Project name: SH3_V141W

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	VA141W
Energy difference between WT (input) and mutated protein (by FoldX)	0.868592 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: 1.2454
• Average score: -0.9532
• Total score value: -54.3347

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	0.3359
86	L	A	0.6114
87	F	A	0.7900
88	V	A	0.3898
89	A	A	0.0000
90	L	A	-0.0691
91	Y	A	-0.5370
92	D	A	-2.5183
93	Y	A	-1.9312
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	-2.6204
105	K	A	-2.2394
106	G	A	-1.1806
107	E	A	-1.0046
108	K	A	-0.3139
109	F	A	0.0000
110	Q	A	-0.4539
111	I	A	-0.0300
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	-1.6476
124	S	A	0.0000
125	L	A	0.2275
126	T	A	-0.3252
127	T	A	-0.7614
128	G	A	-1.3390
129	E	A	-2.2304
130	T	A	-1.6859
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	-1.1501
137	Y	A	-0.1425
138	V	A	0.0000
139	A	A	0.2880
140	P	A	0.4842
141	W	A	1.2454	mutated: VA141W