GARANT COMMANDS: check inconsistencies - check assigned peaks for inconsistencies

USAGE: check inconsistencies

The mean frequency of the coherences is calulated from the assigned peaks. 
All peaks differing more than a tolerance specified are listed. The 
allowed tolerance within one spectrum is defined for each dimesnion and 
each spectrum by the spectra variables <spectype>_acc_w1, 
<spectype>_acc_w2. The allowed deviation from the global mean value is 
'picck_acc' times the deviation allowed within the same spectrum.


EXAMPLE:

	# define tolerances
   ...
   set NOESY_acc_w1 = 0.025
   set NOESY_acc_w2 = 0.025
   ...
   set D2ONOESY_acc_w1 = 0.025
   set D2ONOESY_acc_w2 = 0.025
   ...
   set N15NOESY_acc_w1 = 0.3
   set N15NOESY_acc_w2 = 0.025
   set N15NOESY_acc_w3 = 0.025
   ...
   set pick_acc = 3
   ...
	# load assignments of the three different NOESY spectra
   load  assignments NOESY    $dir/zqnoe-434a    $dir/zqnoe-434aud 0.0
   load  assignments D2ONOESY $dir/zqnoe-434d20  $dir/zqnoe-434d20 0.0
   load  assignments N15NOESY $dir/3dnoe-434a    $dir/3dnoe-434d   0.0
	# check for inconsistencies
   check inconsistencies
   ...


EXAMPLE OF OUTPUT:

HA1(GLY 62) at   3.475 has inconsistent assignments involving
    105   3.085 ppm,  NOESY: HA1(GLY 62) HN(GLY 62)                
    597   3.579 ppm,  NOESY: HA1(GLY 62) HN(THR 63)                
    837   3.582 ppm,  D2ONOESY: HA1(GLY 62) HA2(GLY 62)             (spec. ok)
    104   3.565 ppm,  N15NOESY: N(GLY 62) HN(GLY 62) HA1(GLY 62)    (spec. ok)
    597   3.563 ppm,  N15NOESY: N(THR 63) HN(THR 63) HA1(GLY 62)    (spec. ok)

This means that the positions of peaks assigned to HA2 of Gly 62 differ 
by more than 0.075ppm from the mean frequency 3.162ppm. All peaks 
assigned to HA2 of Gly 62 that violate the limits are listed. The first 
number on each line is the peak number, followed by the peak position in 
the dimension assigned to HA2 of Gly 62 and the name of the peak. If 
within the same spectrum the assignments are consistent but differ only 
between different spectra, the corresponding peaks are marked with 
'(spec. ok)'.