Project name: SH3_N136T

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	NA136T
Energy difference between WT (input) and mutated protein (by FoldX)	0.61034 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: -0.8941
• Total score value: -50.9641

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	0.9351
88	V	A	0.4457
89	A	A	0.0000
90	L	A	0.0488
91	Y	A	-0.4304
92	D	A	-2.5458
93	Y	A	-1.9156
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	-2.3935
106	G	A	-1.4581
107	E	A	-1.3078
108	K	A	-0.6426
109	F	A	0.0000
110	Q	A	-0.5091
111	I	A	-0.0564
112	L	A	0.1429
113	N	A	-0.8875
114	S	A	-1.1779
115	S	A	-1.5952
116	E	A	-2.5582
117	G	A	-2.1302
118	D	A	-2.2226
119	W	A	-0.9098
120	W	A	-0.9246
121	E	A	-1.1522
122	A	A	0.0000
123	R	A	-1.7155
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	-1.4992
132	Y	A	-0.8668
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.3071
136	T	A	0.0987	mutated: NA136T
137	Y	A	0.5521
138	V	A	0.0000
139	A	A	0.6580
140	P	A	0.7757
141	V	A	1.7964