[gmx-users] S2Min and S2Max

Dechang Li li.dc06 at gmail.com
Sat Jan 3 13:02:57 CET 2009


Dear all,

	After running the g_chi, a file named as "order.xvg" is generated. In this
file, I found that there are S2min and S2max values for each amino acid residue.

	What is the difference between S2 min and max? 
	Here is part of my order.xvg

@ s0 legend "S2Min"
@ s1 legend "S2Max"
@ s2 legend "Phi"
@ s3 legend "Psi"
@ s4 legend "Omega"
#Res.      S2Min      S2Max        Phi        Psi      Omega 
    1      0.833      0.871      0.871      0.833      0.000 
    2      0.746      0.974      0.746      0.938      0.974 
    3      0.909      0.977      0.961      0.909      0.977 
    4      0.902      0.975      0.902      0.969      0.975 
    5      0.965      0.980      0.965      0.980      0.978 
    6      0.960      0.977      0.977      0.960      0.973 
    7      0.945      0.977      0.945      0.977      0.975 
    8      0.971      0.976      0.975      0.971      0.976 
    9      0.877      0.983      0.983      0.877      0.977 
   10      0.855      0.976      0.855      0.963      0.976 
   11      0.923      0.978      0.977      0.923      0.978 
   12      0.831      0.974      0.831      0.967      0.974 



Thanks alot!!! 





Best regards,
2009-1-3


========================================= 
Dechang Li, PhD Candidate
Department of Engineering Mechanics
Tsinghua University
Beijing 100084
PR China 

Tel:   +86-10-62773779(O) 
Email: li.dc06 at gmail.com
=========================================

  




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