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


1.N1	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	N 0.63   D 0.17   Y 0.07   F 0.06   L 0.04   

	C Shift Assignments>> 	C :: 174.587	 	CA :: 52.858	 	CB :: 38.632	
	Ave C Shift Values>> 	C :: 175.27(1.79) 	CA :: 53.54(1.88) 	CB :: 38.69(1.69) 	CG :: 176.76(1.38)

	H Shift Assignments>> 	H :: 7.479	 	HA :: 4.413	 	HB2 :: 2.432	 	HB3 :: 2.432	 	HD21 :: 7.45	 	HD22 :: 7.45	
	Ave H Shift Values>> 	H :: 8.34(0.63) 	HA :: 4.67(0.36) 	HB2 :: 2.81(0.31) 	HB3 :: 2.75(0.33) 	HD21 :: 7.35(0.48) 	HD22 :: 7.14(0.49)

	N Shift Assignments>> 	N :: 113.128	 	ND2 :: 113.335	
	Ave N Shift Values>> 	N :: 118.93(4.03) 	ND2 :: 112.75(2.23)



1.E2	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.76   Q 0.1   K 0.09   I 0.03   

	C Shift Assignments>> 	C :: 175.846	 	CA :: 55.900	 	CB :: 30.399	 	CG :: 36.283	
	Ave C Shift Values>> 	C :: 176.87(1.95) 	CA :: 57.32(2.09) 	CB :: 30.01(1.72) 	CG :: 36.11(1.19) 	CD :: 182.4(1.78)

	H Shift Assignments>> 	H :: 8.232	 	HA :: 4.133	 	HB2 :: 1.681	 	HB3 :: 1.831	 	HG2 :: 2.018	 	HG3 :: 2.018	
	Ave H Shift Values>> 	H :: 8.33(0.59) 	HA :: 4.25(0.41) 	HB2 :: 2.02(0.21) 	HB3 :: 1.99(0.23) 	HG2 :: 2.27(0.21) 	HG3 :: 2.25(0.22)

	N Shift Assignments>> 	N :: 121.946	
	Ave N Shift Values>> 	N :: 120.67(3.48)



1.F3	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	F 0.99   

	C Shift Assignments>> 	C :: 176.091	 	CA :: 58.001	 	CB :: 40.910	 	CD1 :: 131.394	 	CD2 :: 131.394	 	CE1 :: 130.847	
			 	CE2 :: 130.847	 	CZ :: 130.301	
	Ave C Shift Values>> 	C :: 175.42(1.99) 	CA :: 58.08(2.57) 	CB :: 39.99(2.09) 	CG :: 138.41(2.04) 	CD1 :: 131.58(1.18) 	CD2 :: 131.63(1.12)
			 	CE1 :: 130.71(1.3) 	CE2 :: 130.76(1.13) 	CZ :: 129.21(1.43)

	H Shift Assignments>> 	H :: 8.684	 	HA :: 4.473	 	HB2 :: 2.747	 	HB3 :: 4.473(S)	 	HD1 :: 6.796	 	HD2 :: 6.796	
			 	HE1 :: 6.991	 	HE2 :: 6.991	 	HZ :: 6.547	
	Ave H Shift Values>> 	H :: 8.36(0.72) 	HA :: 4.63(0.57) 	HB2 :: 3(0.37) 	HB3 :: 2.93(0.4) 	HD1 :: 7.06(0.31) 	HD2 :: 7.06(0.31)
			 	HE1 :: 7.08(0.31) 	HE2 :: 7.08(0.32) 	HZ :: 7(0.42)

	N Shift Assignments>> 	N :: 121.83	
	Ave N Shift Values>> 	N :: 120.45(4.18)



1.T4	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.99   

	C Shift Assignments>> 	C :: 173.064	 	CA :: 60.998	 	CB :: 71.506	 	CG2 :: 21.230	
	Ave C Shift Values>> 	C :: 174.54(1.76) 	CA :: 62.22(2.59) 	CB :: 69.73(1.63) 	CG2 :: 21.55(1.11)

	H Shift Assignments>> 	H :: 9.003	 	HA :: 4.525	 	HB :: 3.807	 	HG21 :: 1.138	 	HG22 :: 1.138	 	HG23 :: 1.138	
	Ave H Shift Values>> 	H :: 8.24(0.62) 	HA :: 4.46(0.48) 	HB :: 4.17(0.33) 	HG1 :: 4.92(1.58) 	HG2 :: 1.14(0.23) 	HG21 :: 1.14(0.23)
			 	HG22 :: 1.14(0.23) 	HG23 :: 1.14(0.23)

	N Shift Assignments>> 	N :: 116.472	
	Ave N Shift Values>> 	N :: 115.42(4.75)



1.Q5	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.43   Q 0.37   R 0.16   E 0.02   

	C Shift Assignments>> 	C :: 175.376	 	CA :: 57.298	 	CB :: 28.771	 	CG :: 32.850	
	Ave C Shift Values>> 	C :: 176.31(1.95) 	CA :: 56.57(2.14) 	CB :: 29.19(1.82) 	CG :: 33.76(1.11) 	CD :: 179.69(1.29)

	H Shift Assignments>> 	H :: 8.979	 	HA :: 3.546	 	HB2 :: 1.718	 	HB3 :: 1.718	 	HG2 :: 1.472	 	HG3 :: 1.925	
	Ave H Shift Values>> 	H :: 8.22(0.59) 	HA :: 4.27(0.44) 	HB2 :: 2.05(0.25) 	HB3 :: 2.02(0.28) 	HG2 :: 2.32(0.27) 	HG3 :: 2.29(0.29)
			 	HE21 :: 7.24(0.45) 	HE22 :: 7.02(0.44)

	N Shift Assignments>> 	N :: 127.991	
	Ave N Shift Values>> 	N :: 119.89(3.6) 	NE2 :: 111.87(1.72)



1.I6	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.99   

	C Shift Assignments>> 	C :: 175.226	 	CA :: 61.695	 	CB :: 37.130	 	CG1 :: 27.964	 	CG2 :: 16.406	 	CD1 :: 12.584	
	Ave C Shift Values>> 	C :: 175.85(1.92) 	CA :: 61.61(2.68) 	CB :: 38.63(2.02) 	CG1 :: 27.71(1.68) 	CG2 :: 17.53(1.36) 	CD1 :: 13.43(1.67)

	H Shift Assignments>> 	H :: 8.121	 	HA :: 3.497	 	HB :: 0.866	 	HG12 :: 0.312	 	HG13 :: 1.000	 	HG21 :: 0.145	
			 	HG22 :: 0.145	 	HG23 :: 0.145	 	HD11 :: -0.060	 	HD12 :: -0.060	 	HD13 :: -0.060	
	Ave H Shift Values>> 	H :: 8.28(0.68) 	HA :: 4.18(0.56) 	HB :: 1.78(0.29) 	HG2 :: 0.77(0.27) 	HG12 :: 1.28(0.4) 	HG13 :: 1.19(0.41)
			 	HD1 :: 0.68(0.29)

	N Shift Assignments>> 	N :: 129.683	
	Ave N Shift Values>> 	N :: 121.46(4.28)



1.S7	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.99   

	C Shift Assignments>> 	C :: 174.662	 	CA :: 60.176	 	CB :: 63.054	
	Ave C Shift Values>> 	C :: 174.62(1.72) 	CA :: 58.72(2.07) 	CB :: 63.8(1.48)

	H Shift Assignments>> 	H :: 8.453	 	HA :: 3.881	 	HB2 :: 3.532	 	HB3 :: 3.682	
	Ave H Shift Values>> 	H :: 8.28(0.59) 	HA :: 4.48(0.4) 	HB2 :: 3.88(0.25) 	HB3 :: 3.85(0.27) 	HG :: 5.36(1.03)

	N Shift Assignments>> 	N :: 122.732	
	Ave N Shift Values>> 	N :: 116.28(3.52)



1.G8	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.61   L 0.22   R 0.09   F 0.02   D 0.02   Y 0.01   

	C Shift Assignments>> 	C :: 174.286	 	CA :: 44.635	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	H :: 8.476	 	HA2 :: 3.317	 	HA3 :: 4.028	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)

	N Shift Assignments>> 	N :: 112.130	
	Ave N Shift Values>> 	N :: 109.67(3.87)



1.Y9	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.94   G 0.05   

	C Shift Assignments>> 	C :: 175.320	 	CA :: 57.463	 	CB :: 42.625	 	CD1 :: 132.979	 	CD2 :: 132.979	 	CE1 :: 117.717	
			 	CE2 :: 117.717	
	Ave C Shift Values>> 	C :: 175.4(1.99) 	CA :: 58.13(2.51) 	CB :: 39.32(2.16) 	CG :: 129.75(4.96) 	CD1 :: 132.77(1.17) 	CD2 :: 132.73(1.3)
			 	CE1 :: 117.93(1.19) 	CE2 :: 117.9(1.18) 	CZ :: 156.76(1.99)

	H Shift Assignments>> 	H :: 8.208	 	HA :: 4.916	 	HB2 :: 2.518	 	HB3 :: 2.681	 	HD1 :: 6.449	 	HD2 :: 6.455	
			 	HE1 :: 6.254	 	HE2 :: 6.260	
	Ave H Shift Values>> 	H :: 8.32(0.73) 	HA :: 4.63(0.56) 	HB2 :: 2.91(0.37) 	HB3 :: 2.84(0.39) 	HD1 :: 6.93(0.3) 	HD2 :: 6.93(0.3)
			 	HE1 :: 6.7(0.23) 	HE2 :: 6.71(0.23) 	HH :: 9.3(1.36)

	N Shift Assignments>> 	N :: 119.078	
	Ave N Shift Values>> 	N :: 120.52(4.2)



1.V10	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.99   

	HN Overlap>>	 1.S15 1.S15

	C Shift Assignments>> 	C :: 176.655	 	CA :: 62.890	 	CB :: 32.794	 	CG1 :: 20.764	 	CG2 :: 20.582	
	Ave C Shift Values>> 	C :: 175.62(1.9) 	CA :: 62.49(2.86) 	CB :: 32.73(1.79) 	CG1 :: 21.49(1.36) 	CG2 :: 21.26(1.56)

	H Shift Assignments>> 	H :: 8.546	 	HA :: 3.856	 	HB :: 1.777	 	HG11 :: 0.668	 	HG12 :: 0.668	 	HG13 :: 0.668	
			 	HG21 :: 0.668	 	HG22 :: 0.668	 	HG23 :: 0.668	
	Ave H Shift Values>> 	H :: 8.29(0.67) 	HA :: 4.19(0.58) 	HB :: 1.98(0.32) 	HG1 :: 0.83(0.26) 	HG2 :: 0.8(0.28)

	N Shift Assignments>> 	N :: 115.648	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.N11	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	N 0.7   D 0.13   Y 0.05   F 0.05   L 0.03   

	C Shift Assignments>> 	C :: 172.594	 	CA :: 52.334	 	CB :: 38.386	
	Ave C Shift Values>> 	C :: 175.27(1.79) 	CA :: 53.54(1.88) 	CB :: 38.69(1.69) 	CG :: 176.76(1.38)

	H Shift Assignments>> 	H :: 7.89	 	HA :: 4.769	 	HB2 :: 2.396	 	HB3 :: 3.547	
	Ave H Shift Values>> 	H :: 8.34(0.63) 	HA :: 4.67(0.36) 	HB2 :: 2.81(0.31) 	HB3 :: 2.75(0.33) 	HD21 :: 7.35(0.48) 	HD22 :: 7.14(0.49)

	N Shift Assignments>> 	N :: 116.0	
	Ave N Shift Values>> 	N :: 118.93(4.03) 	ND2 :: 112.75(2.23)



1.A12	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	A 0.4   L 0.35   G 0.19   P 0.02   K 0.02   

	C Shift Assignments>> 	C :: 174.718	 	CA :: 49.135	 	CB :: 23.174	
	Ave C Shift Values>> 	C :: 177.74(2.13) 	CA :: 53.14(1.98) 	CB :: 19.01(1.83)

	H Shift Assignments>> 	H :: 6.211(S)	 	HA :: 5.378	 	HB1 :: 0.577	 	HB2 :: 0.577	 	HB3 :: 0.577	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.44) 	HB :: 1.35(0.26)

	N Shift Assignments>> 	N :: 118.357	
	Ave N Shift Values>> 	N :: 123.23(3.54)



1.F13	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.49   G 0.33   Y 0.17   

	C Shift Assignments>> 	C :: 174.061	 	CA :: 56.282	 	CB :: 44.017	 	CD1 :: 131.385	 	CD2 :: 131.385	 	CE1 :: 131.385	
			 	CE2 :: 131.385	
	Ave C Shift Values>> 	C :: 175.42(1.99) 	CA :: 58.08(2.57) 	CB :: 39.99(2.09) 	CG :: 138.41(2.04) 	CD1 :: 131.58(1.18) 	CD2 :: 131.63(1.12)
			 	CE1 :: 130.71(1.3) 	CE2 :: 130.76(1.13) 	CZ :: 129.21(1.43)

	H Shift Assignments>> 	H :: 8.840	 	HA :: 4.952	 	HB2 :: 2.259	 	HB3 :: 2.719	 	HD1 :: 6.569	 	HD2 :: 6.544	
			 	HE1 :: 6.975	 	HE2 :: 6.975	
	Ave H Shift Values>> 	H :: 8.36(0.72) 	HA :: 4.63(0.57) 	HB2 :: 3(0.37) 	HB3 :: 2.93(0.4) 	HD1 :: 7.06(0.31) 	HD2 :: 7.06(0.31)
			 	HE1 :: 7.08(0.31) 	HE2 :: 7.08(0.32) 	HZ :: 7(0.42)

	N Shift Assignments>> 	N :: 119.783	
	Ave N Shift Values>> 	N :: 120.45(4.18)



1.G14	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	G 0.47   L 0.26   R 0.16   F 0.03   D 0.03   Y 0.01   

	C Shift Assignments>> 	C :: 171.561	 	CA :: 44.388	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	H :: 9.554	 	HA2 :: 3.136	 	HA3 :: 6.033(S)	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)

	N Shift Assignments>> 	N :: 106.941	
	Ave N Shift Values>> 	N :: 109.67(3.87)



1.S15	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	S 0.99   

	HN Overlap>>	 1.V10 1.V10

	C Shift Assignments>> 	C :: 172.594	 	CA :: 56.476	 	CB :: 63.876	
	Ave C Shift Values>> 	C :: 174.62(1.72) 	CA :: 58.72(2.07) 	CB :: 63.8(1.48)

	H Shift Assignments>> 	H :: 8.554	 	HA :: 4.271	 	HB2 :: 1.933(S)	 	HB3 :: 2.298(S)	
	Ave H Shift Values>> 	H :: 8.28(0.59) 	HA :: 4.48(0.4) 	HB2 :: 3.88(0.25) 	HB3 :: 3.85(0.27) 	HG :: 5.36(1.03)

	N Shift Assignments>> 	N :: 115.691	
	Ave N Shift Values>> 	N :: 116.28(3.52)



1.Q16	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Q 0.52   K 0.4   R 0.03   E 0.02   

	C Shift Assignments>> 	C :: 174.606	 	CA :: 54.091	 	CB :: 30	 	CG :: 33.060	
	Ave C Shift Values>> 	C :: 176.31(1.95) 	CA :: 56.57(2.14) 	CB :: 29.19(1.82) 	CG :: 33.76(1.11) 	CD :: 179.69(1.29)

	H Shift Assignments>> 	H :: 9.054	 	HA :: 5.214	 	HB2 :: 1.652	 	HB3 :: 1.652	 	HG2 :: 1.925	 	HG3 :: 2.072	
	Ave H Shift Values>> 	H :: 8.22(0.59) 	HA :: 4.27(0.44) 	HB2 :: 2.05(0.25) 	HB3 :: 2.02(0.28) 	HG2 :: 2.32(0.27) 	HG3 :: 2.29(0.29)
			 	HE21 :: 7.24(0.45) 	HE22 :: 7.02(0.44)

	N Shift Assignments>> 	N :: 130.200	
	Ave N Shift Values>> 	N :: 119.89(3.6) 	NE2 :: 111.87(1.72)



1.R17	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.79   K 0.11   G 0.08   

	C Shift Assignments>> 	C :: 176.072	 	CA :: 55.571	 	CB :: 31.314	 	CG :: 26.963	 	CD :: 43.162	
	Ave C Shift Values>> 	C :: 176.41(2.03) 	CA :: 56.77(2.31) 	CB :: 30.7(1.83) 	CG :: 27.21(1.2) 	CD :: 43.16(0.88) 	CZ :: 159.97(2.95)

	H Shift Assignments>> 	H :: 8.631	 	HA :: 4.264	 	HB2 :: 1.492	 	HB3 :: 1.492	 	HG2 :: 1.303	 	HG3 :: 1.303	
			 	HD2 :: 2.927	 	HD3 :: 2.927	
	Ave H Shift Values>> 	H :: 8.24(0.61) 	HA :: 4.3(0.46) 	HB2 :: 1.79(0.27) 	HB3 :: 1.76(0.28) 	HG2 :: 1.57(0.27) 	HG3 :: 1.54(0.29)
			 	HD2 :: 3.12(0.24) 	HD3 :: 3.1(0.26) 	HE :: 7.4(0.63) 	HH11 :: 6.91(0.46) 	HH12 :: 6.8(0.33) 	HH21 :: 6.81(0.48)
			 	HH22 :: 6.76(0.36)

	N Shift Assignments>> 	N :: 128.075	
	Ave N Shift Values>> 	N :: 120.8(3.68) 	NE :: 84.63(1.68) 	NH1 :: 73.82(4.62) 	NH2 :: 73.26(3.32)



1.G18	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Indeterminable 	N Shifts: Indeterminable




1.S19	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Indeterminable 	N Shifts: Indeterminable




1.V20	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	V 0.99   

	C Shift Assignments>> 	C :: 175.264	 	CA :: 62.394	 	CB :: 32.211	 	CG1 :: 21.701	 	CG2 :: 21.685	
	Ave C Shift Values>> 	C :: 175.62(1.9) 	CA :: 62.49(2.86) 	CB :: 32.73(1.79) 	CG1 :: 21.49(1.36) 	CG2 :: 21.26(1.56)

	H Shift Assignments>> 	HA :: 4.298	 	HB :: 2.061	 	HG11 :: 0.679	 	HG12 :: 0.679	 	HG13 :: 0.679	 	HG21 :: 0.530	
			 	HG22 :: 0.530	 	HG23 :: 0.530	
	Ave H Shift Values>> 	H :: 8.29(0.67) 	HA :: 4.19(0.58) 	HB :: 1.98(0.32) 	HG1 :: 0.83(0.26) 	HG2 :: 0.8(0.28)



1.L21	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.81   L 0.11   A 0.06   

	C Shift Assignments>> 	C :: 175.282	 	CA :: 52.529	 	CB :: 45.387	 	CG :: 26.653	 	CD1 :: 23.072	 	CD2 :: 26.727	
	Ave C Shift Values>> 	C :: 176.99(1.98) 	CA :: 55.62(2.13) 	CB :: 42.31(1.88) 	CG :: 26.78(1.1) 	CD1 :: 24.72(1.59) 	CD2 :: 24.05(1.7)

	H Shift Assignments>> 	H :: 9.392	 	HA :: 4.806	 	HB2 :: 1.267	 	HB3 :: 2.278	 	HG :: 1.256	 	HD11 :: 0.593	
			 	HD12 :: 0.593	 	HD13 :: 0.593	 	HD21 :: 0.593	 	HD22 :: 0.593	 	HD23 :: 0.593	
	Ave H Shift Values>> 	H :: 8.23(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.61(0.34) 	HB3 :: 1.52(0.36) 	HG :: 1.51(0.33) 	HD1 :: 0.75(0.28)
			 	HD2 :: 0.73(0.29)

	N Shift Assignments>> 	N :: 131.672	
	Ave N Shift Values>> 	N :: 121.86(3.9)



1.T22	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.99   

	C Shift Assignments>> 	C :: 174.173	 	CA :: 62.478	 	CB :: 69.715	 	CG2 :: 21.958	
	Ave C Shift Values>> 	C :: 174.54(1.76) 	CA :: 62.22(2.59) 	CB :: 69.73(1.63) 	CG2 :: 21.55(1.11)

	H Shift Assignments>> 	H :: 9.316	 	HA :: 5.075	 	HB :: 3.663	 	HG21 :: 1.187	 	HG22 :: 1.187	 	HG23 :: 1.187	
	Ave H Shift Values>> 	H :: 8.24(0.62) 	HA :: 4.46(0.48) 	HB :: 4.17(0.33) 	HG1 :: 4.92(1.58) 	HG2 :: 1.14(0.23) 	HG21 :: 1.14(0.23)
			 	HG22 :: 1.14(0.23) 	HG23 :: 1.14(0.23)

	N Shift Assignments>> 	N :: 128.008	
	Ave N Shift Values>> 	N :: 115.42(4.75)



1.V23	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.99   

	C Shift Assignments>> 	C :: 173.591	 	CA :: 59.683	 	CB :: 33.863	 	CG1 :: 21.958	 	CG2 :: 20.775	
	Ave C Shift Values>> 	C :: 175.62(1.9) 	CA :: 62.49(2.86) 	CB :: 32.73(1.79) 	CG1 :: 21.49(1.36) 	CG2 :: 21.26(1.56)

	H Shift Assignments>> 	H :: 9.420	 	HA :: 5.215	 	HB :: 1.812	 	HG11 :: 0.662	 	HG12 :: 0.662	 	HG13 :: 0.662	
			 	HG21 :: 0.532	 	HG22 :: 0.532	 	HG23 :: 0.532	
	Ave H Shift Values>> 	H :: 8.29(0.67) 	HA :: 4.19(0.58) 	HB :: 1.98(0.32) 	HG1 :: 0.83(0.26) 	HG2 :: 0.8(0.28)

	N Shift Assignments>> 	N :: 124.543	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.K24	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.87   A 0.06   R 0.05   

	C Shift Assignments>> 	C :: 174.380	 	CA :: 53.845	 	CB :: 36.888	 	CG :: 24.870	 	CD :: 29.238	 	CE :: 40.523	
	Ave C Shift Values>> 	C :: 176.64(2) 	CA :: 56.95(2.2) 	CB :: 32.79(1.78) 	CG :: 24.89(1.13) 	CD :: 28.96(1.08) 	CE :: 41.89(0.82)

	H Shift Assignments>> 	H :: 9.055	 	HA :: 5.323	 	HB2 :: 1.330	 	HB3 :: 1.468	 	HG2 :: 0.781	 	HG3 :: 0.859	
	Ave H Shift Values>> 	H :: 8.19(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.78(0.25) 	HB3 :: 1.74(0.27) 	HG2 :: 1.37(0.26) 	HG3 :: 1.35(0.28)
			 	HD2 :: 1.61(0.22) 	HD3 :: 1.6(0.22) 	HE2 :: 2.92(0.19) 	HE3 :: 2.91(0.2) 	HZ :: 7.42(0.67)

	N Shift Assignments>> 	N :: 121.097	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.V25	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.99   

	C Shift Assignments>> 	C :: 175.489	 	CA :: 60.834	 	CB :: 34.110	 	CG1 :: 21.230	 	CG2 :: 21.230	
	Ave C Shift Values>> 	C :: 175.62(1.9) 	CA :: 62.49(2.86) 	CB :: 32.73(1.79) 	CG1 :: 21.49(1.36) 	CG2 :: 21.26(1.56)

	H Shift Assignments>> 	H :: 7.928	 	HA :: 4.757	 	HB :: 1.653	 	HG11 :: 0.646	 	HG12 :: 0.646	 	HG13 :: 0.646	
			 	HG21 :: 0.401	 	HG22 :: 0.401	 	HG23 :: 0.401	
	Ave H Shift Values>> 	H :: 8.29(0.67) 	HA :: 4.19(0.58) 	HB :: 1.98(0.32) 	HG1 :: 0.83(0.26) 	HG2 :: 0.8(0.28)

	N Shift Assignments>> 	N :: 121.353	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.E26	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.9   Q 0.09   

	C Shift Assignments>> 	C :: 176.410	 	CA :: 54.091	 	CB :: 34.028	 	CG :: 36.063	
	Ave C Shift Values>> 	C :: 176.87(1.95) 	CA :: 57.32(2.09) 	CB :: 30.01(1.72) 	CG :: 36.11(1.19) 	CD :: 182.4(1.78)

	H Shift Assignments>> 	H :: 8.452	 	HA :: 5.137	 	HB2 :: 1.810	 	HB3 :: 1.810	 	HG2 :: 1.597	 	HG3 :: 1.729	
	Ave H Shift Values>> 	H :: 8.33(0.59) 	HA :: 4.25(0.41) 	HB2 :: 2.02(0.21) 	HB3 :: 1.99(0.23) 	HG2 :: 2.27(0.21) 	HG3 :: 2.25(0.22)

	N Shift Assignments>> 	N :: 125.028	
	Ave N Shift Values>> 	N :: 120.67(3.48)



1.N27	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	N 0.81   D 0.11   F 0.02   Y 0.02   L 0.01   

	C Shift Assignments>> 	C :: 176.937	 	CA :: 50.473	 	CB :: 38.386	
	Ave C Shift Values>> 	C :: 175.27(1.79) 	CA :: 53.54(1.88) 	CB :: 38.69(1.69) 	CG :: 176.76(1.38)

	H Shift Assignments>> 	H :: 8.340	 	HA :: 4.813	 	HB2 :: 2.625	 	HB3 :: 3.439	
	Ave H Shift Values>> 	H :: 8.34(0.63) 	HA :: 4.67(0.36) 	HB2 :: 2.81(0.31) 	HB3 :: 2.75(0.33) 	HD21 :: 7.35(0.48) 	HD22 :: 7.14(0.49)

	N Shift Assignments>> 	N :: 117.752	
	Ave N Shift Values>> 	N :: 118.93(4.03) 	ND2 :: 112.75(2.23)



1.D28	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.24   Y 0.22   D 0.22   L 0.14   N 0.11   I 0.03   K 0.01   

	C Shift Assignments>> 	C :: 176.579	 	CA :: 55.982	 	CB :: 39.866	
	Ave C Shift Values>> 	C :: 176.4(1.75) 	CA :: 54.69(2.03) 	CB :: 40.88(1.62) 	CG :: 179.17(1.79)

	H Shift Assignments>> 	H :: 8.394	 	HA :: 4.178	 	HB2 :: 2.504	 	HB3 :: 2.504	
	Ave H Shift Values>> 	H :: 8.31(0.58) 	HA :: 4.59(0.32) 	HB2 :: 2.72(0.26) 	HB3 :: 2.66(0.28) 	HD2 :: 5.25(0.58)

	N Shift Assignments>> 	N :: 118.006	
	Ave N Shift Values>> 	N :: 120.65(3.86)



1.E29	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.76   K 0.11   Q 0.07   I 0.04   

	C Shift Assignments>> 	C :: 176.279	 	CA :: 55.818	 	CB :: 30.052	 	CG :: 36.518	
	Ave C Shift Values>> 	C :: 176.87(1.95) 	CA :: 57.32(2.09) 	CB :: 30.01(1.72) 	CG :: 36.11(1.19) 	CD :: 182.4(1.78)

	H Shift Assignments>> 	H :: 7.431	 	HA :: 4.093	 	HB2 :: 1.531	 	HB3 :: 1.924	 	HG2 :: 1.932	 	HG3 :: 1.932	
	Ave H Shift Values>> 	H :: 8.33(0.59) 	HA :: 4.25(0.41) 	HB2 :: 2.02(0.21) 	HB3 :: 1.99(0.23) 	HG2 :: 2.27(0.21) 	HG3 :: 2.25(0.22)

	N Shift Assignments>> 	N :: 117.057	
	Ave N Shift Values>> 	N :: 120.67(3.48)



1.G30	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.9   L 0.07   

	C Shift Assignments>> 	C :: 173.327	 	CA :: 45.905	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	H :: 7.818	 	HA2 :: 3.496	 	HA3 :: 3.855	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)

	N Shift Assignments>> 	N :: 107.446	
	Ave N Shift Values>> 	N :: 109.67(3.87)



1.W31	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	W 0.99   

	HN Overlap>>	 1.E35 1.E35

	C Shift Assignments>> 	C :: 175.978	 	CA :: 55.407	 	CB :: 29.623	 	CD1 :: 127.02	 	CE3 :: 121.006	 	CZ3 :: 121.990	
	Ave C Shift Values>> 	C :: 176.12(2.01) 	CA :: 57.66(2.58) 	CB :: 30.01(2.01) 	CG :: 110.59(1.88) 	CD1 :: 126.51(1.83) 	CD2 :: 127.57(1.55)
			 	CE2 :: 138.31(6.98) 	CE3 :: 120.43(1.79) 	CZ2 :: 114.26(1.12) 	CZ3 :: 121.35(1.53) 	CH2 :: 123.86(1.42)

	H Shift Assignments>> 	H :: 7.788	 	HA :: 4.477	 	HB2 :: 2.803	 	HB3 :: 2.990	 	HD1 :: 6.813	 	HE3 :: 7.398	
			 	HZ3 :: 6.894	
	Ave H Shift Values>> 	H :: 8.29(0.79) 	HA :: 4.68(0.53) 	HB2 :: 3.19(0.35) 	HB3 :: 3.12(0.36) 	HD1 :: 7.14(0.36) 	HE1 :: 10.08(0.66)
			 	HE3 :: 7.31(0.41) 	HZ2 :: 7.28(0.33) 	HZ3 :: 6.86(0.4) 	HH2 :: 6.98(0.39)

	N Shift Assignments>> 	N :: 121.760	
	Ave N Shift Values>> 	N :: 121.68(4.18) 	NE1 :: 129.32(2.11)



1.T32	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.99   

	C Shift Assignments>> 	C :: 173.797	 	CA :: 64.687	 	CB :: 69.4925	 	CG2 :: 22.432	
	Ave C Shift Values>> 	C :: 174.54(1.76) 	CA :: 62.22(2.59) 	CB :: 69.73(1.63) 	CG2 :: 21.55(1.11)

	H Shift Assignments>> 	H :: 8.365	 	HA :: 3.707	 	HB :: 3.635	 	HG21 :: 0.764	 	HG22 :: 0.764	 	HG23 :: 0.764	
	Ave H Shift Values>> 	H :: 8.24(0.62) 	HA :: 4.46(0.48) 	HB :: 4.17(0.33) 	HG1 :: 4.92(1.58) 	HG2 :: 1.14(0.23) 	HG21 :: 1.14(0.23)
			 	HG22 :: 1.14(0.23) 	HG23 :: 1.14(0.23)

	N Shift Assignments>> 	N :: 120.652	
	Ave N Shift Values>> 	N :: 115.42(4.75)



1.L33	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.85   G 0.05   A 0.04   R 0.04   

	C Shift Assignments>> 	C :: 177.049	 	CA :: 56.229	 	CB :: 42.811	 	CG :: 26.545	 	CD1 :: 24.717	 	CD2 :: 22.432	
	Ave C Shift Values>> 	C :: 176.99(1.98) 	CA :: 55.62(2.13) 	CB :: 42.31(1.88) 	CG :: 26.78(1.1) 	CD1 :: 24.72(1.59) 	CD2 :: 24.05(1.7)

	H Shift Assignments>> 	H :: 9.319	 	HA :: 4.178	 	HB2 :: 1.417	 	HB3 :: 1.417	 	HG :: 1.456	 	HD11 :: 0.738	
			 	HD12 :: 0.738	 	HD13 :: 0.738	 	HD21 :: 0.676	 	HD22 :: 0.676	 	HD23 :: 0.676	
	Ave H Shift Values>> 	H :: 8.23(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.61(0.34) 	HB3 :: 1.52(0.36) 	HG :: 1.51(0.33) 	HD1 :: 0.75(0.28)
			 	HD2 :: 0.73(0.29)

	N Shift Assignments>> 	N :: 129.342	
	Ave N Shift Values>> 	N :: 121.86(3.9)



1.V34	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.99   

	C Shift Assignments>> 	C :: 172.406	 	CA :: 59.836	 	CB :: 35.500	 	CG1 :: 21.518	 	CG2 :: 19.782	
	Ave C Shift Values>> 	C :: 175.62(1.9) 	CA :: 62.49(2.86) 	CB :: 32.73(1.79) 	CG1 :: 21.49(1.36) 	CG2 :: 21.26(1.56)

	H Shift Assignments>> 	H :: 7.089	 	HA :: 4.318	 	HB :: 2.092	 	HG11 :: 0.676	 	HG12 :: 0.676	 	HG13 :: 0.676	
			 	HG21 :: 0.676	 	HG22 :: 0.676	 	HG23 :: 0.676	
	Ave H Shift Values>> 	H :: 8.29(0.67) 	HA :: 4.19(0.58) 	HB :: 1.98(0.32) 	HG1 :: 0.83(0.26) 	HG2 :: 0.8(0.28)

	N Shift Assignments>> 	N :: 111.835	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.E35	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.9   Q 0.09   

	HN Overlap>>	 1.W31 1.W31

	C Shift Assignments>> 	C :: 174.136	 	CA :: 55.240	 	CB :: 33.216	 	CG :: 36.049	
	Ave C Shift Values>> 	C :: 176.87(1.95) 	CA :: 57.32(2.09) 	CB :: 30.01(1.72) 	CG :: 36.11(1.19) 	CD :: 182.4(1.78)

	H Shift Assignments>> 	H :: 7.798	 	HA :: 5.253	 	HB2 :: 1.606	 	HB3 :: 1.644	 	HG2 :: 1.787	 	HG3 :: 1.784	
	Ave H Shift Values>> 	H :: 8.33(0.59) 	HA :: 4.25(0.41) 	HB2 :: 2.02(0.21) 	HB3 :: 1.99(0.23) 	HG2 :: 2.27(0.21) 	HG3 :: 2.25(0.22)

	N Shift Assignments>> 	N :: 121.823	
	Ave N Shift Values>> 	N :: 120.67(3.48)



1.E36	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	E 0.92   Q 0.06   

	C Shift Assignments>> 	C :: 172.406	 	CA :: 54.914	 	CB :: 33.342	 	CG :: 36.275	
	Ave C Shift Values>> 	C :: 176.87(1.95) 	CA :: 57.32(2.09) 	CB :: 30.01(1.72) 	CG :: 36.11(1.19) 	CD :: 182.4(1.78)

	H Shift Assignments>> 	H :: 8.689	 	HA :: 4.294	 	HB2 :: 0.885(S)	 	HB3 :: 1.686	 	HG2 :: 1.240(S)	 	HG3 :: 1.240(S)	
	Ave H Shift Values>> 	H :: 8.33(0.59) 	HA :: 4.25(0.41) 	HB2 :: 2.02(0.21) 	HB3 :: 1.99(0.23) 	HG2 :: 2.27(0.21) 	HG3 :: 2.25(0.22)

	N Shift Assignments>> 	N :: 125.497	
	Ave N Shift Values>> 	N :: 120.67(3.48)



1.D37	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.32   D 0.27   R 0.15   K 0.09   F 0.04   N 0.04   G 0.03   Y 0.02   

	C Shift Assignments>> 	C :: 175.602	 	CA :: 53.022	 	CB :: 42.643	
	Ave C Shift Values>> 	C :: 176.4(1.75) 	CA :: 54.69(2.03) 	CB :: 40.88(1.62) 	CG :: 179.17(1.79)

	H Shift Assignments>> 	H :: 8.462	 	HA :: 5.131	 	HB2 :: 2.055	 	HB3 :: 2.242	
	Ave H Shift Values>> 	H :: 8.31(0.58) 	HA :: 4.59(0.32) 	HB2 :: 2.72(0.26) 	HB3 :: 2.66(0.28) 	HD2 :: 5.25(0.58)

	N Shift Assignments>> 	N :: 123.653	
	Ave N Shift Values>> 	N :: 120.65(3.86)



1.F38	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.97   G 0.02   

	C Shift Assignments>> 	C :: 173.327	 	CA :: 56.969	 	CB :: 42.250	 	CD1 :: 131.941	 	CD2 :: 131.941	 	CE1 :: 130.301	
			 	CE2 :: 130.301	 	CZ :: 129.754	
	Ave C Shift Values>> 	C :: 175.42(1.99) 	CA :: 58.08(2.57) 	CB :: 39.99(2.09) 	CG :: 138.41(2.04) 	CD1 :: 131.58(1.18) 	CD2 :: 131.63(1.12)
			 	CE1 :: 130.71(1.3) 	CE2 :: 130.76(1.13) 	CZ :: 129.21(1.43)

	H Shift Assignments>> 	H :: 8.993	 	HA :: 4.364	 	HB2 :: 2.530	 	HB3 :: 2.776	 	HD1 :: 6.875	 	HD2 :: 6.875	
			 	HE1 :: 6.439	 	HE2 :: 6.439	 	HZ :: 6.098	
	Ave H Shift Values>> 	H :: 8.36(0.72) 	HA :: 4.63(0.57) 	HB2 :: 3(0.37) 	HB3 :: 2.93(0.4) 	HD1 :: 7.06(0.31) 	HD2 :: 7.06(0.31)
			 	HE1 :: 7.08(0.31) 	HE2 :: 7.08(0.32) 	HZ :: 7(0.42)

	N Shift Assignments>> 	N :: 120.897	
	Ave N Shift Values>> 	N :: 120.45(4.18)



1.D39	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.4   L 0.23   N 0.17   K 0.08   F 0.04   Y 0.03   R 0.02   

	C Shift Assignments>> 	CA :: 52.118	 	CB :: 41.564	
	Ave C Shift Values>> 	C :: 176.4(1.75) 	CA :: 54.69(2.03) 	CB :: 40.88(1.62) 	CG :: 179.17(1.79)

	H Shift Assignments>> 	H :: 9.469	 	HA :: 4.991	 	HB2 :: 2.251	 	HB3 :: 3.027	
	Ave H Shift Values>> 	H :: 8.31(0.58) 	HA :: 4.59(0.32) 	HB2 :: 2.72(0.26) 	HB3 :: 2.66(0.28) 	HD2 :: 5.25(0.58)

	N Shift Assignments>> 	N :: 125.543	
	Ave N Shift Values>> 	N :: 120.65(3.86)



1.R40	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.21   Q 0.21   W 0.18   E 0.16   R 0.11   I 0.05   L 0.05   

	C Shift Assignments>> 	C :: 177.613	 	CA :: 57.298	 	CB :: 28.518	
	Ave C Shift Values>> 	C :: 176.41(2.03) 	CA :: 56.77(2.31) 	CB :: 30.7(1.83) 	CG :: 27.21(1.2) 	CD :: 43.16(0.88) 	CZ :: 159.97(2.95)

	H Shift Assignments>> 	H :: 9.312	 	HA :: 4.133	
	Ave H Shift Values>> 	H :: 8.24(0.61) 	HA :: 4.3(0.46) 	HB2 :: 1.79(0.27) 	HB3 :: 1.76(0.28) 	HG2 :: 1.57(0.27) 	HG3 :: 1.54(0.29)
			 	HD2 :: 3.12(0.24) 	HD3 :: 3.1(0.26) 	HE :: 7.4(0.63) 	HH11 :: 6.91(0.46) 	HH12 :: 6.8(0.33) 	HH21 :: 6.81(0.48)
			 	HH22 :: 6.76(0.36)

	N Shift Assignments>> 	N :: 128.148	
	Ave N Shift Values>> 	N :: 120.8(3.68) 	NE :: 84.63(1.68) 	NH1 :: 73.82(4.62) 	NH2 :: 73.26(3.32)



1.A41	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.98   I 0.01   

	C Shift Assignments>> 	C :: 178.196	 	CA :: 53.762	 	CB :: 17.993	
	Ave C Shift Values>> 	C :: 177.74(2.13) 	CA :: 53.14(1.98) 	CB :: 19.01(1.83)

	H Shift Assignments>> 	H :: 8.665	 	HA :: 4.037	 	HB1 :: 1.122	 	HB2 :: 1.122	 	HB3 :: 1.122	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.44) 	HB :: 1.35(0.26)

	N Shift Assignments>> 	N :: 121.948	
	Ave N Shift Values>> 	N :: 123.23(3.54)



1.D42	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.31   N 0.21   L 0.15   F 0.15   Y 0.13   K 0.01   I 0.01   

	C Shift Assignments>> 	C :: 174.512	 	CA :: 54.749	 	CB :: 40.030	
	Ave C Shift Values>> 	C :: 176.4(1.75) 	CA :: 54.69(2.03) 	CB :: 40.88(1.62) 	CG :: 179.17(1.79)

	H Shift Assignments>> 	H :: 7.815	 	HA :: 4.290	 	HB2 :: 2.307	 	HB3 :: 2.560	
	Ave H Shift Values>> 	H :: 8.31(0.58) 	HA :: 4.59(0.32) 	HB2 :: 2.72(0.26) 	HB3 :: 2.66(0.28) 	HD2 :: 5.25(0.58)

	N Shift Assignments>> 	N :: 116.451	
	Ave N Shift Values>> 	N :: 120.65(3.86)



1.Y43	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.98   G 0.01   

	C Shift Assignments>> 	C :: 175.508	 	CA :: 57.463	 	CB :: 41.922	 	CD1 :: 134.128	 	CD2 :: 134.128	 	CE1 :: 118.219	
			 	CE2 :: 118.219	
	Ave C Shift Values>> 	C :: 175.4(1.99) 	CA :: 58.13(2.51) 	CB :: 39.32(2.16) 	CG :: 129.75(4.96) 	CD1 :: 132.77(1.17) 	CD2 :: 132.73(1.3)
			 	CE1 :: 117.93(1.19) 	CE2 :: 117.9(1.18) 	CZ :: 156.76(1.99)

	H Shift Assignments>> 	H :: 7.522	 	HA :: 4.487	 	HB2 :: 2.616	 	HB3 :: 3.010	 	HD1 :: 7.251	 	HD2 :: 7.251	
			 	HE1 :: 6.764	 	HE2 :: 6.764	
	Ave H Shift Values>> 	H :: 8.32(0.73) 	HA :: 4.63(0.56) 	HB2 :: 2.91(0.37) 	HB3 :: 2.84(0.39) 	HD1 :: 6.93(0.3) 	HD2 :: 6.93(0.3)
			 	HE1 :: 6.7(0.23) 	HE2 :: 6.71(0.23) 	HH :: 9.3(1.36)

	N Shift Assignments>> 	N :: 117.665	
	Ave N Shift Values>> 	N :: 120.52(4.2)



1.G44	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.89   L 0.08   

	C Shift Assignments>> 	C :: 173.985	 	CA :: 45.540	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	H :: 8.967	 	HA2 :: 3.682	 	HA3 :: 4.000	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)

	N Shift Assignments>> 	N :: 106.710	
	Ave N Shift Values>> 	N :: 109.67(3.87)



1.S45	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.99   

	C Shift Assignments>> 	C :: 173.139	 	CA :: 57.433	 	CB :: 65.130	
	Ave C Shift Values>> 	C :: 174.62(1.72) 	CA :: 58.72(2.07) 	CB :: 63.8(1.48)

	H Shift Assignments>> 	H :: 7.336	 	HA :: 4.427	 	HB2 :: 3.783	 	HB3 :: 3.972	
	Ave H Shift Values>> 	H :: 8.28(0.59) 	HA :: 4.48(0.4) 	HB2 :: 3.88(0.25) 	HB3 :: 3.85(0.27) 	HG :: 5.36(1.03)

	N Shift Assignments>> 	N :: 110.233	
	Ave N Shift Values>> 	N :: 116.28(3.52)



1.D46	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.31   Y 0.28   F 0.18   I 0.13   N 0.02   K 0.02   D 0.01   

	C Shift Assignments>> 	C :: 175.226	 	CA :: 57.8	 	CB :: 37.15	
	Ave C Shift Values>> 	C :: 176.4(1.75) 	CA :: 54.69(2.03) 	CB :: 40.88(1.62) 	CG :: 179.17(1.79)

	H Shift Assignments>> 	H :: 9.235	 	HA :: 4.294	 	HB2 :: 2.453	 	HB3 :: 2.653	
	Ave H Shift Values>> 	H :: 8.31(0.58) 	HA :: 4.59(0.32) 	HB2 :: 2.72(0.26) 	HB3 :: 2.66(0.28) 	HD2 :: 5.25(0.58)

	N Shift Assignments>> 	N :: 121.065	
	Ave N Shift Values>> 	N :: 120.65(3.86)



1.P47	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	P 0.99   

	C Shift Assignments>> 	C :: 179.625	 	CA :: 65.603	 	CB :: 30.574	 	CG :: 27.733	 	CD :: 49.939	
	Ave C Shift Values>> 	C :: 176.75(1.51) 	CA :: 63.33(1.52) 	CB :: 31.85(1.18) 	CG :: 27.17(1.09) 	CD :: 50.32(0.99)

	H Shift Assignments>> 	HA :: 3.991	 	HB2 :: 1.580	 	HB3 :: 2.092	 	HG2 :: 1.728	 	HG3 :: 1.944	 	HD2 :: 3.596	
			 	HD3 :: 3.596	
	Ave H Shift Values>> 	HA :: 4.4(0.33) 	HB2 :: 2.08(0.35) 	HB3 :: 2(0.36) 	HG2 :: 1.93(0.31) 	HG3 :: 1.9(0.33) 	HD2 :: 3.65(0.35)
			 	HD3 :: 3.61(0.39)



1.E48	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.67   I 0.3   K 0.01   

	C Shift Assignments>> 	C :: 177.839	 	CA :: 59.272	 	CB :: 30.821	 	CG :: 37.511	
	Ave C Shift Values>> 	C :: 176.87(1.95) 	CA :: 57.32(2.09) 	CB :: 30.01(1.72) 	CG :: 36.11(1.19) 	CD :: 182.4(1.78)

	H Shift Assignments>> 	H :: 7.225	 	HA :: 3.869	 	HB2 :: 1.980	 	HB3 :: 2.195	 	HG2 :: 2.170	 	HG3 :: 2.170	
	Ave H Shift Values>> 	H :: 8.33(0.59) 	HA :: 4.25(0.41) 	HB2 :: 2.02(0.21) 	HB3 :: 1.99(0.23) 	HG2 :: 2.27(0.21) 	HG3 :: 2.25(0.22)

	N Shift Assignments>> 	N :: 117.174	
	Ave N Shift Values>> 	N :: 120.67(3.48)



1.F49	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.84   F 0.15   

	C Shift Assignments>> 	C :: 175.207	 	CA :: 60.926	 	CB :: 39.340	 	CD1 :: 131.932	 	CD2 :: 131.932	 	CE1 :: 134.128	
			 	CE2 :: 134.128	
	Ave C Shift Values>> 	C :: 175.42(1.99) 	CA :: 58.08(2.57) 	CB :: 39.99(2.09) 	CG :: 138.41(2.04) 	CD1 :: 131.58(1.18) 	CD2 :: 131.63(1.12)
			 	CE1 :: 130.71(1.3) 	CE2 :: 130.76(1.13) 	CZ :: 129.21(1.43)

	H Shift Assignments>> 	H :: 7.378	 	HA :: 3.054	 	HB2 :: 2.563	 	HB3 :: 2.564	 	HD1 :: 6.723	 	HD2 :: 6.723	
			 	HE1 :: 7.251	 	HE2 :: 7.251	
	Ave H Shift Values>> 	H :: 8.36(0.72) 	HA :: 4.63(0.57) 	HB2 :: 3(0.37) 	HB3 :: 2.93(0.4) 	HD1 :: 7.06(0.31) 	HD2 :: 7.06(0.31)
			 	HE1 :: 7.08(0.31) 	HE2 :: 7.08(0.32) 	HZ :: 7(0.42)

	N Shift Assignments>> 	N :: 120.987	
	Ave N Shift Values>> 	N :: 120.45(4.18)



1.V50	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.99   

	C Shift Assignments>> 	C :: 178.873	 	CA :: 65.850	 	CB :: 31.561	 	CG1 :: 23.596	 	CG2 :: 20.229	
	Ave C Shift Values>> 	C :: 175.62(1.9) 	CA :: 62.49(2.86) 	CB :: 32.73(1.79) 	CG1 :: 21.49(1.36) 	CG2 :: 21.26(1.56)

	H Shift Assignments>> 	H :: 8.196	 	HA :: 2.825	 	HB :: 1.532	 	HG11 :: 0.194	 	HG12 :: 0.194	 	HG13 :: 0.194	
			 	HG21 :: 0.371	 	HG22 :: 0.371	 	HG23 :: 0.371	
	Ave H Shift Values>> 	H :: 8.29(0.67) 	HA :: 4.19(0.58) 	HB :: 1.98(0.32) 	HG1 :: 0.83(0.26) 	HG2 :: 0.8(0.28)

	N Shift Assignments>> 	N :: 118.065	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.A51	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.92   I 0.07   

	C Shift Assignments>> 	C :: 180.076	 	CA :: 54.831	 	CB :: 17.635	
	Ave C Shift Values>> 	C :: 177.74(2.13) 	CA :: 53.14(1.98) 	CB :: 19.01(1.83)

	H Shift Assignments>> 	H :: 8.174	 	HA :: 3.841	 	HB1 :: 1.251	 	HB2 :: 1.251	 	HB3 :: 1.251	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.44) 	HB :: 1.35(0.26)

	N Shift Assignments>> 	N :: 123.161	
	Ave N Shift Values>> 	N :: 123.23(3.54)



1.E52	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.28   K 0.27   Q 0.26   I 0.14   R 0.03   

	C Shift Assignments>> 	C :: 179.155	 	CA :: 59.189	 	CB :: 28.436	 	CG :: 34.952	
	Ave C Shift Values>> 	C :: 176.87(1.95) 	CA :: 57.32(2.09) 	CB :: 30.01(1.72) 	CG :: 36.11(1.19) 	CD :: 182.4(1.78)

	H Shift Assignments>> 	H :: 7.470	 	HA :: 3.934	 	HB2 :: 1.634	 	HB3 :: 1.746	 	HG2 :: 2.505	 	HG3 :: 2.505	
	Ave H Shift Values>> 	H :: 8.33(0.59) 	HA :: 4.25(0.41) 	HB2 :: 2.02(0.21) 	HB3 :: 1.99(0.23) 	HG2 :: 2.27(0.21) 	HG3 :: 2.25(0.22)

	N Shift Assignments>> 	N :: 120.129	
	Ave N Shift Values>> 	N :: 120.67(3.48)



1.V53	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	V 0.99   

	C Shift Assignments>> 	C :: 177.820	 	CA :: 66.115	 	CB :: 30.821	 	CG1 :: 21.427	 	CG2 :: 20.696	
	Ave C Shift Values>> 	C :: 175.62(1.9) 	CA :: 62.49(2.86) 	CB :: 32.73(1.79) 	CG1 :: 21.49(1.36) 	CG2 :: 21.26(1.56)

	H Shift Assignments>> 	H :: 7.512	 	HA :: 2.350	 	HB :: 1.336	 	HG11 :: 0.075	 	HG12 :: 0.075	 	HG13 :: 0.075	
			 	HG21 :: -0.750(S)	 	HG22 :: -0.750(S)	 	HG23 :: -0.750(S)	
	Ave H Shift Values>> 	H :: 8.29(0.67) 	HA :: 4.19(0.58) 	HB :: 1.98(0.32) 	HG1 :: 0.83(0.26) 	HG2 :: 0.8(0.28)

	N Shift Assignments>> 	N :: 120.587	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.S54	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.99   

	C Shift Assignments>> 	C :: 176.843	 	CA :: 62.094	 	CB :: 62.478	
	Ave C Shift Values>> 	C :: 174.62(1.72) 	CA :: 58.72(2.07) 	CB :: 63.8(1.48)

	H Shift Assignments>> 	H :: 8.549	 	HA :: 3.68	 	HB2 :: 3.53	 	HB3 :: 3.53	
	Ave H Shift Values>> 	H :: 8.28(0.59) 	HA :: 4.48(0.4) 	HB2 :: 3.88(0.25) 	HB3 :: 3.85(0.27) 	HG :: 5.36(1.03)

	N Shift Assignments>> 	N :: 114.485	
	Ave N Shift Values>> 	N :: 116.28(3.52)



1.S55	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.99   

	C Shift Assignments>> 	C :: 176.279	 	CA :: 61.180	 	CB :: 62.276	
	Ave C Shift Values>> 	C :: 174.62(1.72) 	CA :: 58.72(2.07) 	CB :: 63.8(1.48)

	H Shift Assignments>> 	H :: 8.079	 	HA :: 4.019	 	HB2 :: 3.841	 	HB3 :: 3.823	
	Ave H Shift Values>> 	H :: 8.28(0.59) 	HA :: 4.48(0.4) 	HB2 :: 3.88(0.25) 	HB3 :: 3.85(0.27) 	HG :: 5.36(1.03)

	N Shift Assignments>> 	N :: 119.035	
	Ave N Shift Values>> 	N :: 116.28(3.52)



1.Y56	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.98   Y 0.01   

	C Shift Assignments>> 	C :: 178.384	 	CA :: 61.840	 	CB :: 37.928	 	CD1 :: 129.754	 	CD2 :: 129.754	
	Ave C Shift Values>> 	C :: 175.4(1.99) 	CA :: 58.13(2.51) 	CB :: 39.32(2.16) 	CG :: 129.75(4.96) 	CD1 :: 132.77(1.17) 	CD2 :: 132.73(1.3)
			 	CE1 :: 117.93(1.19) 	CE2 :: 117.9(1.18) 	CZ :: 156.76(1.99)

	H Shift Assignments>> 	H :: 7.794	 	HA :: 3.742	 	HB2 :: 3.011	 	HB3 :: 3.030	 	HD1 :: 6.114	 	HD2 :: 6.406	
			 	HE1 :: 6.082	 	HE2 :: 6.731	
	Ave H Shift Values>> 	H :: 8.32(0.73) 	HA :: 4.63(0.56) 	HB2 :: 2.91(0.37) 	HB3 :: 2.84(0.39) 	HD1 :: 6.93(0.3) 	HD2 :: 6.93(0.3)
			 	HE1 :: 6.7(0.23) 	HE2 :: 6.71(0.23) 	HH :: 9.3(1.36)

	N Shift Assignments>> 	N :: 123.512	
	Ave N Shift Values>> 	N :: 120.52(4.2)



1.L57	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	L 0.98   

	C Shift Assignments>> 	C :: 178.816	 	CA :: 57.792	 	CB :: 41.675	 	CG :: 26.420	 	CD1 :: 23.505	 	CD2 :: 24.205	
	Ave C Shift Values>> 	C :: 176.99(1.98) 	CA :: 55.62(2.13) 	CB :: 42.31(1.88) 	CG :: 26.78(1.1) 	CD1 :: 24.72(1.59) 	CD2 :: 24.05(1.7)

	H Shift Assignments>> 	H :: 8.389	 	HA :: 3.345	 	HB2 :: 0.449(S)	 	HB3 :: 1.709	 	HG :: 1.490	 	HD11 :: 0.165	
			 	HD12 :: 0.165	 	HD13 :: 0.165	 	HD21 :: -0.455(S)	 	HD22 :: -0.455(S)	 	HD23 :: -0.455(S)	
	Ave H Shift Values>> 	H :: 8.23(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.61(0.34) 	HB3 :: 1.52(0.36) 	HG :: 1.51(0.33) 	HD1 :: 0.75(0.28)
			 	HD2 :: 0.73(0.29)

	N Shift Assignments>> 	N :: 119.571	
	Ave N Shift Values>> 	N :: 121.86(3.9)



1.K58	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.82   R 0.16   

	C Shift Assignments>> 	C :: 179.380	 	CA :: 58.987	 	CB :: 32.054	 	CG :: 24.443	 	CD :: 29.012	 	CE :: 41.806	
	Ave C Shift Values>> 	C :: 176.64(2) 	CA :: 56.95(2.2) 	CB :: 32.79(1.78) 	CG :: 24.89(1.13) 	CD :: 28.96(1.08) 	CE :: 41.89(0.82)

	H Shift Assignments>> 	H :: 7.918	 	HA :: 3.962	 	HB2 :: 1.814	 	HB3 :: 1.814	 	HG2 :: 1.222	 	HG3 :: 1.350	
	Ave H Shift Values>> 	H :: 8.19(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.78(0.25) 	HB3 :: 1.74(0.27) 	HG2 :: 1.37(0.26) 	HG3 :: 1.35(0.28)
			 	HD2 :: 1.61(0.22) 	HD3 :: 1.6(0.22) 	HE2 :: 2.92(0.19) 	HE3 :: 2.91(0.2) 	HZ :: 7.42(0.67)

	N Shift Assignments>> 	N :: 119.807	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.R59	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.75   K 0.18   G 0.05   

	C Shift Assignments>> 	C :: 176.448	 	CA :: 57.250	 	CB :: 31.058	 	CG :: 27.184	 	CD :: 42.994	
	Ave C Shift Values>> 	C :: 176.41(2.03) 	CA :: 56.77(2.31) 	CB :: 30.7(1.83) 	CG :: 27.21(1.2) 	CD :: 43.16(0.88) 	CZ :: 159.97(2.95)

	H Shift Assignments>> 	H :: 7.609	 	HA :: 4.035	 	HB2 :: 1.581	 	HB3 :: 1.581	 	HG2 :: 1.364	 	HG3 :: 1.364	
			 	HD2 :: 2.946	 	HD3 :: 2.946	
	Ave H Shift Values>> 	H :: 8.24(0.61) 	HA :: 4.3(0.46) 	HB2 :: 1.79(0.27) 	HB3 :: 1.76(0.28) 	HG2 :: 1.57(0.27) 	HG3 :: 1.54(0.29)
			 	HD2 :: 3.12(0.24) 	HD3 :: 3.1(0.26) 	HE :: 7.4(0.63) 	HH11 :: 6.91(0.46) 	HH12 :: 6.8(0.33) 	HH21 :: 6.81(0.48)
			 	HH22 :: 6.76(0.36)

	N Shift Assignments>> 	N :: 116.243	
	Ave N Shift Values>> 	N :: 120.8(3.68) 	NE :: 84.63(1.68) 	NH1 :: 73.82(4.62) 	NH2 :: 73.26(3.32)



1.N60	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	N 0.5   D 0.24   F 0.08   Y 0.08   L 0.07   

	C Shift Assignments>> 	C :: 173.572	 	CA :: 53.269	 	CB :: 39.208	
	Ave C Shift Values>> 	C :: 175.27(1.79) 	CA :: 53.54(1.88) 	CB :: 38.69(1.69) 	CG :: 176.76(1.38)

	H Shift Assignments>> 	H :: 7.042	 	HA :: 4.593	 	HB2 :: 1.614(S)	 	HB3 :: 2.547	
	Ave H Shift Values>> 	H :: 8.34(0.63) 	HA :: 4.67(0.36) 	HB2 :: 2.81(0.31) 	HB3 :: 2.75(0.33) 	HD21 :: 7.35(0.48) 	HD22 :: 7.14(0.49)

	N Shift Assignments>> 	N :: 115.424	
	Ave N Shift Values>> 	N :: 118.93(4.03) 	ND2 :: 112.75(2.23)



1.G61	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.9   L 0.07   

	C Shift Assignments>> 	C :: 175.621	 	CA :: 45.868	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	H :: 7.223	 	HA2 :: 3.458	 	HA3 :: 3.860	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)

	N Shift Assignments>> 	N :: 103.144	
	Ave N Shift Values>> 	N :: 109.67(3.87)



1.G62	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.86   L 0.1   R 0.01   F 0.01   

	C Shift Assignments>> 	C :: 172.688	 	CA :: 45.287	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	H :: 8.852	 	HA2 :: 2.784	 	HA3 :: 3.962	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)

	N Shift Assignments>> 	N :: 109.290	
	Ave N Shift Values>> 	N :: 109.67(3.87)



1.I63	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.99   

	C Shift Assignments>> 	C :: 175.057	 	CA :: 60.094	 	CB :: 40.068	 	CG1 :: 26.872	 	CG2 :: 17.043	 	CD1 :: 12.584	
	Ave C Shift Values>> 	C :: 175.85(1.92) 	CA :: 61.61(2.68) 	CB :: 38.63(2.02) 	CG1 :: 27.71(1.68) 	CG2 :: 17.53(1.36) 	CD1 :: 13.43(1.67)

	H Shift Assignments>> 	H :: 9.762	 	HA :: 4.112	 	HB :: 1.391	 	HG12 :: 0.866	 	HG13 :: 0.866	 	HG21 :: 0.686	
			 	HG22 :: 0.686	 	HG23 :: 0.686	 	HD11 :: 0.622	 	HD12 :: 0.622	 	HD13 :: 0.622	
	Ave H Shift Values>> 	H :: 8.28(0.68) 	HA :: 4.18(0.56) 	HB :: 1.78(0.29) 	HG2 :: 0.77(0.27) 	HG12 :: 1.28(0.4) 	HG13 :: 1.19(0.41)
			 	HD1 :: 0.68(0.29)

	N Shift Assignments>> 	N :: 131.206	
	Ave N Shift Values>> 	N :: 121.46(4.28)



1.K64	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.82   R 0.16   

	C Shift Assignments>> 	C :: 175.752	 	CA :: 55.625	 	CB :: 32.684	 	CG :: 25.052	 	CD :: 28.510	 	CE :: 41.524	
	Ave C Shift Values>> 	C :: 176.64(2) 	CA :: 56.95(2.2) 	CB :: 32.79(1.78) 	CG :: 24.89(1.13) 	CD :: 28.96(1.08) 	CE :: 41.89(0.82)

	H Shift Assignments>> 	H :: 8.426	 	HA :: 4.069	 	HB2 :: 1.319	 	HB3 :: 1.319	 	HG2 :: 1.158	 	HG3 :: 1.158	
	Ave H Shift Values>> 	H :: 8.19(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.78(0.25) 	HB3 :: 1.74(0.27) 	HG2 :: 1.37(0.26) 	HG3 :: 1.35(0.28)
			 	HD2 :: 1.61(0.22) 	HD3 :: 1.6(0.22) 	HE2 :: 2.92(0.19) 	HE3 :: 2.91(0.2) 	HZ :: 7.42(0.67)

	N Shift Assignments>> 	N :: 127.381	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.D65	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.38   N 0.29   L 0.16   F 0.06   Y 0.04   K 0.03   

	C Shift Assignments>> 	C :: 176.072	 	CA :: 52.611	 	CB :: 40.688	
	Ave C Shift Values>> 	C :: 176.4(1.75) 	CA :: 54.69(2.03) 	CB :: 40.88(1.62) 	CG :: 179.17(1.79)

	H Shift Assignments>> 	H :: 7.809	 	HA :: 4.122	 	HB2 :: 1.884	 	HB3 :: 2.268	
	Ave H Shift Values>> 	H :: 8.31(0.58) 	HA :: 4.59(0.32) 	HB2 :: 2.72(0.26) 	HB3 :: 2.66(0.28) 	HD2 :: 5.25(0.58)

	N Shift Assignments>> 	N :: 121.111	
	Ave N Shift Values>> 	N :: 120.65(3.86)



1.L66	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.87   A 0.11   

	C Shift Assignments>> 	C :: 177.782	 	CA :: 54.996	 	CB :: 41.001	 	CG :: 26.690	 	CD1 :: 24.534	 	CD2 :: 22.341	
	Ave C Shift Values>> 	C :: 176.99(1.98) 	CA :: 55.62(2.13) 	CB :: 42.31(1.88) 	CG :: 26.78(1.1) 	CD1 :: 24.72(1.59) 	CD2 :: 24.05(1.7)

	H Shift Assignments>> 	H :: 8.423	 	HA :: 4.112	 	HB2 :: 1.418	 	HB3 :: 1.418	 	HG :: 1.409	 	HD11 :: 0.676	
			 	HD12 :: 0.676	 	HD13 :: 0.676	 	HD21 :: 0.568	 	HD22 :: 0.568	 	HD23 :: 0.568	
	Ave H Shift Values>> 	H :: 8.23(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.61(0.34) 	HB3 :: 1.52(0.36) 	HG :: 1.51(0.33) 	HD1 :: 0.75(0.28)
			 	HD2 :: 0.73(0.29)

	N Shift Assignments>> 	N :: 126.03	
	Ave N Shift Values>> 	N :: 121.86(3.9)



1.T67	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.99   

	C Shift Assignments>> 	C :: 174.831	 	CA :: 63.301	 	CB :: 69.221	 	CG2 :: 21.230	
	Ave C Shift Values>> 	C :: 174.54(1.76) 	CA :: 62.22(2.59) 	CB :: 69.73(1.63) 	CG2 :: 21.55(1.11)

	H Shift Assignments>> 	H :: 8.146	 	HA :: 3.902	 	HB :: 3.937	 	HG21 :: 0.996	 	HG22 :: 0.996	 	HG23 :: 0.996	
	Ave H Shift Values>> 	H :: 8.24(0.62) 	HA :: 4.46(0.48) 	HB :: 4.17(0.33) 	HG1 :: 4.92(1.58) 	HG2 :: 1.14(0.23) 	HG21 :: 1.14(0.23)
			 	HG22 :: 1.14(0.23) 	HG23 :: 1.14(0.23)

	N Shift Assignments>> 	N :: 113.448	
	Ave N Shift Values>> 	N :: 115.42(4.75)



2.D1	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Consistent 	N Shifts: Indeterminable


	H Shift Assignments>> 	HA :: 4.485	
	Ave H Shift Values>> 	H :: 8.31(0.58) 	HA :: 4.59(0.32) 	HB2 :: 2.72(0.26) 	HB3 :: 2.66(0.28) 	HD2 :: 5.25(0.58)



2.L2	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Consistent 	N Shifts: Indeterminable


	H Shift Assignments>> 	H :: 9.057	 	HA :: 3.893	 	HB2 :: 1.505	 	HB3 :: 1.505	 	HG :: 1.505	 	HD11 :: 0.516	
			 	HD12 :: 0.516	 	HD13 :: 0.516	 	HD21 :: 0.138	 	HD22 :: 0.138	 	HD23 :: 0.138	
	Ave H Shift Values>> 	H :: 8.23(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.61(0.34) 	HB3 :: 1.52(0.36) 	HG :: 1.51(0.33) 	HD1 :: 0.75(0.28)
			 	HD2 :: 0.73(0.29)



2.L3	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.98   

	C Shift Assignments>> 	CA :: 57.887	 	CB :: 40.400	 	CG :: 27.880	 	CD1 :: 25.400	 	CD2 :: 24.500	
	Ave C Shift Values>> 	C :: 176.99(1.98) 	CA :: 55.62(2.13) 	CB :: 42.31(1.88) 	CG :: 26.78(1.1) 	CD1 :: 24.72(1.59) 	CD2 :: 24.05(1.7)

	H Shift Assignments>> 	H :: 7.942	 	HA :: 4.092	 	HB2 :: 1.872	 	HB3 :: 1.387	 	HG :: 1.510	 	HD11 :: 0.709	
			 	HD12 :: 0.709	 	HD13 :: 0.709	 	HD21 :: 0.600	 	HD22 :: 0.600	 	HD23 :: 0.600	
	Ave H Shift Values>> 	H :: 8.23(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.61(0.34) 	HB3 :: 1.52(0.36) 	HG :: 1.51(0.33) 	HD1 :: 0.75(0.28)
			 	HD2 :: 0.73(0.29)

	N Shift Assignments>> 	N :: 117.944	
	Ave N Shift Values>> 	N :: 121.86(3.9)



2.N4	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Consistent 	N Shifts: Indeterminable


	H Shift Assignments>> 	H :: 7.896	 	HA :: 3.902	 	HB2 :: 2.105	 	HB3 :: 1.708	
	Ave H Shift Values>> 	H :: 8.34(0.63) 	HA :: 4.67(0.36) 	HB2 :: 2.81(0.31) 	HB3 :: 2.75(0.33) 	HD21 :: 7.35(0.48) 	HD22 :: 7.14(0.49)



2.L5	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.91   A 0.07   R 0.01   

	C Shift Assignments>> 	CA :: 56.560	 	CB :: 41.000	 	CG :: 26.400	 	CD1 :: 26.000	 	CD2 :: 22.060	
	Ave C Shift Values>> 	C :: 176.99(1.98) 	CA :: 55.62(2.13) 	CB :: 42.31(1.88) 	CG :: 26.78(1.1) 	CD1 :: 24.72(1.59) 	CD2 :: 24.05(1.7)

	H Shift Assignments>> 	H :: 7.188	 	HA :: 3.770	 	HB2 :: 1.517	 	HB3 :: 0.812	 	HG :: 1.630	 	HD11 :: 0.611	
			 	HD12 :: 0.611	 	HD13 :: 0.611	 	HD21 :: 0.551	 	HD22 :: 0.551	 	HD23 :: 0.551	
	Ave H Shift Values>> 	H :: 8.23(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.61(0.34) 	HB3 :: 1.52(0.36) 	HG :: 1.51(0.33) 	HD1 :: 0.75(0.28)
			 	HD2 :: 0.73(0.29)

	N Shift Assignments>> 	N :: 116.848	
	Ave N Shift Values>> 	N :: 121.86(3.9)



2.F6	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Consistent 	N Shifts: Indeterminable


	H Shift Assignments>> 	H :: 7.176	 	HA :: 3.907	 	HB2 :: 3.259	 	HB3 :: 2.739	 	HD1 :: 7.315	 	HD2 :: 7.315	
			 	HE1 :: 6.915	 	HE2 :: 6.915	 	HZ :: 6.348	
	Ave H Shift Values>> 	H :: 8.36(0.72) 	HA :: 4.63(0.57) 	HB2 :: 3(0.37) 	HB3 :: 2.93(0.4) 	HD1 :: 7.06(0.31) 	HD2 :: 7.06(0.31)
			 	HE1 :: 7.08(0.31) 	HE2 :: 7.08(0.32) 	HZ :: 7(0.42)



2.N7	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Consistent 	N Shifts: Indeterminable


	H Shift Assignments>> 	H :: 7.437	 	HA :: 4.521	 	HB2 :: 2.734	 	HB3 :: 2.568	
	Ave H Shift Values>> 	H :: 8.34(0.63) 	HA :: 4.67(0.36) 	HB2 :: 2.81(0.31) 	HB3 :: 2.75(0.33) 	HD21 :: 7.35(0.48) 	HD22 :: 7.14(0.49)



2.Q8	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Consistent 	N Shifts: Indeterminable


	H Shift Assignments>> 	H :: 7.795	 	HA :: 4.386	 	HB2 :: 2.568	 	HB3 :: 2.568	
	Ave H Shift Values>> 	H :: 8.22(0.59) 	HA :: 4.27(0.44) 	HB2 :: 2.05(0.25) 	HB3 :: 2.02(0.28) 	HG2 :: 2.32(0.27) 	HG3 :: 2.29(0.29)
			 	HE21 :: 7.24(0.45) 	HE22 :: 7.02(0.44)





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

Overall Results:

	      #Consistent:  67      #Clerical:   0      #Suspicious:   8      #Anomalous:   0      #Mistyped:   0      #Indeterminable:   0


Typing Results:

	      #Consistent:  67      #Suspicious:   0      #Mistyped:   0      #Indeterminable:   8


Shift Relative Order (SRO) Results:

	      #Consistent:  75      #Suspicious:   0


C Shift Results:

	      #Consistent: 289      #Duplicate:   0      #Unknown:   0      #Suspicious:   0      #Anomalous:   0


H Shift Results:

	      #Consistent: 448      #Duplicate:   0      #Unknown:   0      #Suspicious:  16      #Anomalous:   0


N Shift Results:

	      #Consistent:  66      #Duplicate:   0      #Unknown:   0      #Suspicious:   0      #Anomalous:   0



Error Summary:

1.F3	HB3 = 4.473(S),	 Expected =  2.93, Std = 0.4000, ChiSquare = 1.1455e-04
1.A12	H = 6.211(S),	 Expected =  8.20, Std = 0.6000, ChiSquare = 9.1643e-04
1.G14	HA3 = 6.033(S),	 Expected =  3.90, Std = 0.3700, ChiSquare = 8.1723e-09
1.S15	HB2 = 1.933(S),	 Expected =  3.88, Std = 0.2500, ChiSquare = 6.8078e-15
1.S15	HB3 = 2.298(S),	 Expected =  3.85, Std = 0.2700, ChiSquare = 9.0226e-09
1.E36	HB2 = 0.885(S),	 Expected =  2.02, Std = 0.2100, ChiSquare = 6.4895e-08
1.E36	HG2 = 1.240(S),	 Expected =  2.27, Std = 0.2100, ChiSquare = 9.3541e-07
1.E36	HG3 = 1.240(S),	 Expected =  2.25, Std = 0.2200, ChiSquare = 4.4132e-06
1.V53	HG21 = -0.750(S),	 Expected =  0.80, Std = 0.2800, ChiSquare = 3.0996e-08
1.V53	HG22 = -0.750(S),	 Expected =  0.80, Std = 0.2800, ChiSquare = 3.0996e-08
1.V53	HG23 = -0.750(S),	 Expected =  0.80, Std = 0.2800, ChiSquare = 3.0996e-08
1.L57	HB2 = 0.449(S),	 Expected =  1.61, Std = 0.3400, ChiSquare = 6.3851e-04
1.L57	HD21 = -0.455(S),	 Expected =  0.73, Std = 0.2900, ChiSquare = 4.3848e-05
1.L57	HD22 = -0.455(S),	 Expected =  0.73, Std = 0.2900, ChiSquare = 4.3848e-05
1.L57	HD23 = -0.455(S),	 Expected =  0.73, Std = 0.2900, ChiSquare = 4.3848e-05
1.N60	HB2 = 1.614(S),	 Expected =  2.81, Std = 0.3100, ChiSquare = 1.1429e-04