447
51	E	H	-0.3153
52	W	H	0.1203
53	V	H	0.0000
54	A	H	0.0000
55	V	H	0.0000
56	I	H	0.0000
57	S	H	0.0714
58	Y	H	0.3059
59	D	H	-1.5234
62	G	H	-0.3993
63	S	H	-0.3163
64	N	H	-0.8321
65	R	H	-1.6222
66	Y	H	0.1751
67	Y	H	0.3131
68	A	H	-0.2693
69	D	H	-1.9897
70	S	H	-0.4557
71	V	H	0.0000
72	K	H	-1.9703
74	G	H	-0.8176
75	R	H	-0.3452
76	F	H	0.0000
77	T	H	-0.0740
78	I	H	0.0000
79	S	H	-0.0912
80	R	H	-0.2928
81	D	H	-0.5433
82	N	H	-0.6645
83	S	H	-0.5966
84	K	H	-1.8831
85	N	H	-1.1669
86	T	H	-0.1483
87	L	H	0.0000
88	Y	H	0.2562
89	L	H	0.0000
90	Q	H	-0.4277
91	M	H	0.0000
92	N	H	-0.4738
93	S	H	-0.3233
94	L	H	0.0000
95	R	H	-1.8420
96	P	H	-0.8641
97	E	H	-1.6932
98	D	H	0.0000
99	T	H	-0.0176
100	A	H	0.0000
101	V	H	0.4690
102	Y	H	0.0000
103	Y	H	0.1851
104	C	H	0.0000
105	A	H	0.0000
106	R	H	0.0000
107	D	H	0.0000
108	R	H	-1.4900
109	F	H	1.5661
110	S	H	0.1397
111	A	H	0.2936
111A	V	H	1.7835
111B	A	H	0.3337
111C	S	H	-0.2145
111D	T	H	-0.1100
112E	P	H	-0.0878
112D	T	H	-0.0385
112C	Y	H	0.0466
112B	H	H	-1.0953
112A	N	H	-0.7481
112	Y	H	1.5054
113	F	H	2.2750
114	Y	H	0.9349
115	M	H	0.0000
116	D	H	-1.2489
117	V	H	0.0247
118	W	H	0.3985
119	G	H	-0.3140
120	K	H	-1.7277
121	G	H	-0.3580
122	T	H	-0.0344
123	T	H	-0.0018
124	V	H	0.0000
125	T	H	0.1827
126	V	H	0.0000
127	S	H	-0.1298
128	S	H	-0.2296