Project name: SH3_N136M

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	NA136M
Energy difference between WT (input) and mutated protein (by FoldX)	-0.512045 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: -0.8473
• Total score value: -48.2936

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	0.9323
88	V	A	0.4422
89	A	A	0.0000
90	L	A	0.2011
91	Y	A	-0.3228
92	D	A	-2.5492
93	Y	A	-1.9195
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	-2.3965
106	G	A	-1.4581
107	E	A	-1.3078
108	K	A	-0.6426
109	F	A	0.0000
110	Q	A	-0.5089
111	I	A	-0.0561
112	L	A	0.1433
113	N	A	-0.9019
114	S	A	-1.1996
115	S	A	-1.6082
116	E	A	-2.5778
117	G	A	-2.1596
118	D	A	-2.0691
119	W	A	-0.8488
120	W	A	-0.8551
121	E	A	-1.1763
122	A	A	0.0000
123	R	A	-1.7153
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	-1.6927
131	G	A	-1.5116
132	Y	A	-0.8985
133	I	A	0.0000
134	P	A	0.0000
135	S	A	0.1920
136	M	A	1.1956	mutated: NA136M
137	Y	A	1.0622
138	V	A	0.0000
139	A	A	0.8603
140	P	A	0.7757
141	V	A	1.7964