Project name: SH3_E94T

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	EA94T
Energy difference between WT (input) and mutated protein (by FoldX)	-0.0217744 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: -3.1064
• Maximal score value: 1.7964
• Average score: -0.8634
• Total score value: -49.2131

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	0.5173
86	L	A	0.7932
87	F	A	0.9242
88	V	A	0.4320
89	A	A	0.0000
90	L	A	-0.1521
91	Y	A	-0.4012
92	D	A	-2.1745
93	Y	A	-1.0979
94	T	A	-0.9146	mutated: EA94T
95	A	A	-1.7761
96	R	A	-2.5694
97	T	A	-2.4562
98	E	A	-3.1064
99	D	A	-3.0467
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-1.5261
103	F	A	0.0000
104	H	A	-2.4798
105	K	A	-2.4071
106	G	A	-1.4570
107	E	A	-1.3055
108	K	A	-0.6415
109	F	A	0.0000
110	Q	A	-0.5091
111	I	A	-0.0568
112	L	A	0.1429
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	-1.1530
122	A	A	0.0000
123	R	A	-1.7155
124	S	A	0.0000
125	L	A	0.0596
126	T	A	-0.4724
127	T	A	-0.8204
128	G	A	-1.3572
129	E	A	-2.2443
130	T	A	-1.6964
131	G	A	-1.5039
132	Y	A	-0.8716
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9206
136	N	A	-1.1504
137	Y	A	-0.1262
138	V	A	0.0000
139	A	A	0.4158
140	P	A	0.7757
141	V	A	1.7964