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Syntax
XANGle {<Angle-statement>} END
<Angle-statement> :==
ASSIgn <sel> <sel> <real> <real> <real>
! Detected nucleus, Coupled nucleus, theta, phi, err
! Error is defined as the accepted deviation from unity
! of the cosine squared of the angle between the observed
! and calculated vector orientations.
CLASsification <name>
! Starts a new class.
FORCeconstant <real>
! Force constant for the given class.
NREStraints <integer>
! Number of slots for orientational restraints to
! allocate in memory.
PRINt THREshold <real>
! Prints violations greater than the specified value. This
! value is calculated as the deviation from unity of the
! cosine squared of the angle between the observed and
! calculated vector orientations.
RESEt
! Erases the restraints table, but keeps NRES the same.
Xplor-NIH 2024-09-13