Project name: SH3_T126G

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	TA126G
Energy difference between WT (input) and mutated protein (by FoldX)	0.10426 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: 1.793
• Average score: -0.9899
• Total score value: -56.4259

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	0.7888
87	F	A	0.9041
88	V	A	0.3948
89	A	A	0.0000
90	L	A	-0.1667
91	Y	A	-0.5862
92	D	A	-2.5721
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	-2.7997
105	K	A	-2.4368
106	G	A	-1.5479
107	E	A	-1.5033
108	K	A	-0.7923
109	F	A	0.0000
110	Q	A	-0.5123
111	I	A	-0.0591
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	-1.7731
124	S	A	0.0000
125	L	A	-0.1570
126	G	A	-0.8921	mutated: TA126G
127	T	A	-1.0222
128	G	A	-1.4618
129	E	A	-2.3029
130	T	A	-1.6920
131	G	A	-1.4992
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	-0.1243
138	V	A	0.0000
139	A	A	0.4134
140	P	A	0.7731
141	V	A	1.7930