Project name: SH3_S114G

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	SA114G
Energy difference between WT (input) and mutated protein (by FoldX)	0.147921 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: 1.7964
• Average score: -0.9645
• Total score value: -54.9742

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	0.5264
86	L	A	0.8049
87	F	A	0.9341
88	V	A	0.4313
89	A	A	0.0000
90	L	A	-0.1511
91	Y	A	-0.5748
92	D	A	-2.5599
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	-2.7282
105	K	A	-2.4059
106	G	A	-1.4581
107	E	A	-1.3078
108	K	A	-0.6369
109	F	A	0.0000
110	Q	A	-0.4805
111	I	A	-0.0296
112	L	A	0.1416
113	N	A	-0.9340
114	G	A	-1.3010	mutated: SA114G
115	S	A	-1.6616
116	E	A	-2.5982
117	G	A	-2.1657
118	D	A	-2.4697
119	W	A	-1.1211
120	W	A	-1.0753
121	E	A	-1.1599
122	A	A	0.0000
123	R	A	-1.7001
124	S	A	0.0000
125	L	A	0.0592
126	T	A	-0.4730
127	T	A	-0.8207
128	G	A	-1.3572
129	E	A	-2.2401
130	T	A	-1.6865
131	G	A	-1.4899
132	Y	A	-0.8687
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9312
136	N	A	-1.1479
137	Y	A	-0.1243
138	V	A	0.0000
139	A	A	0.4158
140	P	A	0.7757
141	V	A	1.7964