Project name: SH3_V141I

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	VA141I
Energy difference between WT (input) and mutated protein (by FoldX)	-0.0619383 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: 2.0159
• Average score: -0.9354
• Total score value: -53.3181

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	0.8017
87	F	A	0.9708
88	V	A	0.4804
89	A	A	0.0000
90	L	A	-0.1102
91	Y	A	-0.5344
92	D	A	-2.5198
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	-2.6730
105	K	A	-2.2982
106	G	A	-1.2078
107	E	A	-1.2031
108	K	A	-0.5889
109	F	A	0.0000
110	Q	A	-0.5228
111	I	A	-0.0727
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	-1.6977
124	S	A	0.0000
125	L	A	0.1460
126	T	A	-0.3975
127	T	A	-0.7914
128	G	A	-1.3219
129	E	A	-2.2214
130	T	A	-1.6797
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	-0.1371
138	V	A	0.0000
139	A	A	0.4646
140	P	A	0.8514
141	I	A	2.0159	mutated: VA141I