Project name: SH3_T126H

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	TA126H
Energy difference between WT (input) and mutated protein (by FoldX)	-0.247415 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: -3.1041
• Maximal score value: 1.793
• Average score: -1.0142
• Total score value: -57.8071

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	0.9166
88	V	A	0.4203
89	A	A	0.0000
90	L	A	-0.1545
91	Y	A	-0.5758
92	D	A	-2.5630
93	Y	A	-1.9351
94	E	A	-2.6497
95	A	A	-2.6301
96	R	A	-2.9868
97	T	A	-2.6621
98	E	A	-3.1041
99	D	A	-3.0446
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.2171
103	F	A	0.0000
104	H	A	-2.8320
105	K	A	-2.4114
106	G	A	-1.5626
107	E	A	-1.5492
108	K	A	-0.8676
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	-1.8462
124	S	A	0.0000
125	L	A	-0.3989
126	H	A	-1.3932	mutated: TA126H
127	T	A	-1.2598
128	G	A	-1.5998
129	E	A	-2.3869
130	T	A	-1.6924
131	G	A	-1.5008
132	Y	A	-0.8688
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