XEASY Atom List

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Atom List

The XEASY atom list is simply a formatted text file containing the following columns: atom number, chemical shift, chemical shift error, atom name, and a residue or spin system number (an example is shown below). The atom list is one of the most important files and should be backed up regularly.

  • Example of XEASY atom list 


...
190 113.905   0.000 N      3
191   8.295   0.000 HN     3
192  58.246   0.000 CA     3
193   4.376   0.000 HA     3
194  63.386   0.000 CB     3
195   3.979   0.000 HB2    3
196   3.893   0.004 HB3    3
197 999.000   0.000 QB     3
199 999.000   0.000 HG     3
200 999.000   0.000 C      3 
...













-- Main.GaohuaLiu - 14 Jun 2007









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