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. Author manuscript; available in PMC: 2011 Jul 7.
Published in final edited form as: J Am Chem Soc. 2010 Jul 7;132(26):8973–8983. doi: 10.1021/ja1007867

Table 1.

Statistical information for the hIAPP and hIAPP-Zn+2 structural ensembles

IAPP IAPP+Zn2+
Distance constraints Total 435 460
Intraresidual 156 171
Interresidual 279 289
Sequential (i-j = 1) 135 153
Medium (i-j = 2–4) 144 136
Structural statistics Violated distance constraints 0 4
Violated angle constraints 0 0
RMSD of all backbone atoms (Å)
Q10 – L27 0.47 ± 0.19
Q10 – T30 0.33 ± 0.12
RMSD of all heavy atoms (Å)
Q10 – L27 1.15 ± 0.34
Q10 – T30 1.21 ± 0.26
Ramachandran plot Residues in most favored region (%) 72.1 64.5
Residues in additionally allowed region (%) 22.4 29.4
Residues in generously allowed region (%) 5.5 6.1