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Jan Jensen edited begin_table_label_table_ensembles__.tex
almost 9 years ago
Commit id: deb797fa341a56eff1c78956e167d7adea758c21
deletions | additions
diff --git a/begin_table_label_table_ensembles__.tex b/begin_table_label_table_ensembles__.tex
index a1428f7..9049e9d 100644
--- a/begin_table_label_table_ensembles__.tex
+++ b/begin_table_label_table_ensembles__.tex
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\label{table:ensembles}
\caption{Comparison to experimental values. Computed using raw NMR ensemble structures. Outliers have not been removed. Number of structures in ensemble indicated in parentheses}
\begin{center}
\begin{tabular}{
l c c c c c c c }
\hline
& CA & CB & C & HA & H & N \\ \hline
& RMSD (\textit{r}) & RMSD (\textit{r}) & RMSD (\textit{r}) & RMSD (\textit{r}) & RMSD (\textit{r}) & RMSD (\textit{r}) \\
ProCS15 & & & & & & \\
xx 1UBQ (1) & 1.7 (0.73) & 2.0 (0.50) & 1.8 (0.86) & 0.3 (0.82) & 0.6 (0.94) & 3.9 (0.80) \\
xx 1D3Z (10) & 1.3 (0.80) & 1.7 (0.62) & 1.7 (0.74) & 0.3
(0.84) (0.82) & 0.5 (0.66) &
3.4 (0.83) 3.2 (0.82) \\
xx 2K39 (116) & 1.2 (0.82) & 1.7 (0.52) & 1.7 (0.68) & 0.3
(0.84) (0.82) & 0.5
(0.62) (0.61) &
3.8 (0.70) 3.6 (0.69) \\
xx 1XQQ (128) & 1.2 (0.82) & 1.8 (0.49) & 1.7 (0.72) &
0.2 (0.88) 0.3 (0.85) & 0.5 (0.61) &
3.9 (0.74) 3.7 (0.73) \\
xx 2LJ5 (301) & 1.2 (0.84) & 1.7 (0.55) & 1.6 (0.68) & 0.3
(0.84) (0.83) & 0.6 (0.58) &
3.8 (0.75) 3.5 (0.73) \\
xx 2KOX (640) & 1.0 (0.87) & 1.7 (0.56) & 1.6 (0.70) & 0.2
(0.90) (0.88) & 0.5 (0.65) &
3.7 (0.79) 3.5 (0.78) \\
CheShift & & & & & & \\
xx & 1.9 (0.58) & 1.9 (0.47) & & & & \\
xx & 1.3 (0.76) & 1.3 (0.70) & & & & \\
...
xx & 1.3 (0.81) & 1.6 (0.56) & & & & \\
xx & 1.2 (0.82) & 1.4 (0.65) & & & & \\
xx & 1.2 (0.83) & 1.4 (0.66) & & & & \\
Camshift & & & & & & \\
xx & 1.7 (0.75) & 0.6 (0.52) & 1.2 (0.74) & 0.4 (0.72) & 1.9 (0.58) & 4.5 (0.54) \\
xx & 1.0 (0.87) & 1.2 (0.75) & 0.9 (0.85) & 0.3 (0.81) & 0.5 (0.70) & 2.7 (0.72) \\
xx & 1.1 (0.84) & 1.2 (0.80) & 1.0 (0.83) & 0.2 (0.88) & 0.4 (0.73) & 2.9 (0.65) \\
xx & 1.1 (0.84) & 1.2 (0.77) & 0.9 (0.85) & 0.2 (0.88) & 0.5 (0.68) & 2.9 (0.64) \\
xx & 1.0 (0.86) & 1.4 (0.68) & 0.9 (0.85) & 0.2 (0.88) & 0.5 (0.71) & 3.1 (0.59) \\
xx & 1.0 (0.88) & 1.1 (0.78) & 0.9 (0.85) & 0.2 (0.86) & 0.4 (0.73) & 2.8 (0.67) \\
ppm & & & & & & \\
xx & 0.7 (0.94) & 0.6 (0.49) & 0.9 (0.85) & 0.2 (0.88) & 1.1 (0.84) & 2.2 (0.81) \\
xx & 0.6 (0.96) & 0.9 (0.88) & 0.8 (0.89) & 0.2 (0.89) & 0.4 (0.78) & 1.8 (0.89) \\
xx & 0.8 (0.95) & 1.0 (0.88) & 0.8 (0.89) & 0.2 (0.92) & 0.4 (0.78) & 2.2 (0.81) \\
xx & 0.8 (0.91) & 1.1 (0.84) & 0.8 (0.88) & 0.2 (0.92) & 0.4 (0.73) & 2.2 (0.82) \\
xx & 0.6 (0.95) & 0.9 (0.88) & 0.8 (0.89) & 0.2 (0.93) & 0.4 (0.74) & 2.1 (0.84) \\
xx & 0.6 (0.96) & 0.9 (0.89) & 0.8 (0.89) & 0.2 (0.94) & 0.4 (0.78) & 2.0 (0.85) \\
Sparta+ & & & & & & \\
xx & 0.7 (0.94) & 1.0 (0.85) & 0.9 (0.86) & 0.2 (0.91) & 0.6 (0.48) & 2.0 (0.84) \\
xx & 0.6 (0.95) & 0.9 (0.87) & 1.0 (0.83) & 0.2 (0.90) & 0.4 (0.77) & 1.8 (0.88) \\
xx & 0.7 (0.95) & 0.9 (0.88) & 1.0 (0.85) & 0.2 (0.94) & 0.4 (0.78) & 2.2 (0.83) \\
xx & 0.7 (0.93) & 1.0 (0.86) & 1.0 (0.84) & 0.2 (0.94) & 0.4 (0.72) & 2.2 (0.82) \\
xx & 0.6 (0.96) & 0.9 (0.88) & 1.0 (0.84) & 0.1 (0.96) & 0.4 (0.76) & 2.1 (0.84) \\
xx & 0.6 (0.96) & 0.9 (0.89) & 1.0 (0.84) & 0.1 (0.96) & 0.4 (0.77) & 2.0 (0.86) \\
Shaic & & & & & & \\
xx & 0.7 (0.93) & 0.5 (0.69) & 0.8 (0.89) & 0.3 (0.83) & 1.1 (0.83) & 2.0 (0.84) \\
xx & 0.6 (0.95) & 1.0 (0.85) & 0.7 (0.91) & 0.2 (0.86) & 0.4 (0.77) & 1.8 (0.87) \\
xx & 0.7 (0.94) & 1.0 (0.84) & 0.7 (0.92) & 0.2 (0.86) & 0.4 (0.78) & 2.1 (0.83) \\
xx & 0.7 (0.94) & 1.1 (0.80) & 0.7 (0.91) & 0.2 (0.86) & 0.4 (0.72) & 2.2 (0.82) \\
xx & 0.6 (0.95) & 1.0 (0.86) & 0.7 (0.91) & 0.2 (0.88) & 0.4 (0.75) & 2.1 (0.84) \\
xx & 0.7 (0.94) & 1.0 (0.85) & 0.7 (0.91) & 0.2 (0.85) & 0.4 (0.74) & 2.0 (0.86) \\
ShiftX2 & & & & & & \\
xx & 0.5 (0.97) & 0.4 (0.97) & 0.4 (0.97) & 0.0 (1.00) & 0.1 (0.98) & 1.3 (0.94) \\
xx & 0.4 (0.98) & 0.7 (0.94) & 0.6 (0.95) & 0.1 (0.97) & 0.2 (0.93) & 1.6 (0.91) \\
xx & 0.4 (0.98) & 0.7 (0.93) & 0.7 (0.93) & 0.1 (0.98) & 0.2 (0.92) & 2.1 (0.85) \\
xx & 0.5 (0.97) & 0.8 (0.91) & 0.7 (0.93) & 0.1 (0.99) & 0.3 (0.90) & 2.0 (0.86) \\
xx & 0.4 (0.98) & 0.6 (0.95) & 0.7 (0.94) & 0.1 (0.99) & 0.3 (0.92) & 1.9 (0.87) \\
xx & 0.4 (0.98) & 0.6 (0.95) & 0.7 (0.93) & 0.0 (0.99) & 0.2 (0.92) & 1.8 (0.88) \\
\hline
\end{tabular}
\end{center}
\end{table}