Project name: 2510-13.pdb

Chain sequence(s)	H: EVQLVESGGDLVKPGGSLKLSCAASGFTFSSYGMSWVRQTPDKRLEWVATISSGGSYTYYPDSVKGRFTISRDNAKNTLYLQMSSLKSEDTAMYYCARTGAFDYWGQGTTLTVSS; L: DIVMTQAAFSNPVTLGTSASISCRSSKSLLHSNGITYLYWYLQKPGQSPQLLIYQMSNLASGVPDRFSSSGSGTDFTLRISRVEAEDVGVYYCAQNLELPLTFGAGTRLEIK
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                                          (00:02:15)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:17)

• Minimal score value: -3.3014
• Maximal score value: 1.1728
• Average score: -0.5709
• Total score value: -129.6

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	-1.9763
2	V	H	-0.9702
3	Q	H	-0.8141
4	L	H	0.0000
5	V	H	1.0941
6	E	H	0.0000
7	S	H	-0.5167
8	G	H	-1.1986
9	G	H	-1.0399
11	D	H	-1.4422
12	L	H	0.3215
13	V	H	-0.7051
14	K	H	-2.0210
15	P	H	-1.7752
16	G	H	-1.4017
17	G	H	-0.9578
18	S	H	-1.0792
19	L	H	-0.8236
20	K	H	-1.7296
21	L	H	0.0000
22	S	H	-0.2953
23	C	H	0.0000
24	A	H	-0.0517
25	A	H	0.0000
26	S	H	-0.8443
27	G	H	-1.0867
28	F	H	-0.4236
29	T	H	-0.1881
30	F	H	0.0000
35	S	H	-0.7996
36	S	H	-0.2132
37	Y	H	0.1538
38	G	H	0.0080
39	M	H	0.0000
40	S	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	0.0000
45	T	H	-2.0941
46	P	H	-2.0848
47	D	H	-3.1528
48	K	H	-3.3014
49	R	H	-3.2134
50	L	H	0.0000
51	E	H	-1.0450
52	W	H	0.0000
53	V	H	0.0000
54	A	H	0.0000
55	T	H	0.4963
56	I	H	0.0000
57	S	H	0.1823
58	S	H	-0.2572
59	G	H	-0.6045
62	G	H	-0.3358
63	S	H	0.1496
64	Y	H	1.1728
65	T	H	0.8463
66	Y	H	0.6825
67	Y	H	-0.4866
68	P	H	-1.3552
69	D	H	-2.4907
70	S	H	-1.7863
71	V	H	0.0000
72	K	H	-2.5540
74	G	H	-1.7334
75	R	H	-1.4921
76	F	H	0.0000
77	T	H	-0.8327
78	I	H	0.0000
79	S	H	-0.3547
80	R	H	-1.0896
81	D	H	-1.6866
82	N	H	-1.7865
83	A	H	-1.4082
84	K	H	-2.3482
85	N	H	-1.7784
86	T	H	-1.0105
87	L	H	0.0000
88	Y	H	-0.4934
89	L	H	0.0000
90	Q	H	-1.4110
91	M	H	0.0000
92	S	H	-1.0248
93	S	H	-1.0757
94	L	H	0.0000
95	K	H	-2.4333
96	S	H	-2.0422
97	E	H	-2.4135
98	D	H	0.0000
99	T	H	-0.6953
100	A	H	0.0000
101	M	H	-0.0916
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	0.0000
107	T	H	-0.1789
108	G	H	-0.3518
114	A	H	-0.2152
115	F	H	0.0000
116	D	H	-0.2978
117	Y	H	0.1145
118	W	H	-0.0041
119	G	H	0.0000
120	Q	H	-1.0900
121	G	H	0.0000
122	T	H	0.0000
123	T	H	-0.3747
124	L	H	0.0000
125	T	H	-0.5502
126	V	H	0.0000
127	S	H	-0.8900
128	S	H	-0.6770
1	D	L	-1.5576
2	I	L	0.0000
3	V	L	0.6608
4	M	L	0.0000
5	T	L	-0.4421
6	Q	L	-0.1528
7	A	L	0.2220
8	A	L	0.7488
9	F	L	1.0818
10	S	L	-0.2903
11	N	L	-1.4086
12	P	L	-1.2861
13	V	L	0.0000
14	T	L	-0.7239
15	L	L	0.0163
16	G	L	-0.6132
17	T	L	-0.4449
18	S	L	-0.8376
19	A	L	0.0000
20	S	L	-1.0913
21	I	L	0.0000
22	S	L	-1.0882
23	C	L	0.0000
24	R	L	-2.2404
25	S	L	0.0000
26	S	L	-1.0317
27	K	L	-1.5558
28	S	L	-0.8638
29	L	L	0.0000
30	L	L	0.4601
31	H	L	-0.5135
32	S	L	-0.9144
34	N	L	-1.4135
35	G	L	-0.6764
36	I	L	0.2642
37	T	L	0.0000
38	Y	L	0.3242
39	L	L	0.0000
40	Y	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	L	L	0.0000
44	Q	L	-0.9897
45	K	L	-1.5185
46	P	L	-0.9730
47	G	L	-1.4399
48	Q	L	-2.0396
49	S	L	-1.3088
50	P	L	0.0000
51	Q	L	-1.0307
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.1498
56	Q	L	0.2568
57	M	L	0.1263
65	S	L	-0.2830
66	N	L	-0.3619
67	L	L	-0.0794
68	A	L	-0.1167
69	S	L	-0.4149
70	G	L	-0.6750
71	V	L	0.0000
72	P	L	-1.0092
74	D	L	-1.9309
75	R	L	0.0000
76	F	L	0.0000
77	S	L	-1.2193
78	S	L	0.0000
79	S	L	-0.8125
80	G	L	-0.7886
83	S	L	-0.6282
84	G	L	-0.5029
85	T	L	-1.3299
86	D	L	-1.8470
87	F	L	0.0000
88	T	L	-1.1143
89	L	L	0.0000
90	R	L	-1.8623
91	I	L	0.0000
92	S	L	-1.3935
93	R	L	-1.5787
94	V	L	0.0000
95	E	L	-1.3272
96	A	L	-0.9730
97	E	L	-1.9925
98	D	L	0.0000
99	V	L	-0.6556
100	G	L	-0.9132
101	V	L	-0.2812
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	A	L	0.0000
106	Q	L	0.0000
107	N	L	-0.3757
108	L	L	-0.3162
109	E	L	-1.1455
114	L	L	-0.0076
115	P	L	-0.5026
116	L	L	0.0000
117	T	L	-0.0995
118	F	L	0.0000
119	G	L	0.0000
120	A	L	-0.9127
121	G	L	0.0000
122	T	L	0.0000
123	R	L	-0.5687
124	L	L	0.0000
125	E	L	-1.3272
126	I	L	-0.7651
127	K	L	-1.6279