<html><body><div style="color:#000; background-color:#fff; font-family:times new roman, new york, times, serif;font-size:12pt"><div>Dear All</div><div> </div><div>I run a 1ns MD on a membrane protein and I get these values for box coordinate's</div><div>
</div><div style="margin: 0cm 0cm 0pt;"><span style='font-family: "Verdana","sans-serif"; font-size: 10pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: EN-US;' lang="EN-US">Energy<span style="mso-spacerun: yes;"> </span>Average<span style="mso-spacerun: yes;"> </span>Err.Est.<span style="mso-spacerun: yes;"> </span>RMSD<span style="mso-spacerun: yes;">
</span>Tot-Drift<?xml:namespace prefix = o ns = "urn:schemas-microsoft-com:office:office" /><o:p></o:p></span></div><div>
</div><div style="margin: 0cm 0cm 0pt;"><span style='font-family: "Verdana","sans-serif"; font-size: 10pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: EN-US;' lang="EN-US">-------------------------------------------------------------------------------<o:p></o:p></span></div><div>
</div><div style="margin: 0cm 0cm 0pt;"><span style='font-family: "Verdana","sans-serif"; font-size: 10pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: EN-US;' lang="EN-US">Box-X<span style="mso-spacerun: yes;"> </span>13.867<span style="mso-spacerun: yes;"> </span>0.071<span style="mso-spacerun: yes;">
</span>0.167634<span style="mso-spacerun: yes;"> </span>0.48292<span style="mso-spacerun: yes;"> </span>(nm)<o:p></o:p></span></div><div>
</div><div style="margin: 0cm 0cm 0pt;"><span style='font-family: "Verdana","sans-serif"; font-size: 10pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: EN-US;' lang="EN-US">Box-Y<span style="mso-spacerun: yes;"> </span>13.867<span style="mso-spacerun: yes;"> </span>0.071<span style="mso-spacerun: yes;">
</span>0.167634<span style="mso-spacerun: yes;"> </span>0.48292<span style="mso-spacerun: yes;"> </span>(nm)<o:p></o:p></span></div><div>
</div><div style="margin: 0cm 0cm 0pt;"><span style='font-family: "Verdana","sans-serif"; font-size: 10pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: EN-US;' lang="EN-US">Box-Z<span style="mso-spacerun: yes;"> </span>9.15929<span style="mso-spacerun: yes;"> </span>0.095<span style="mso-spacerun: yes;">
</span>0.222463<span style="mso-spacerun: yes;"> </span>-0.642479<span style="mso-spacerun: yes;"> </span>(nm)<o:p></o:p></span></div><div>
</div><div style="margin: 0cm 0cm 0pt;"><span style='font-family: "Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: EN-US;' lang="EN-US"><o:p><font size="3" face="Times New Roman"> </font></o:p></span></div><div>
BoxX and BoxY fluctuate between <span style='line-height: 115%; font-family: "Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: IT; mso-fareast-font-family: Calibri; mso-fareast-theme-font: minor-latin; mso-fareast-language: EN-US; mso-bidi-language: AR-SA;'>13,5 and
14,2 nm , BoxZ <font size="3"><font face="Times New Roman">fluctuate between <span style='line-height: 115%; font-family: "Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: IT; mso-fareast-font-family: Calibri; mso-fareast-theme-font: minor-latin; mso-fareast-language: EN-US; mso-bidi-language: AR-SA;'>8,6 e 9,6
nm.</span></font></font></span></div><div><span style='line-height: 115%; font-family: "Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: IT; mso-fareast-font-family: Calibri; mso-fareast-theme-font: minor-latin; mso-fareast-language: EN-US; mso-bidi-language: AR-SA;'><font size="3"><font face="Times New Roman"><span style='line-height: 115%; font-family: "Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: IT; mso-fareast-font-family: Calibri; mso-fareast-theme-font: minor-latin; mso-fareast-language: EN-US; mso-bidi-language: AR-SA;'>These values seem not to reach a convergence.</span></font></font></span></div><div><span style='line-height: 115%; font-family: "Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: IT;
mso-fareast-font-family: Calibri; mso-fareast-theme-font: minor-latin; mso-fareast-language: EN-US; mso-bidi-language: AR-SA;'><font size="3"><font face="Times New Roman"><span style='line-height: 115%; font-family: "Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: IT; mso-fareast-font-family: Calibri; mso-fareast-theme-font: minor-latin; mso-fareast-language: EN-US; mso-bidi-language: AR-SA;'>Which could be the cause? How can I fix it?</span></font></font></span></div><div><span style='line-height: 115%; font-family: "Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: IT; mso-fareast-font-family: Calibri; mso-fareast-theme-font: minor-latin; mso-fareast-language: EN-US; mso-bidi-language: AR-SA;'><font size="3"><font face="Times New Roman"><span style='line-height: 115%; font-family:
"Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: IT; mso-fareast-font-family: Calibri; mso-fareast-theme-font: minor-latin; mso-fareast-language: EN-US; mso-bidi-language: AR-SA;'></span></font></font></span> </div><div><span style='line-height: 115%; font-family: "Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: IT; mso-fareast-font-family: Calibri; mso-fareast-theme-font: minor-latin; mso-fareast-language: EN-US; mso-bidi-language: AR-SA;'><font size="3"><font face="Times New Roman"><span style='line-height: 115%; font-family: "Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: IT; mso-fareast-font-family: Calibri; mso-fareast-theme-font: minor-latin; mso-fareast-language: EN-US; mso-bidi-language:
AR-SA;'>Thanks</span></font></font></span></div><div><span style='line-height: 115%; font-family: "Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: IT; mso-fareast-font-family: Calibri; mso-fareast-theme-font: minor-latin; mso-fareast-language: EN-US; mso-bidi-language: AR-SA;'><font size="3"><font face="Times New Roman"><span style='line-height: 115%; font-family: "Verdana","sans-serif"; font-size: 11pt; mso-bidi-font-family: Calibri; mso-bidi-theme-font: minor-latin; mso-ansi-language: IT; mso-fareast-font-family: Calibri; mso-fareast-theme-font: minor-latin; mso-fareast-language: EN-US; mso-bidi-language: AR-SA;'></span></font></font></span> </div></div></body></html>