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. 2016 Aug 8;21(8):1028. doi: 10.3390/molecules21081028

Table A3.

Residues detected as putative HS on mtGS PPI and their classification as HS, WS or NS. In the columns “A” to “L”, each one referring to a GS chain, an x indicates that the residue on that monomer was detected as a potential HS (buried area ≥ 40 Å2). If the residue was detected in at least 10 monomers, ΔΔGbind was determined by cASM and his classification (HS/WS/NS) is presented in the last column.

Resid A B C D E F G H I J K L Tested Classif
20 x x x x x x x x x x x x Yes NS
31 x x x x x x x x x x x x Yes NS
32 x x x No
33 x x No
34 x x x x x x x x x x x x Yes HS
35 x x x x x x x x x x x Yes NS
36 x x x x x x x x x x No
40 x x x No
54 x x x x x x x x x No
59 x x x x x No
64 x x x x x x x x x x x x Yes HS
65 x x x x x x x x x x x x Yes NS
66 x x No
68 x x x x x x x x x x x x Yes NS
84 x x x x x x x x x x x x Yes HS
99 x x x x x x x x x x x x Yes NS
141 x x x x x No
142 x x x x x x x x x x x Yes WS
143 x x x x x No
144 x x x x x x x x x x x x Yes WS
146 x No
147 x x x x x x No
149 x x x x x x x x x x x x Yes WS
151 x x x x x x x x x x x Yes NS
152 x x x x x x x x x No
153 x x x x x x x x x x x x Yes HS
154 x x x x x x x x x x x Yes NS
161 x x x x x x x No
162 x x No
164 x x x x x x x x x x No
175 x x x x x x x No
176 x x x x x x x x x x x x Yes HS
178 x x x x x x x x x x x x Yes WS
179 x x x x x No
181 x x x x x x x x x x x x Yes HS
186 x x x x x x x x x x x x Yes WS
187 x x x x x x x x x x x x Yes WS
189 x x x x x x x x x x x x Yes WS
194 x No
196 x x x x x x x x x x x Yes NS
197 x No
199 x x x x No
200 x x x x x x x x x x x x Yes NS
203 x x x x x x x x x No
207 x x No
212 x x No
213 x x x No
214 x x x x x No
215 x x x x x x x x x x No
247 x x x x x No
250 x x x x x x x x x x x x Yes HS
251 x x x x x x No
254 x x x x x x x x x x x x Yes HS
T261 x x x x x No
M263 x x x x x x x x x x x x Yes HS
P265 x x No
F268 x x x x x x x x x x x x Yes WS
N325 x x x No
Y327 x No
K328 x x x x x x x x x x x Yes HS
V331 x x x No
R345 x x x x x x x x x x x x Yes HS
N346 x No
R347 x x x x x x x x x x x x Yes HS
R352 x x No
I355 x x x x x x x x x x x x Yes WS
T356 x No
D404 x x x x x x x x No
T421 x x x x No
Q422 x x x x x x x x x x No
S424 x No
E457 x No
E459 x x x No
V463 x x x x x x x x x x x x Yes HS
N464 x x x x x x x x x x No
I465 x x x x x x x x x x x x Yes NS
R466 x x x x x x x x x x x x Yes HS
H468 x x x x x x x x x x x x Yes HS
Y470 x x x x x x x x x x x x Yes WS
E471 x x x x x x x x x x x x Yes HS
F472 x x x x x x x x x x x x Yes HS
L474 x x x x x x x x x x x Yes WS
Y475 x x x x x x x x x x x x Yes HS
Y476 x x x x x x x x x x x x Yes HS
D477 x x x x x x x x x x x x Yes NS
V478 x x x x x x x x x x x x No