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 0.95 C 0.03 F 0.01 C Shift Assignments>> CA :: 45.270(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 3.892(D) HA3 :: 3.892(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 0.95 C 0.03 F 0.01 C Shift Assignments>> CA :: 45.263(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 4.000(D) HA3 :: 4.000(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 1.NFK4 Overall Status: Residue type NFK not supported. 1.G5 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> G 0.9 C 0.06 F 0.03 C Shift Assignments>> CA :: 44.705(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 3.784(D) HA3 :: 3.784(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 0.91 C 0.05 F 0.02 C Shift Assignments>> CA :: 44.832(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 3.942(D) HA3 :: 3.942(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 = 45.270(D), Expected = 45.35, Std = 1.3400, ChiSquare = 9.5239e-01 1.G2 HA2 = 3.892(D), Expected = 3.97, Std = 0.3700, ChiSquare = 8.3303e-01 1.G2 HA3 = 3.892(D), Expected = 3.90, Std = 0.3700, ChiSquare = 9.8275e-01 1.G3 CA = 45.263(D), Expected = 45.35, Std = 1.3400, ChiSquare = 9.4823e-01 1.G3 HA2 = 4.000(D), Expected = 3.97, Std = 0.3700, ChiSquare = 9.3538e-01 1.G3 HA3 = 4.000(D), Expected = 3.90, Std = 0.3700, ChiSquare = 7.8695e-01 1.G5 CA = 44.705(D), Expected = 45.35, Std = 1.3400, ChiSquare = 6.3027e-01 1.G5 HA2 = 3.784(D), Expected = 3.97, Std = 0.3700, ChiSquare = 6.1517e-01 1.G5 HA3 = 3.784(D), Expected = 3.90, Std = 0.3700, ChiSquare = 7.5389e-01 1.G6 CA = 44.832(D), Expected = 45.35, Std = 1.3400, ChiSquare = 6.9908e-01 1.G6 HA2 = 3.942(D), Expected = 3.97, Std = 0.3700, ChiSquare = 9.3968e-01 1.G6 HA3 = 3.942(D), Expected = 3.90, Std = 0.3700, ChiSquare = 9.0962e-01