Project name: SH3_D118N

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	DA118N
Energy difference between WT (input) and mutated protein (by FoldX)	-0.467664 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: -0.9278
• Total score value: -52.8819

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	0.9246
88	V	A	0.4313
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	-2.6259
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	-2.4059
106	G	A	-1.4581
107	E	A	-1.3078
108	K	A	-0.6426
109	F	A	0.0000
110	Q	A	-0.5092
111	I	A	-0.0563
112	L	A	0.1428
113	N	A	-0.8373
114	S	A	-1.0706
115	S	A	-1.5170
116	E	A	-2.4630
117	G	A	-1.9103
118	N	A	-1.9404	mutated: DA118N
119	W	A	-0.8569
120	W	A	-0.9168
121	E	A	-1.0976
122	A	A	0.0000
123	R	A	-1.7156
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	-1.4993
132	Y	A	-0.8072
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.7537
136	N	A	-1.0532
137	Y	A	-0.1222
138	V	A	0.0000
139	A	A	0.4170
140	P	A	0.7757
141	V	A	1.7964