Project name: SH3_T97H

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	TA97H
Energy difference between WT (input) and mutated protein (by FoldX)	0.277433 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: -3.5802
• Maximal score value: 1.7964
• Average score: -1.0062
• Total score value: -57.3534

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	0.9234
88	V	A	0.4306
89	A	A	0.0000
90	L	A	-0.1515
91	Y	A	-0.5751
92	D	A	-2.5603
93	Y	A	-1.9317
94	E	A	-2.7548
95	A	A	-2.8935
96	R	A	-3.4295
97	H	A	-3.5802	mutated: TA97H
98	E	A	-3.5526
99	D	A	-3.3434
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.3134
103	F	A	0.0000
104	H	A	-2.7290
105	K	A	-2.4066
106	G	A	-1.4592
107	E	A	-1.3102
108	K	A	-0.6438
109	F	A	0.0000
110	Q	A	-0.5091
111	I	A	-0.0568
112	L	A	0.1429
113	N	A	-0.8890
114	S	A	-1.1810
115	S	A	-1.5972
116	E	A	-2.5613
117	G	A	-2.1362
118	D	A	-2.4481
119	W	A	-1.1102
120	W	A	-1.0594
121	E	A	-1.1547
122	A	A	0.0000
123	R	A	-1.7155
124	S	A	0.0000
125	L	A	0.0587
126	T	A	-0.4736
127	T	A	-0.8209
128	G	A	-1.3572
129	E	A	-2.2402
130	T	A	-1.6927
131	G	A	-1.5002
132	Y	A	-0.8697
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9230
136	N	A	-1.1515
137	Y	A	-0.1251
138	V	A	0.0000
139	A	A	0.4158
140	P	A	0.7757
141	V	A	1.7964