Assignment Validation Software (AVS)
(c) Hunter Moseley and Gaetano Montelione, 2004


1.ACE1 Overall Status: Residue type ACE not supported.



1.G2	Overall: Clerical 	Typing: Consistent 	SRO: Consistent 	C Shifts: Duplicate 	H Shifts: Duplicate 	N Shifts: Indeterminable

	PRTL>>	G 0.96   C 0.03   

	C Shift Assignments>> 	CA :: 45.369(D)	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	HA2 :: 3.954(D)	 	HA3 :: 3.954(D)	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)



1.G3	Overall: Clerical 	Typing: Consistent 	SRO: Consistent 	C Shifts: Duplicate 	H Shifts: Duplicate 	N Shifts: Indeterminable

	PRTL>>	G 0.96   C 0.03   

	C Shift Assignments>> 	CA :: 45.297(D)	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	HA2 :: 4.008(D)	 	HA3 :: 4.008(D)	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)



1.KYN4 Overall Status: Residue type KYN not supported.



1.G5	Overall: Clerical 	Typing: Consistent 	SRO: Consistent 	C Shifts: Duplicate 	H Shifts: Duplicate 	N Shifts: Indeterminable

	PRTL>>	G 0.96   C 0.03   

	C Shift Assignments>> 	CA :: 45.297(D)	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	HA2 :: 4.008(D)	 	HA3 :: 4.008(D)	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)



1.G6	Overall: Clerical 	Typing: Consistent 	SRO: Consistent 	C Shifts: Duplicate 	H Shifts: Duplicate 	N Shifts: Indeterminable

	PRTL>>	G 0.92   C 0.05   Y 0.01   

	C Shift Assignments>> 	CA :: 44.768(D)	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	HA2 :: 3.950(D)	 	HA3 :: 3.950(D)	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)



1.NH27 Overall Status: Residue type NH2 not supported.





###########################################################################

Overall Results:

	      #Consistent:   0      #Clerical:   4      #Suspicious:   0      #Anomalous:   0      #Mistyped:   0      #Indeterminable:   0


Typing Results:

	      #Consistent:   4      #Suspicious:   0      #Mistyped:   0      #Indeterminable:   0


Shift Relative Order (SRO) Results:

	      #Consistent:   4      #Suspicious:   0


C Shift Results:

	      #Consistent:   0      #Duplicate:   4      #Unknown:   0      #Suspicious:   0      #Anomalous:   0


H Shift Results:

	      #Consistent:   0      #Duplicate:   8      #Unknown:   0      #Suspicious:   0      #Anomalous:   0


N Shift Results:

	      #Consistent:   0      #Duplicate:   0      #Unknown:   0      #Suspicious:   0      #Anomalous:   0



Error Summary:

1.G2	CA = 45.369(D),	 Expected = 45.35, Std = 1.3400, ChiSquare = 9.8869e-01
1.G2	HA2 = 3.954(D),	 Expected =  3.97, Std = 0.3700, ChiSquare = 9.6551e-01
1.G2	HA3 = 3.954(D),	 Expected =  3.90, Std = 0.3700, ChiSquare = 8.8396e-01
1.G3	CA = 45.297(D),	 Expected = 45.35, Std = 1.3400, ChiSquare = 9.6845e-01
1.G3	HA2 = 4.008(D),	 Expected =  3.97, Std = 0.3700, ChiSquare = 9.1820e-01
1.G3	HA3 = 4.008(D),	 Expected =  3.90, Std = 0.3700, ChiSquare = 7.7037e-01
1.G5	CA = 45.297(D),	 Expected = 45.35, Std = 1.3400, ChiSquare = 9.6845e-01
1.G5	HA2 = 4.008(D),	 Expected =  3.97, Std = 0.3700, ChiSquare = 9.1820e-01
1.G5	HA3 = 4.008(D),	 Expected =  3.90, Std = 0.3700, ChiSquare = 7.7037e-01
1.G6	CA = 44.768(D),	 Expected = 45.35, Std = 1.3400, ChiSquare = 6.6405e-01
1.G6	HA2 = 3.950(D),	 Expected =  3.97, Std = 0.3700, ChiSquare = 9.5689e-01
1.G6	HA3 = 3.950(D),	 Expected =  3.90, Std = 0.3700, ChiSquare = 8.9251e-01