Project name: SH3_T127N

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	TA127N
Energy difference between WT (input) and mutated protein (by FoldX)	0.369382 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: -3.103
• Maximal score value: 1.7964
• Average score: -1.0141
• Total score value: -57.8059

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	0.9197
88	V	A	0.4228
89	A	A	0.0000
90	L	A	-0.1552
91	Y	A	-0.5782
92	D	A	-2.5638
93	Y	A	-1.9320
94	E	A	-2.6458
95	A	A	-2.6265
96	R	A	-2.9854
97	T	A	-2.6610
98	E	A	-3.1030
99	D	A	-3.0418
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.1806
103	F	A	0.0000
104	H	A	-2.7368
105	K	A	-2.4143
106	G	A	-1.4712
107	E	A	-1.4730
108	K	A	-0.7786
109	F	A	0.0000
110	Q	A	-0.5075
111	I	A	-0.0553
112	L	A	0.1447
113	N	A	-0.8883
114	S	A	-1.1799
115	S	A	-1.5966
116	E	A	-2.5603
117	G	A	-2.1347
118	D	A	-2.4456
119	W	A	-1.1053
120	W	A	-1.0569
121	E	A	-1.1506
122	A	A	0.0000
123	R	A	-1.8340
124	S	A	0.0000
125	L	A	-0.2586
126	T	A	-1.0250
127	N	A	-1.9548	mutated: TA127N
128	G	A	-1.8384
129	E	A	-2.4087
130	T	A	-1.7371
131	G	A	-1.4444
132	Y	A	-0.8655
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9214
136	N	A	-1.1508
137	Y	A	-0.1246
138	V	A	0.0000
139	A	A	0.4158
140	P	A	0.7757
141	V	A	1.7964