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Lars Andersen Bratholm edited Delta_sigma_i__HB_in__.tex
over 8 years ago
Commit id: a35b11401c2e0ddbcb69dc1bc64c66b2562257bf
deletions | additions
diff --git a/Delta_sigma_i__HB_in__.tex b/Delta_sigma_i__HB_in__.tex
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--- a/Delta_sigma_i__HB_in__.tex
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$\Delta\sigma^i_{HB}$ in Eq \ref{eqn:procs} is the effect of hydrogen bonding to the amide H ($\Delta\sigma^i_{1^\circ HB}$) and O ($\Delta\sigma^i_{2^\circ HB}$) atoms of residue $i$ on the chemical shielding of the backbone atoms
(i.e. this (this term is zero for C$\beta$)
\begin{equation}
\label{eqn:sigmahb}
\Delta \sigma^i_{HB}=\Delta\sigma^i_{1^\circ HB}(r_{\mathrm{HO}},\theta,\rho)+\Delta\sigma^i_{2^\circ HB}(r_{\mathrm{OH}},\theta_{\mathrm{O}},\rho_{\mathrm{O}})
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