Project name: SH3_T130H

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	TA130H
Energy difference between WT (input) and mutated protein (by FoldX)	0.200107 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: -3.1741
• Maximal score value: 1.7964
• Average score: -1.0036
• Total score value: -57.2063

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	0.4749
86	L	A	0.7416
87	F	A	0.8751
88	V	A	0.4066
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	-2.6257
96	R	A	-2.9852
97	T	A	-2.6608
98	E	A	-3.1025
99	D	A	-3.1741
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.2881
103	F	A	0.0000
104	H	A	-2.7282
105	K	A	-2.4059
106	G	A	-1.4581
107	E	A	-1.3042
108	K	A	-0.6509
109	F	A	0.0000
110	Q	A	-0.7111
111	I	A	-0.1501
112	L	A	0.1620
113	N	A	-0.8468
114	S	A	-1.1526
115	S	A	-1.5818
116	E	A	-2.5668
117	G	A	-2.1392
118	D	A	-2.4501
119	W	A	-1.1145
120	W	A	-1.0456
121	E	A	-1.3444
122	A	A	0.0000
123	R	A	-1.8989
124	S	A	0.0000
125	L	A	0.0331
126	T	A	-0.3853
127	T	A	-0.8162
128	G	A	-1.3812
129	E	A	-2.4527
130	H	A	-2.4712	mutated: TA130H
131	G	A	-1.8711
132	Y	A	-1.0392
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9268
136	N	A	-1.1504
137	Y	A	-0.1243
138	V	A	0.0000
139	A	A	0.4158
140	P	A	0.7547
141	V	A	1.7964