Project name: clone105

Chain sequence(s)	H: QVQLVQSGAEVKNPGASVRLSCLTSGYTFATNGLHWVRQAPGQGPEWMGWINAGNGDTQYSRAFQGRLSLTRDTSASTTYLDLASLTSEDTAIYYCARGSTRWLQTDHLDHWGQGTLVTVSS; L: DIQLTQTPSSLSAAVGDRVSITCRASRPIRNSLAWFQQKPGQAPKSLIYGTSTLHSGVPSKFSGSGSGSEFTLTINNLQPEDFATYYCQQYDTYPITFGQGTRLETK
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                                          (00:00:54)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:55)

• Minimal score value: -2.7329
• Maximal score value: 1.1887
• Average score: -0.5845
• Total score value: -133.8503

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	-1.4538
2	V	H	-0.9399
3	Q	H	-1.1972
4	L	H	0.0000
5	V	H	0.2920
6	Q	H	0.0000
7	S	H	-0.3490
8	G	H	-0.5076
9	A	H	0.3471
11	E	H	0.1831
12	V	H	1.1717
13	K	H	-0.5173
14	N	H	-1.5176
15	P	H	-1.3515
16	G	H	-1.1109
17	A	H	-0.8818
18	S	H	-1.1113
19	V	H	0.0000
20	R	H	-2.0130
21	L	H	0.0000
22	S	H	-0.2223
23	C	H	0.0000
24	L	H	0.8964
25	T	H	0.0000
26	S	H	-0.4005
27	G	H	-0.9315
28	Y	H	-0.3289
29	T	H	-0.0743
30	F	H	0.0000
35	A	H	-0.5601
36	T	H	-0.4803
37	N	H	0.0000
38	G	H	-0.6116
39	L	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	-0.5301
45	A	H	-0.9338
46	P	H	-1.0031
47	G	H	-1.3178
48	Q	H	-1.9079
49	G	H	-1.3789
50	P	H	0.0000
51	E	H	-1.0407
52	W	H	0.0000
53	M	H	0.0000
54	G	H	0.0000
55	W	H	-0.2042
56	I	H	0.0000
57	N	H	-1.5995
58	A	H	0.0000
59	G	H	-1.3365
62	N	H	-1.9885
63	G	H	-1.7510
64	D	H	-1.9647
65	T	H	-1.0340
66	Q	H	-0.8521
67	Y	H	-0.7558
68	S	H	-1.0867
69	R	H	-2.3369
70	A	H	-1.2945
71	F	H	0.0000
72	Q	H	-1.9726
74	G	H	-1.4249
75	R	H	-1.0970
76	L	H	0.0000
77	S	H	-0.7348
78	L	H	0.0000
79	T	H	-0.7745
80	R	H	-0.8985
81	D	H	-0.8172
82	T	H	-0.7940
83	S	H	-0.4927
84	A	H	-0.1917
85	S	H	-0.1064
86	T	H	0.0000
87	T	H	0.0000
88	Y	H	-0.4242
89	L	H	0.0000
90	D	H	-1.0867
91	L	H	0.0000
92	A	H	-0.8255
93	S	H	-0.7967
94	L	H	0.0000
95	T	H	-1.2865
96	S	H	-1.4850
97	E	H	-1.9848
98	D	H	0.0000
99	T	H	-0.3821
100	A	H	0.0000
101	I	H	0.6663
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	-0.3814
107	G	H	0.0000
108	S	H	-0.1443
109	T	H	-0.2054
110	R	H	-0.4813
111	W	H	1.0192
111A	L	H	1.1887
112A	Q	H	-0.2984
112	T	H	-0.2029
113	D	H	-0.2289
114	H	H	0.0000
115	L	H	0.0000
116	D	H	0.0000
117	H	H	-0.8496
118	W	H	-0.5780
119	G	H	0.0000
120	Q	H	-1.3985
121	G	H	-0.4778
122	T	H	0.0000
123	L	H	1.0440
124	V	H	0.0000
125	T	H	0.1888
126	V	H	0.0000
127	S	H	-0.8240
128	S	H	-0.7944
1	D	L	-2.3647
2	I	L	0.0000
3	Q	L	-2.2399
4	L	L	0.0000
5	T	L	-1.2658
6	Q	L	0.0000
7	T	L	-0.5523
8	P	L	-0.4249
9	S	L	-0.8011
10	S	L	-0.7878
11	L	L	-0.6347
12	S	L	-1.0593
13	A	L	0.0000
14	A	L	-0.9015
15	V	L	-0.1994
16	G	L	-1.3908
17	D	L	-2.3057
18	R	L	-2.7329
19	V	L	0.0000
20	S	L	-0.6698
21	I	L	0.0000
22	T	L	-0.6867
23	C	L	0.0000
24	R	L	-2.3643
25	A	L	0.0000
26	S	L	-1.9203
27	R	L	-2.4215
28	P	L	-1.9210
29	I	L	0.0000
36	R	L	-2.6184
37	N	L	-1.8108
38	S	L	0.0000
39	L	L	0.0000
40	A	L	0.0000
41	W	L	0.0000
42	F	L	0.0000
43	Q	L	-0.8555
44	Q	L	-1.2481
45	K	L	-1.6656
46	P	L	-1.1236
47	G	L	-1.4060
48	Q	L	-2.0859
49	A	L	-1.3535
50	P	L	0.0000
51	K	L	-1.2103
52	S	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.2774
56	G	L	-0.4612
57	T	L	0.0000
65	S	L	-0.2441
66	T	L	0.1293
67	L	L	0.3044
68	H	L	-0.0953
69	S	L	-0.3460
70	G	L	-0.4940
71	V	L	-0.2534
72	P	L	-0.3286
74	S	L	-0.3704
75	K	L	-1.0668
76	F	L	0.0000
77	S	L	-0.2967
78	G	L	-0.2148
79	S	L	-0.6672
80	G	L	-1.2517
83	S	L	-1.5962
84	G	L	-1.8843
85	S	L	-1.9354
86	E	L	-2.0219
87	F	L	0.0000
88	T	L	-0.6260
89	L	L	0.0000
90	T	L	0.0000
91	I	L	0.0000
92	N	L	-1.9877
93	N	L	-2.3356
94	L	L	0.0000
95	Q	L	-1.1792
96	P	L	-0.8203
97	E	L	-1.4894
98	D	L	0.0000
99	F	L	-0.6972
100	A	L	0.0000
101	T	L	-1.0489
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	Q	L	0.0000
106	Q	L	0.0000
107	Y	L	0.0000
108	D	L	-0.7700
109	T	L	-0.3196
114	Y	L	-0.0965
115	P	L	0.0000
116	I	L	0.0000
117	T	L	-0.6834
118	F	L	-0.4635
119	G	L	0.0000
120	Q	L	-1.7313
121	G	L	0.0000
122	T	L	0.0000
123	R	L	-1.6862
124	L	L	0.0000
125	E	L	-1.2068
126	T	L	-0.8493
127	K	L	-1.6999