Project name: SH3_S135F

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	SA135F
Energy difference between WT (input) and mutated protein (by FoldX)	-0.364635 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: 1.7956
• Average score: -0.9175
• Total score value: -52.2994

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	0.5174
86	L	A	0.7929
87	F	A	1.0076
88	V	A	0.4493
89	A	A	0.0000
90	L	A	-0.1121
91	Y	A	-0.5436
92	D	A	-2.5411
93	Y	A	-1.9103
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	-2.7282
105	K	A	-2.3893
106	G	A	-1.4584
107	E	A	-1.3082
108	K	A	-0.6430
109	F	A	0.0000
110	Q	A	-0.5111
111	I	A	0.0010
112	L	A	0.1385
113	N	A	-0.8955
114	S	A	-1.0946
115	S	A	-1.5985
116	E	A	-2.5615
117	G	A	-2.0549
118	D	A	-2.2660
119	W	A	-0.9170
120	W	A	-0.9225
121	E	A	-1.0965
122	A	A	0.0000
123	R	A	-1.7181
124	S	A	0.0000
125	L	A	0.0589
126	T	A	-0.4730
127	T	A	-0.8207
128	G	A	-1.3572
129	E	A	-2.2401
130	T	A	-1.6922
131	G	A	-1.5044
132	Y	A	-0.7993
133	I	A	0.0000
134	P	A	0.0000
135	F	A	-0.3141	mutated: SA135F
136	N	A	-0.8173
137	Y	A	0.1850
138	V	A	0.0000
139	A	A	0.5377
140	P	A	0.7746
141	V	A	1.7956