Project name: 2510-8.pdb

Chain sequence(s)	H: QVQLQQSGAELVKPGASVKLSCTASGFNIKDTYMHWVKQRPEQGLEWIGRIDPANGNTYYAPKFQGKATITADTSSNTAYLQLSSLTSEDTAVYYCVGGNLFVYWGQGTLVTVSS; L: DVVMTQTPLSLPVSLGDQASISCRSSQSIVHSNGNTYLEWYLQKPGQSPKLLIYKVSNRFSGVPDRFSGSGSGTDFTLKISRVEAEDLGVYYCFQGSHVPWTFGGGTKLELK
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:01:47)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:49)

• Minimal score value: -2.832
• Maximal score value: 1.3773
• Average score: -0.5536
• Total score value: -125.6632

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	-1.3960
2	V	H	-0.9567
3	Q	H	-1.3777
4	L	H	0.0000
5	Q	H	-1.6420
6	Q	H	-1.1164
7	S	H	-0.7162
8	G	H	-0.4516
9	A	H	0.5071
11	E	H	0.6188
12	L	H	1.2716
13	V	H	-0.0751
14	K	H	-1.6288
15	P	H	-1.3701
16	G	H	-1.1214
17	A	H	-0.8648
18	S	H	-0.8974
19	V	H	-0.6141
20	K	H	-1.2373
21	L	H	0.0000
22	S	H	-0.5279
23	C	H	0.0000
24	T	H	-0.7398
25	A	H	0.0000
26	S	H	-0.9514
27	G	H	-0.9527
28	F	H	-1.0545
29	N	H	-1.6663
30	I	H	0.0000
35	K	H	-2.8320
36	D	H	-2.7797
37	T	H	-1.5004
38	Y	H	-0.6871
39	M	H	0.0000
40	H	H	-0.1410
41	W	H	0.0000
42	V	H	0.0000
43	K	H	0.0000
44	Q	H	-0.7727
45	R	H	-1.4044
46	P	H	-1.5379
47	E	H	-2.4440
48	Q	H	-2.0948
49	G	H	-1.3074
50	L	H	0.0000
51	E	H	-0.9334
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	R	H	-0.1997
56	I	H	0.0000
57	D	H	-1.4897
58	P	H	0.0000
59	A	H	-1.9516
62	N	H	-2.1096
63	G	H	-1.9197
64	N	H	-1.7937
65	T	H	-0.6742
66	Y	H	0.3059
67	Y	H	0.0868
68	A	H	0.0000
69	P	H	-1.1182
70	K	H	-1.6762
71	F	H	0.0000
72	Q	H	-1.7745
74	G	H	-1.3753
75	K	H	-1.2616
76	A	H	0.0000
77	T	H	-0.6343
78	I	H	0.0000
79	T	H	-0.5559
80	A	H	-0.7271
81	D	H	-0.9849
82	T	H	-0.9944
83	S	H	-0.7616
84	S	H	-0.5839
85	N	H	-0.8593
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.2405
89	L	H	0.0000
90	Q	H	-0.9835
91	L	H	0.0000
92	S	H	-0.7786
93	S	H	-0.8464
94	L	H	0.0000
95	T	H	-1.2039
96	S	H	-1.2578
97	E	H	-1.7938
98	D	H	0.0000
99	T	H	-0.2932
100	A	H	0.0000
101	V	H	0.5009
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	V	H	0.0000
106	G	H	0.0000
107	G	H	-0.5869
108	N	H	-0.9353
114	L	H	0.4693
115	F	H	0.2828
116	V	H	0.0000
117	Y	H	0.0063
118	W	H	0.0000
119	G	H	0.0000
120	Q	H	-1.6202
121	G	H	-0.6086
122	T	H	0.0000
123	L	H	1.1985
124	V	H	0.0000
125	T	H	0.3200
126	V	H	0.0000
127	S	H	-0.5906
128	S	H	-0.7643
1	D	L	-1.1517
2	V	L	0.0000
3	V	L	0.7824
4	M	L	0.0000
5	T	L	-0.3739
6	Q	L	0.0000
7	T	L	-0.1292
8	P	L	0.3771
9	L	L	1.1552
10	S	L	0.1426
11	L	L	-0.0253
12	P	L	-0.6912
13	V	L	0.0000
14	S	L	-0.2409
15	L	L	0.5322
16	G	L	-0.8329
17	D	L	-1.3174
18	Q	L	-1.9470
19	A	L	0.0000
20	S	L	-0.8452
21	I	L	0.0000
22	S	L	-0.7823
23	C	L	0.0000
24	R	L	-2.1770
25	S	L	0.0000
26	S	L	-0.7666
27	Q	L	-1.0151
28	S	L	-0.6644
29	I	L	0.0000
30	V	L	0.4236
31	H	L	-0.5728
32	S	L	-0.9698
34	N	L	-1.6311
35	G	L	-1.0807
36	N	L	-0.8686
37	T	L	-0.2865
38	Y	L	0.0141
39	L	L	0.0000
40	E	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	L	L	0.0000
44	Q	L	-1.0153
45	K	L	-1.5321
46	P	L	-0.9225
47	G	L	-1.2179
48	Q	L	-1.6328
49	S	L	-1.2114
50	P	L	0.0000
51	K	L	-1.3239
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-0.5130
56	K	L	-0.9832
57	V	L	-0.7906
65	S	L	-1.1512
66	N	L	-1.7603
67	R	L	-1.7860
68	F	L	-0.5766
69	S	L	-0.6008
70	G	L	-0.7732
71	V	L	-0.9355
72	P	L	-1.1105
74	D	L	-2.1247
75	R	L	0.0000
76	F	L	0.0000
77	S	L	-1.2677
78	G	L	-0.9896
79	S	L	-0.9139
80	G	L	-0.9610
83	S	L	-0.6982
84	G	L	-0.6465
85	T	L	-1.3168
86	D	L	-1.9013
87	F	L	0.0000
88	T	L	-0.9298
89	L	L	0.0000
90	K	L	-1.4202
91	I	L	0.0000
92	S	L	-1.9158
93	R	L	-1.9643
94	V	L	0.0000
95	E	L	-0.9847
96	A	L	-0.7100
97	E	L	-1.9978
98	D	L	0.0000
99	L	L	-0.5841
100	G	L	0.0000
101	V	L	-0.2184
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	F	L	0.0000
106	Q	L	0.0000
107	G	L	0.0000
108	S	L	0.0000
109	H	L	0.3203
114	V	L	1.3773
115	P	L	0.4261
116	W	L	0.5595
117	T	L	0.0000
118	F	L	0.1979
119	G	L	0.0000
120	G	L	-0.2981
121	G	L	-0.1859
122	T	L	0.0000
123	K	L	-0.7443
124	L	L	0.0000
125	E	L	-0.4364
126	L	L	0.5864
127	K	L	-0.9680