Project name: SH3_V88I

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	VA88I
Energy difference between WT (input) and mutated protein (by FoldX)	-0.208403 kcal/mol Changes in protein stability upon mutation are calculated using the FoldX forcefield. Computational prediction of protein stability is used with the intention of preventing the experimental characterization of proteins bearing mutations that significantly destabilize their structure. Mutations resulting in a predicted reduction in protein stability ≥ 1 kcal/mol are considered disruptive.

• Minimal score value: -3.1028
• Maximal score value: 1.8839
• Average score: -0.9226
• Total score value: -52.5864

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
85	T	A	0.5370
86	L	A	0.8623
87	F	A	1.0729
88	I	A	0.7255	mutated: VA88I
89	A	A	0.0000
90	L	A	-0.0497
91	Y	A	-0.5175
92	D	A	-2.5346
93	Y	A	-1.9315
94	E	A	-2.6452
95	A	A	-2.6259
96	R	A	-2.9852
97	T	A	-2.6608
98	E	A	-3.1028
99	D	A	-3.0434
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.2059
103	F	A	0.0000
104	H	A	-2.6514
105	K	A	-2.2751
106	G	A	-1.2094
107	E	A	-1.1171
108	K	A	-0.4204
109	F	A	0.0000
110	Q	A	-0.4580
111	I	A	-0.0489
112	L	A	0.1430
113	N	A	-0.8879
114	S	A	-1.1794
115	S	A	-1.5962
116	E	A	-2.5599
117	G	A	-2.1340
118	D	A	-2.4444
119	W	A	-1.1028
120	W	A	-1.0557
121	E	A	-1.1529
122	A	A	0.0000
123	R	A	-1.6936
124	S	A	0.0000
125	L	A	0.1479
126	T	A	-0.4181
127	T	A	-0.8007
128	G	A	-1.3446
129	E	A	-2.2334
130	T	A	-1.6879
131	G	A	-1.4991
132	Y	A	-0.8673
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9206
136	N	A	-1.1504
137	Y	A	-0.0926
138	V	A	0.0000
139	A	A	0.5074
140	P	A	0.8380
141	V	A	1.8839