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


1.G1	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Indeterminable 	N Shifts: Indeterminable




1.S2	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Indeterminable 	N Shifts: Indeterminable




1.S3	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Indeterminable 	N Shifts: Indeterminable




1.G4	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Indeterminable 	N Shifts: Indeterminable




1.S5	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Indeterminable 	N Shifts: Indeterminable




1.S6	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Indeterminable 	N Shifts: Indeterminable




1.G7	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	G 0.83   L 0.1   C 0.02   R 0.01   F 0.01   

	C Shift Assignments>> 	C :: 173.717	 	CA :: 45.273	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	HA2 :: 3.913	 	HA3 :: 3.913	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)



1.K8	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.48   C 0.38   R 0.11   

	HN Overlap>>	 1.E63 1.E63

	C Shift Assignments>> 	C :: 175.267	 	CA :: 56.012	 	CB :: 33.208	 	CG :: 24.666	 	CD :: 29.033	 	CE :: 42.215	
	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 :: 8.052	 	HA :: 4.215	 	HB2 :: 1.594	 	HB3 :: 1.594	 	HG2 :: 1.246	 	HG3 :: 1.175	
			 	HD2 :: 1.585	 	HD3 :: 1.585	 	HE2 :: 2.911	 	HE3 :: 2.911	
	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 :: 121.108	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.I9	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.59   C 0.4   

	C Shift Assignments>> 	C :: 174.866	 	CA :: 59.681	 	CB :: 40.512	 	CG1 :: 26.547	 	CG2 :: 18.216	 	CD1 :: 13.155	
	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 :: 7.554	 	HA :: 4.295	 	HB :: 1.653	 	HG12 :: 1.196	 	HG13 :: 0.960	 	HG21 :: 0.699	
			 	HG22 :: 0.699	 	HG23 :: 0.699	 	HD11 :: 0.690	 	HD12 :: 0.690	 	HD13 :: 0.690	
	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 :: 118.302	
	Ave N Shift Values>> 	N :: 121.46(4.28)



1.F10	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.72   C 0.27   

	C Shift Assignments>> 	C :: 174.690	 	CA :: 57.203	 	CB :: 40.619	 	CD1 :: 131.858	 	CD2 :: 131.858	 	CE1 :: 131.453	
			 	CE2 :: 131.453	 	CZ :: 129.882	
	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 :: 8.487	 	HA :: 4.716	 	HB2 :: 3.084	 	HB3 :: 2.805	 	HD1 :: 7.061	 	HD2 :: 7.061	
			 	HE1 :: 7.325	 	HE2 :: 7.325	 	HZ :: 7.335	
	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 :: 123.504	
	Ave N Shift Values>> 	N :: 120.45(4.18)



1.T11	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.88   C 0.1   

	C Shift Assignments>> 	C :: 173.748	 	CA :: 61.441	 	CB :: 70.585	 	CG2 :: 21.392	
	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 :: 8.565	 	HA :: 5.016	 	HB :: 3.860	 	HG21 :: 1.021	 	HG22 :: 1.021	 	HG23 :: 1.021	
	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 :: 119.193	
	Ave N Shift Values>> 	N :: 115.42(4.75)



1.C12	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.26   E 0.15   R 0.12   H 0.11   I 0.09   Q 0.08   K 0.07   V 0.07   

	C Shift Assignments>> 	C :: 177.080	 	CA :: 59.862	 	CB :: 30.114	
	Ave C Shift Values>> 	C :: 174.95(2.07) 	CA :: 58.3(3.33) 	CB :: 32.49(6.01)

	H Shift Assignments>> 	H :: 9.198	 	HA :: 4.600	 	HB2 :: 3.381	 	HB3 :: 2.905	
	Ave H Shift Values>> 	H :: 8.39(0.67) 	HA :: 4.66(0.55) 	HB2 :: 2.96(0.44) 	HB3 :: 2.89(0.46) 	HG :: 1.98(1.38)

	N Shift Assignments>> 	N :: 128.234	
	Ave N Shift Values>> 	N :: 120.17(4.64)



1.E13	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.37   C 0.34   K 0.11   Q 0.09   I 0.06   

	C Shift Assignments>> 	C :: 176.282	 	CA :: 58.106	 	CB :: 29.717	 	CG :: 35.862	
	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 :: 9.565	 	HA :: 4.159	 	HB2 :: 1.839	 	HB3 :: 1.839	 	HG2 :: 1.916	 	HG3 :: 1.621	
	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 :: 131.090	
	Ave N Shift Values>> 	N :: 120.67(3.48)



1.Y14	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.57   C 0.42   

	C Shift Assignments>> 	C :: 177.047	 	CA :: 60.050	 	CB :: 37.146	 	CD1 :: 133.056	 	CD2 :: 133.056	 	CE1 :: 118.180	
			 	CE2 :: 118.180	
	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 :: 9.072	 	HA :: 4.307	 	HB2 :: 2.339	 	HB3 :: 1.596	 	HD1 :: 6.930	 	HD2 :: 6.930	
			 	HE1 :: 6.776	 	HE2 :: 6.776	
	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 :: 120.533	
	Ave N Shift Values>> 	N :: 120.52(4.2)



1.C15	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.26   K 0.17   R 0.15   H 0.12   E 0.11   V 0.09   Q 0.05   

	HN Overlap>>	 1.L29 1.L29

	C Shift Assignments>> 	C :: 175.329	 	CA :: 58.681	 	CB :: 31.906	
	Ave C Shift Values>> 	C :: 174.95(2.07) 	CA :: 58.3(3.33) 	CB :: 32.49(6.01)

	H Shift Assignments>> 	H :: 8.328	 	HA :: 5.171	 	HB2 :: 3.480	 	HB3 :: 2.917	
	Ave H Shift Values>> 	H :: 8.39(0.67) 	HA :: 4.66(0.55) 	HB2 :: 2.96(0.44) 	HB3 :: 2.89(0.46) 	HG :: 1.98(1.38)

	N Shift Assignments>> 	N :: 117.098	
	Ave N Shift Values>> 	N :: 120.17(4.64)



1.N16	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	N 0.23   C 0.19   Y 0.19   F 0.14   E 0.09   D 0.07   I 0.02   L 0.02   

	C Shift Assignments>> 	C :: 174.048	 	CA :: 55.423	 	CB :: 37.856	
	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 :: 8.293	 	HA :: 4.517	 	HB2 :: 3.011	 	HB3 :: 3.011	 	HD21 :: 6.786	 	HD22 :: 7.438	
	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 :: 118.059	 	ND2 :: 112.244	
	Ave N Shift Values>> 	N :: 118.93(4.03) 	ND2 :: 112.75(2.23)



1.K17	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.41   K 0.29   R 0.27   

	C Shift Assignments>> 	C :: 174.446	 	CA :: 58.297	 	CB :: 34.088	 	CG :: 26.451	 	CD :: 29.333	 	CE :: 42.227	
	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 :: 7.870	 	HA :: 4.082	 	HB2 :: 1.534	 	HB3 :: 1.257	 	HG2 :: 1.494	 	HG3 :: 1.046	
			 	HD2 :: 1.411	 	HD3 :: 1.520	 	HE2 :: 2.987	 	HE3 :: 2.903	
	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 :: 121.832	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.V18	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.55   C 0.44   

	C Shift Assignments>> 	C :: 175.318	 	CA :: 60.866	 	CB :: 34.015	 	CG1 :: 21.990	 	CG2 :: 20.593	
	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 :: 7.628	 	HA :: 4.709	 	HB :: 1.727	 	HG11 :: 0.796	 	HG12 :: 0.796	 	HG13 :: 0.796	
			 	HG21 :: 0.823	 	HG22 :: 0.823	 	HG23 :: 0.823	
	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 :: 118.713	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.F19	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.68   C 0.18   G 0.12   

	C Shift Assignments>> 	C :: 175.059	 	CA :: 56.979	 	CB :: 43.278	 	CD1 :: 132.437	 	CD2 :: 132.437	 	CE1 :: 130.637	
			 	CE2 :: 130.637	 	CZ :: 128.494	
	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 :: 9.051	 	HA :: 4.708	 	HB2 :: 3.345	 	HB3 :: 2.687	 	HD1 :: 7.216	 	HD2 :: 7.216	
			 	HE1 :: 6.850	 	HE2 :: 6.850	 	HZ :: 6.109	
	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 :: 122.240	
	Ave N Shift Values>> 	N :: 120.45(4.18)



1.K20	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.46   C 0.42   R 0.1   

	C Shift Assignments>> 	C :: 175.296	 	CA :: 57.095	 	CB :: 33.278	 	CG :: 24.776	 	CD :: 28.977	 	CE :: 42.050	
	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 :: 8.877	 	HA :: 4.347	 	HB2 :: 1.482	 	HB3 :: 1.394	 	HG2 :: 1.269	 	HG3 :: 1.060	
			 	HD2 :: 1.572	 	HD3 :: 1.572	 	HE2 :: 2.906	 	HE3 :: 2.906	
	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 :: 120.516	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.F21	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.74   C 0.22   G 0.03   

	C Shift Assignments>> 	C :: 175.806	 	CA :: 55.294	 	CB :: 42.378	 	CD1 :: 132.659	 	CD2 :: 132.659	 	CE1 :: 131.449	
			 	CE2 :: 131.449	 	CZ :: 129.968	
	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 :: 7.190	 	HA :: 4.959	 	HB2 :: 2.955	 	HB3 :: 2.417	 	HD1 :: 7.428	 	HD2 :: 7.428	
			 	HE1 :: 7.471	 	HE2 :: 7.471	 	HZ :: 7.403	
	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 :: 112.406	
	Ave N Shift Values>> 	N :: 120.45(4.18)



1.K22	Overall: Suspicious 	Typing: Consistent 	SRO: Suspicious 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.46   K 0.43   R 0.09   

	C Shift Assignments>> 	C :: 178.829	 	CA :: 59.474	 	CB :: 31.829	 	CG :: 24.781	 	CD :: 29.320	 	CE :: 42.148	
	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 :: 8.726	 	HA :: 2.862	 	HB2 :: 1.556	 	HB3 :: 1.195	 	HG2 :: 1.158	 	HG3 :: 1.060	
			 	HD2 :: 1.605	 	HD3 :: 1.605	 	HE2 :: 2.921	 	HE3 :: 2.838	
	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 :: 126.468	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)

	SRO Rule Breaks>>  	(HA > HE2 : 0.9935)


1.H23	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	C 0.52   H 0.47   

	C Shift Assignments>> 	C :: 178.158	 	CA :: 58.981	 	CB :: 29.153	 	CD2 :: 119.370	 	CE1 :: 138.839	
	Ave C Shift Values>> 	C :: 175.25(1.97) 	CA :: 56.52(2.31) 	CB :: 30.24(2.07) 	CG :: 131.52(3.27) 	CD2 :: 120.49(3.42) 	CE1 :: 137.71(2.12)

	H Shift Assignments>> 	HA :: 4.380	 	HB2 :: 3.137	 	HB3 :: 3.047	 	HD2 :: 6.975	 	HE1 :: 7.375	
	Ave H Shift Values>> 	H :: 8.24(0.68) 	HA :: 4.61(0.43) 	HB2 :: 3.1(0.36) 	HB3 :: 3.04(0.38) 	HD1 :: 8.68(2.62) 	HD2 :: 7(0.43)
			 	HE1 :: 7.95(0.48) 	HE2 :: 9.64(2.6)



1.S24	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.99   

	C Shift Assignments>> 	C :: 176.624	 	CA :: 60.484	 	CB :: 62.396	
	Ave C Shift Values>> 	C :: 174.62(1.72) 	CA :: 58.72(2.07) 	CB :: 63.8(1.48)

	H Shift Assignments>> 	H :: 6.478	 	HA :: 4.269	 	HB2 :: 4.071	 	HB3 :: 3.990	
	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 :: 118.183	
	Ave N Shift Values>> 	N :: 116.28(3.52)



1.L25	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.75   L 0.22   A 0.01   

	C Shift Assignments>> 	C :: 177.390	 	CA :: 57.705	 	CB :: 40.236	 	CG :: 27.730	 	CD1 :: 22.585	 	CD2 :: 26.664	
	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 :: 6.965	 	HA :: 3.060	 	HB2 :: 1.886	 	HB3 :: 1.159	 	HG :: 1.526	 	HD11 :: 0.997	
			 	HD12 :: 0.997	 	HD13 :: 0.997	 	HD21 :: 1.069	 	HD22 :: 1.069	 	HD23 :: 1.069	
	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 :: 124.201	
	Ave N Shift Values>> 	N :: 121.86(3.9)



1.Q26	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.36   Q 0.22   K 0.21   E 0.08   I 0.05   R 0.04   

	HN Overlap>>	 1.L29 1.L29

	C Shift Assignments>> 	C :: 178.480	 	CA :: 59.392	 	CB :: 28.336	 	CG :: 34.185	
	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 :: 8.267	 	HA :: 3.831	 	HB2 :: 2.106	 	HB3 :: 2.037	 	HG2 :: 2.427	 	HG3 :: 2.334	
	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 :: 116.994	
	Ave N Shift Values>> 	N :: 119.89(3.6) 	NE2 :: 111.87(1.72)



1.A27	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.9   C 0.04   I 0.04   

	C Shift Assignments>> 	C :: 180.113	 	CA :: 54.730	 	CB :: 18.208	
	Ave C Shift Values>> 	C :: 177.74(2.13) 	CA :: 53.14(1.98) 	CB :: 19.01(1.83)

	H Shift Assignments>> 	H :: 7.544	 	HA :: 4.088	 	HB1 :: 1.458	 	HB2 :: 1.458	 	HB3 :: 1.458	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.44) 	HB :: 1.35(0.26)

	N Shift Assignments>> 	N :: 119.622	
	Ave N Shift Values>> 	N :: 123.23(3.54)



1.H28	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.84   H 0.15   

	C Shift Assignments>> 	C :: 176.077	 	CA :: 59.095	 	CB :: 28.598	 	CD2 :: 127.484	 	CE1 :: 139.529	
	Ave C Shift Values>> 	C :: 175.25(1.97) 	CA :: 56.52(2.31) 	CB :: 30.24(2.07) 	CG :: 131.52(3.27) 	CD2 :: 120.49(3.42) 	CE1 :: 137.71(2.12)

	H Shift Assignments>> 	H :: 7.480	 	HA :: 4.214	 	HB2 :: 3.166	 	HB3 :: 2.908	 	HD2 :: 7.100	 	HE1 :: 8.075	
	Ave H Shift Values>> 	H :: 8.24(0.68) 	HA :: 4.61(0.43) 	HB2 :: 3.1(0.36) 	HB3 :: 3.04(0.38) 	HD1 :: 8.68(2.62) 	HD2 :: 7(0.43)
			 	HE1 :: 7.95(0.48) 	HE2 :: 9.64(2.6)

	N Shift Assignments>> 	N :: 118.919	
	Ave N Shift Values>> 	N :: 119.69(4) 	ND1 :: 195.02(18.51) 	NE2 :: 182.41(14.4)



1.L29	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.46   C 0.39   R 0.11   G 0.01   

	HN Overlap>>	 1.Q26 1.C15 1.Q26 1.C15

	C Shift Assignments>> 	C :: 178.679	 	CA :: 58.098	 	CB :: 42.409	 	CG :: 27.332	 	CD1 :: 25.766	 	CD2 :: 24.974	
	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 :: 8.352	 	HA :: 3.847	 	HB2 :: 1.947	 	HB3 :: 1.577	 	HG :: 2.055	 	HD11 :: 1.073	
			 	HD12 :: 1.073	 	HD13 :: 1.073	 	HD21 :: 1.459	 	HD22 :: 1.459	 	HD23 :: 1.459	
	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 :: 117.018	
	Ave N Shift Values>> 	N :: 121.86(3.9)



1.R30	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.44   C 0.43   G 0.06   K 0.05   

	C Shift Assignments>> 	C :: 178.408	 	CA :: 58.486	 	CB :: 30.088	 	CG :: 27.591	 	CD :: 43.362	
	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 :: 7.046	 	HA :: 4.043	 	HB2 :: 1.863	 	HB3 :: 1.803	 	HG2 :: 1.800	 	HG3 :: 1.661	
			 	HD2 :: 3.224	 	HD3 :: 3.224	
	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 :: 116.586	
	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.I31	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.76   C 0.23   

	C Shift Assignments>> 	C :: 177.264	 	CA :: 62.979	 	CB :: 37.632	 	CG1 :: 26.344	 	CG2 :: 16.443	 	CD1 :: 14.480	
	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 :: 7.770	 	HA :: 3.957	 	HB :: 1.667	 	HG12 :: 0.892	 	HG13 :: 0.532	 	HG21 :: 0.576	
			 	HG22 :: 0.576	 	HG23 :: 0.576	 	HD11 :: 0.631	 	HD12 :: 0.631	 	HD13 :: 0.631	
	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 :: 115.296	
	Ave N Shift Values>> 	N :: 121.46(4.28)



1.H32	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.84   H 0.15   

	C Shift Assignments>> 	C :: 175.549	 	CA :: 55.119	 	CB :: 28.270	 	CD2 :: 128.438	 	CE1 :: 140.096	
	Ave C Shift Values>> 	C :: 175.25(1.97) 	CA :: 56.52(2.31) 	CB :: 30.24(2.07) 	CG :: 131.52(3.27) 	CD2 :: 120.49(3.42) 	CE1 :: 137.71(2.12)

	H Shift Assignments>> 	H :: 7.223	 	HA :: 4.641	 	HB2 :: 2.539	 	HB3 :: 2.278	 	HD2 :: 6.664	 	HE1 :: 8.039	
	Ave H Shift Values>> 	H :: 8.24(0.68) 	HA :: 4.61(0.43) 	HB2 :: 3.1(0.36) 	HB3 :: 3.04(0.38) 	HD1 :: 8.68(2.62) 	HD2 :: 7(0.43)
			 	HE1 :: 7.95(0.48) 	HE2 :: 9.64(2.6)

	N Shift Assignments>> 	N :: 117.904	
	Ave N Shift Values>> 	N :: 119.69(4) 	ND1 :: 195.02(18.51) 	NE2 :: 182.41(14.4)



1.T33	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.93   C 0.06   

	C Shift Assignments>> 	C :: 174.487	 	CA :: 63.037	 	CB :: 69.409	 	CG2 :: 21.371	
	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 :: 7.578	 	HA :: 4.108	 	HB :: 4.203	 	HG21 :: 1.169	 	HG22 :: 1.169	 	HG23 :: 1.169	
	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 :: 112.476	
	Ave N Shift Values>> 	N :: 115.42(4.75)



1.N34	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	N 0.5   D 0.16   C 0.1   Y 0.08   F 0.08   L 0.04   

	C Shift Assignments>> 	C :: 175.000	 	CA :: 53.455	 	CB :: 38.658	
	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 :: 8.291	 	HA :: 4.641	 	HB2 :: 2.808	 	HB3 :: 2.694	 	HD21 :: 6.805	 	HD22 :: 7.538	
	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 :: 119.759	 	ND2 :: 112.619	
	Ave N Shift Values>> 	N :: 118.93(4.03) 	ND2 :: 112.75(2.23)



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

	PRTL>>	E 0.44   C 0.39   K 0.06   Q 0.05   I 0.03   

	C Shift Assignments>> 	C :: 176.270	 	CA :: 57.051	 	CB :: 30.313	 	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 :: 7.925	 	HA :: 4.131	 	HB2 :: 1.952	 	HB3 :: 1.876	 	HG2 :: 2.167	 	HG3 :: 2.167	
	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 :: 120.053	
	Ave N Shift Values>> 	N :: 120.67(3.48)



1.K36	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.57   C 0.29   R 0.1   G 0.01   

	C Shift Assignments>> 	C :: 173.663	 	CA :: 53.505	 	CB :: 33.152	 	CG :: 24.851	 	CD :: 29.568	 	CE :: 42.314	
	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 :: 8.189	 	HA :: 4.376	 	HB2 :: 1.550	 	HB3 :: 1.226	 	HG2 :: 1.292	 	HG3 :: 1.191	
			 	HD2 :: 1.507	 	HD3 :: 1.465	 	HE2 :: 2.898	 	HE3 :: 2.898	
	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 :: 120.576	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.P37	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	P 0.77   C 0.21   

	C Shift Assignments>> 	C :: 176.446	 	CA :: 63.622	 	CB :: 32.276	 	CG :: 26.743	 	CD :: 50.359	
	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 :: 4.131	 	HB2 :: 1.109	 	HB3 :: 1.966	 	HG2 :: 1.757	 	HG3 :: 1.422	 	HD2 :: 3.548	
			 	HD3 :: 3.472	
	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.Y38	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.53   C 0.46   

	C Shift Assignments>> 	C :: 173.892	 	CA :: 57.561	 	CB :: 36.712	 	CD1 :: 133.072	 	CD2 :: 133.072	 	CE1 :: 118.393	
			 	CE2 :: 118.393	
	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 :: 7.721	 	HA :: 4.637	 	HB2 :: 2.940	 	HB3 :: 2.940	 	HD1 :: 7.035	 	HD2 :: 7.035	
			 	HE1 :: 6.870	 	HE2 :: 6.870	
	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 :: 119.024	
	Ave N Shift Values>> 	N :: 120.52(4.2)



1.K39	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.52   C 0.35   R 0.09   G 0.01   

	C Shift Assignments>> 	C :: 175.709	 	CA :: 54.841	 	CB :: 34.491	 	CG :: 24.670	 	CD :: 28.956	 	CE :: 42.423	
	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 :: 8.195	 	HA :: 4.686	 	HB2 :: 1.947	 	HB3 :: 1.658	 	HG2 :: 1.407	 	HG3 :: 1.367	
			 	HD2 :: 1.706	 	HD3 :: 1.581	 	HE2 :: 2.953	 	HE3 :: 2.953	
	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 :: 124.466	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.C40	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.18   R 0.18   E 0.18   H 0.17   Q 0.12   K 0.09   V 0.02   I 0.01   

	C Shift Assignments>> 	C :: 174.854	 	CA :: 57.606	 	CB :: 30.726	
	Ave C Shift Values>> 	C :: 174.95(2.07) 	CA :: 58.3(3.33) 	CB :: 32.49(6.01)

	H Shift Assignments>> 	H :: 8.894	 	HA :: 4.687	 	HB2 :: 3.501	 	HB3 :: 2.773	
	Ave H Shift Values>> 	H :: 8.39(0.67) 	HA :: 4.66(0.55) 	HB2 :: 2.96(0.44) 	HB3 :: 2.89(0.46) 	HG :: 1.98(1.38)

	N Shift Assignments>> 	N :: 129.045	
	Ave N Shift Values>> 	N :: 120.17(4.64)



1.P41	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	P 0.75   C 0.24   

	C Shift Assignments>> 	C :: 177.615	 	CA :: 63.846	 	CB :: 32.547	 	CG :: 27.238	 	CD :: 51.485	
	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 :: 4.660	 	HB2 :: 2.046	 	HB3 :: 2.419	 	HG2 :: 2.182	 	HG3 :: 2.053	 	HD2 :: 4.425	
			 	HD3 :: 4.079	
	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.Q42	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	C 0.33   Q 0.3   E 0.24   K 0.11   

	C Shift Assignments>> 	C :: 174.820	 	CA :: 56.138	 	CB :: 30.716	 	CG :: 34.646	
	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 :: 9.643	 	HA :: 4.441	 	HB2 :: 1.645	 	HB3 :: 0.908(S)	 	HG2 :: 2.013	 	HG3 :: 1.890	
			 	HE21 :: 6.792	 	HE22 :: 7.289	
	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 :: 119.920	 	NE2 :: 110.815	
	Ave N Shift Values>> 	N :: 119.89(3.6) 	NE2 :: 111.87(1.72)



1.C43	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.2   E 0.18   R 0.14   H 0.14   Q 0.12   K 0.11   I 0.05   V 0.02   

	C Shift Assignments>> 	C :: 173.312	 	CA :: 58.667	 	CB :: 29.859	
	Ave C Shift Values>> 	C :: 174.95(2.07) 	CA :: 58.3(3.33) 	CB :: 32.49(6.01)

	H Shift Assignments>> 	H :: 7.969	 	HA :: 5.009	 	HB2 :: 3.439	 	HB3 :: 3.210	
	Ave H Shift Values>> 	H :: 8.39(0.67) 	HA :: 4.66(0.55) 	HB2 :: 2.96(0.44) 	HB3 :: 2.89(0.46) 	HG :: 1.98(1.38)

	N Shift Assignments>> 	N :: 120.976	
	Ave N Shift Values>> 	N :: 120.17(4.64)



1.S44	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.99   

	C Shift Assignments>> 	C :: 174.110	 	CA :: 59.583	 	CB :: 63.813	
	Ave C Shift Values>> 	C :: 174.62(1.72) 	CA :: 58.72(2.07) 	CB :: 63.8(1.48)

	H Shift Assignments>> 	H :: 8.028	 	HA :: 4.417	 	HB2 :: 4.101	 	HB3 :: 3.937	
	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 :: 110.964	
	Ave N Shift Values>> 	N :: 116.28(3.52)



1.Y45	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.7   C 0.29   

	C Shift Assignments>> 	C :: 173.205	 	CA :: 60.888	 	CB :: 39.570	 	CD1 :: 132.548	 	CD2 :: 132.548	 	CE1 :: 117.101	
			 	CE2 :: 117.101	
	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 :: 9.014	 	HA :: 3.960	 	HB2 :: 2.635	 	HB3 :: 2.026	 	HD1 :: 6.543	 	HD2 :: 6.543	
			 	HE1 :: 6.453	 	HE2 :: 6.453	
	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 :: 128.049	
	Ave N Shift Values>> 	N :: 120.52(4.2)



1.A46	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.45   A 0.32   C 0.17   K 0.03   

	C Shift Assignments>> 	C :: 174.972	 	CA :: 50.577	 	CB :: 23.083	
	Ave C Shift Values>> 	C :: 177.74(2.13) 	CA :: 53.14(1.98) 	CB :: 19.01(1.83)

	H Shift Assignments>> 	H :: 6.894	 	HA :: 4.888	 	HB1 :: 1.161	 	HB2 :: 1.161	 	HB3 :: 1.161	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.44) 	HB :: 1.35(0.26)

	N Shift Assignments>> 	N :: 128.047	
	Ave N Shift Values>> 	N :: 123.23(3.54)



1.S47	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.99   

	C Shift Assignments>> 	C :: 173.330	 	CA :: 56.436	 	CB :: 65.315	
	Ave C Shift Values>> 	C :: 174.62(1.72) 	CA :: 58.72(2.07) 	CB :: 63.8(1.48)

	H Shift Assignments>> 	H :: 8.676	 	HA :: 4.507	 	HB2 :: 3.987	 	HB3 :: 3.424	
	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 :: 111.597	
	Ave N Shift Values>> 	N :: 116.28(3.52)



1.A48	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.93   C 0.03   L 0.02   

	C Shift Assignments>> 	C :: 176.780	 	CA :: 53.247	 	CB :: 19.709	
	Ave C Shift Values>> 	C :: 177.74(2.13) 	CA :: 53.14(1.98) 	CB :: 19.01(1.83)

	H Shift Assignments>> 	H :: 8.907	 	HA :: 4.648	 	HB1 :: 1.607	 	HB2 :: 1.607	 	HB3 :: 1.607	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.44) 	HB :: 1.35(0.26)

	N Shift Assignments>> 	N :: 126.637	
	Ave N Shift Values>> 	N :: 123.23(3.54)



1.I49	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.59   C 0.4   

	C Shift Assignments>> 	C :: 176.613	 	CA :: 59.500	 	CB :: 39.722	 	CG1 :: 27.027	 	CG2 :: 18.128	 	CD1 :: 12.574	
	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 :: 8.534	 	HA :: 4.469	 	HB :: 1.907	 	HG12 :: 1.465	 	HG13 :: 1.187	 	HG21 :: 0.969	
			 	HG22 :: 0.969	 	HG23 :: 0.969	 	HD11 :: 0.876	 	HD12 :: 0.876	 	HD13 :: 0.876	
	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 :: 118.095	
	Ave N Shift Values>> 	N :: 121.46(4.28)



1.K50	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	C 0.49   K 0.41   R 0.08   

	C Shift Assignments>> 	C :: 178.518	 	CA :: 60.454	 	CB :: 31.420	 	CG :: 24.763	 	CD :: 29.125	 	CE :: 42.032	
	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 :: 7.230	 	HA :: 2.997	 	HB2 :: 1.434	 	HB3 :: 0.819(S)	 	HG2 :: 1.113	 	HG3 :: 0.884	
			 	HD2 :: 1.504	 	HD3 :: 1.432	 	HE2 :: 2.898	 	HE3 :: 2.898	
	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 :: 110.944	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



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

	PRTL>>	A 0.85   I 0.06   C 0.06   V 0.01   

	C Shift Assignments>> 	C :: 179.709	 	CA :: 55.147	 	CB :: 18.377	
	Ave C Shift Values>> 	C :: 177.74(2.13) 	CA :: 53.14(1.98) 	CB :: 19.01(1.83)

	H Shift Assignments>> 	H :: 8.675	 	HA :: 4.070	 	HB1 :: 1.383	 	HB2 :: 1.383	 	HB3 :: 1.383	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.44) 	HB :: 1.35(0.26)

	N Shift Assignments>> 	N :: 119.152	
	Ave N Shift Values>> 	N :: 123.23(3.54)



1.N52	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.24   E 0.24   N 0.19   Y 0.13   F 0.08   K 0.02   D 0.02   I 0.01   

	C Shift Assignments>> 	C :: 178.902	 	CA :: 55.179	 	CB :: 36.880	
	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 :: 7.070	 	HA :: 4.519	 	HB2 :: 3.303	 	HB3 :: 3.167	 	HD21 :: 6.905	 	HD22 :: 7.437	
	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 :: 114.734	 	ND2 :: 111.848	
	Ave N Shift Values>> 	N :: 118.93(4.03) 	ND2 :: 112.75(2.23)



1.L53	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.53   L 0.46   

	C Shift Assignments>> 	C :: 177.601	 	CA :: 57.956	 	CB :: 40.229	 	CG :: 27.411	 	CD1 :: 25.824	 	CD2 :: 22.995	
	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 :: 7.489	 	HA :: 4.396	 	HB2 :: 2.216	 	HB3 :: 1.543	 	HG :: 1.779	 	HD11 :: 1.023	
			 	HD12 :: 1.023	 	HD13 :: 1.023	 	HD21 :: 1.071	 	HD22 :: 1.071	 	HD23 :: 1.071	
	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 :: 122.848	
	Ave N Shift Values>> 	N :: 121.86(3.9)



1.N54	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.23   Y 0.22   E 0.17   F 0.16   N 0.07   I 0.06   D 0.02   L 0.01   K 0.01   

	C Shift Assignments>> 	C :: 178.004	 	CA :: 56.661	 	CB :: 37.553	
	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 :: 8.075	 	HA :: 4.398	 	HB2 :: 2.899	 	HB3 :: 2.805	 	HD21 :: 6.754	 	HD22 :: 7.577	
	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 :: 117.489	 	ND2 :: 110.780	
	Ave N Shift Values>> 	N :: 118.93(4.03) 	ND2 :: 112.75(2.23)



1.V55	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.92   C 0.07   

	C Shift Assignments>> 	C :: 178.360	 	CA :: 66.400	 	CB :: 32.203	 	CG1 :: 22.581	 	CG2 :: 21.244	
	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 :: 7.467	 	HA :: 3.607	 	HB :: 2.076	 	HG11 :: 1.099	 	HG12 :: 1.099	 	HG13 :: 1.099	
			 	HG21 :: 0.926	 	HG22 :: 0.926	 	HG23 :: 0.926	
	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 :: 118.710	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.H56	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.82   H 0.17   

	C Shift Assignments>> 	C :: 176.622	 	CA :: 60.129	 	CB :: 27.775	 	CD2 :: 126.435	 	CE1 :: 138.431	
	Ave C Shift Values>> 	C :: 175.25(1.97) 	CA :: 56.52(2.31) 	CB :: 30.24(2.07) 	CG :: 131.52(3.27) 	CD2 :: 120.49(3.42) 	CE1 :: 137.71(2.12)

	H Shift Assignments>> 	H :: 7.795	 	HA :: 3.819	 	HB2 :: 3.233	 	HB3 :: 2.466	 	HD2 :: 6.841	 	HE1 :: 7.559	
	Ave H Shift Values>> 	H :: 8.24(0.68) 	HA :: 4.61(0.43) 	HB2 :: 3.1(0.36) 	HB3 :: 3.04(0.38) 	HD1 :: 8.68(2.62) 	HD2 :: 7(0.43)
			 	HE1 :: 7.95(0.48) 	HE2 :: 9.64(2.6)

	N Shift Assignments>> 	N :: 121.284	
	Ave N Shift Values>> 	N :: 119.69(4) 	ND1 :: 195.02(18.51) 	NE2 :: 182.41(14.4)



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

	PRTL>>	L 0.49   C 0.4   R 0.09   G 0.01   

	C Shift Assignments>> 	C :: 179.363	 	CA :: 58.164	 	CB :: 42.330	 	CG :: 27.276	 	CD1 :: 25.562	 	CD2 :: 24.763	
	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 :: 8.560	 	HA :: 3.831	 	HB2 :: 1.921	 	HB3 :: 1.623	 	HG :: 2.063	 	HD11 :: 1.066	
			 	HD12 :: 1.066	 	HD13 :: 1.066	 	HD21 :: 1.229	 	HD22 :: 1.229	 	HD23 :: 1.229	
	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 :: 116.684	
	Ave N Shift Values>> 	N :: 121.86(3.9)



1.R58	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.43   R 0.43   G 0.1   K 0.02   

	C Shift Assignments>> 	C :: 178.289	 	CA :: 58.247	 	CB :: 29.870	 	CG :: 27.578	 	CD :: 43.685	
	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 :: 7.224	 	HA :: 4.080	 	HB2 :: 1.914	 	HB3 :: 1.796	 	HG2 :: 1.855	 	HG3 :: 1.674	
			 	HD2 :: 3.192	 	HD3 :: 3.192	
	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 :: 117.004	
	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.K59	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.43   C 0.42   R 0.13   

	C Shift Assignments>> 	C :: 177.807	 	CA :: 57.737	 	CB :: 31.536	 	CG :: 24.697	 	CD :: 29.133	 	CE :: 41.968	
	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 :: 7.873	 	HA :: 3.949	 	HB2 :: 1.355	 	HB3 :: 1.355	 	HG2 :: 1.140	 	HG3 :: 1.140	
			 	HD2 :: 1.380	 	HD3 :: 1.380	 	HE2 :: 2.839	 	HE3 :: 2.839	
	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 :: 117.778	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.H60	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.7   H 0.29   

	HN Overlap>>	 1.H88 1.H88

	C Shift Assignments>> 	C :: 175.572	 	CA :: 55.519	 	CB :: 28.728	 	CD2 :: 127.304	 	CE1 :: 139.601	
	Ave C Shift Values>> 	C :: 175.25(1.97) 	CA :: 56.52(2.31) 	CB :: 30.24(2.07) 	CG :: 131.52(3.27) 	CD2 :: 120.49(3.42) 	CE1 :: 137.71(2.12)

	H Shift Assignments>> 	H :: 7.249	 	HA :: 4.753	 	HB2 :: 3.263	 	HB3 :: 3.091	 	HD2 :: 6.613	 	HE1 :: 7.939	
	Ave H Shift Values>> 	H :: 8.24(0.68) 	HA :: 4.61(0.43) 	HB2 :: 3.1(0.36) 	HB3 :: 3.04(0.38) 	HD1 :: 8.68(2.62) 	HD2 :: 7(0.43)
			 	HE1 :: 7.95(0.48) 	HE2 :: 9.64(2.6)

	N Shift Assignments>> 	N :: 115.408	
	Ave N Shift Values>> 	N :: 119.69(4) 	ND1 :: 195.02(18.51) 	NE2 :: 182.41(14.4)



1.T61	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.92   C 0.07   

	C Shift Assignments>> 	C :: 175.192	 	CA :: 62.647	 	CB :: 69.710	 	CG2 :: 21.583	
	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 :: 7.794	 	HA :: 4.309	 	HB :: 4.261	 	HG21 :: 1.221	 	HG22 :: 1.221	 	HG23 :: 1.221	
	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 :: 113.477	
	Ave N Shift Values>> 	N :: 115.42(4.75)



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

	PRTL>>	G 0.83   L 0.09   C 0.02   R 0.01   

	C Shift Assignments>> 	C :: 173.748	 	CA :: 45.291	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	H :: 8.361	 	HA2 :: 3.926	 	HA3 :: 3.926	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)

	N Shift Assignments>> 	N :: 111.366	
	Ave N Shift Values>> 	N :: 109.67(3.87)



1.E63	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.46   C 0.38   Q 0.06   K 0.06   I 0.02   

	HN Overlap>>	 1.K8 1.K8

	C Shift Assignments>> 	C :: 175.125	 	CA :: 56.473	 	CB :: 30.451	 	CG :: 36.233	
	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 :: 8.039	 	HA :: 4.096	 	HB2 :: 1.826	 	HB3 :: 1.826	 	HG2 :: 2.107	 	HG3 :: 1.957	
	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 :: 121.136	
	Ave N Shift Values>> 	N :: 120.67(3.48)



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

	PRTL>>	K 0.53   C 0.37   R 0.07   

	C Shift Assignments>> 	C :: 175.297	 	CA :: 55.509	 	CB :: 34.260	 	CG :: 24.749	 	CD :: 29.115	 	CE :: 42.015	
	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 :: 7.857	 	HA :: 4.381	 	HB2 :: 1.570	 	HB3 :: 1.570	 	HG2 :: 1.292	 	HG3 :: 1.157	
			 	HD2 :: 1.515	 	HD3 :: 1.515	 	HE2 :: 2.858	 	HE3 :: 2.858	
	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 :: 120.474	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.F65	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.71   C 0.28   

	C Shift Assignments>> 	C :: 173.796	 	CA :: 57.675	 	CB :: 40.541	 	CD1 :: 131.469	 	CD2 :: 131.469	 	CE1 :: 131.473	
			 	CE2 :: 131.473	 	CZ :: 129.684	
	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 :: 8.551	 	HA :: 4.520	 	HB2 :: 2.861	 	HB3 :: 2.824	 	HD1 :: 7.053	 	HD2 :: 7.053	
			 	HE1 :: 7.283	 	HE2 :: 7.283	 	HZ :: 7.292	
	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 :: 121.410	
	Ave N Shift Values>> 	N :: 120.45(4.18)



1.A66	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.84   L 0.09   C 0.06   

	C Shift Assignments>> 	C :: 175.846	 	CA :: 50.675	 	CB :: 21.464	
	Ave C Shift Values>> 	C :: 177.74(2.13) 	CA :: 53.14(1.98) 	CB :: 19.01(1.83)

	H Shift Assignments>> 	H :: 8.573	 	HA :: 4.888	 	HB1 :: 1.356	 	HB2 :: 1.356	 	HB3 :: 1.356	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.44) 	HB :: 1.35(0.26)

	N Shift Assignments>> 	N :: 125.445	
	Ave N Shift Values>> 	N :: 123.23(3.54)



1.C67	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.3   V 0.15   E 0.11   R 0.1   I 0.09   H 0.08   Q 0.05   K 0.04   P 0.04   

	C Shift Assignments>> 	C :: 175.272	 	CA :: 60.601	 	CB :: 30.502	
	Ave C Shift Values>> 	C :: 174.95(2.07) 	CA :: 58.3(3.33) 	CB :: 32.49(6.01)

	H Shift Assignments>> 	H :: 8.400	 	HA :: 4.261	 	HB2 :: 3.458	 	HB3 :: 2.804	
	Ave H Shift Values>> 	H :: 8.39(0.67) 	HA :: 4.66(0.55) 	HB2 :: 2.96(0.44) 	HB3 :: 2.89(0.46) 	HG :: 1.98(1.38)

	N Shift Assignments>> 	N :: 125.196	
	Ave N Shift Values>> 	N :: 120.17(4.64)



1.D68	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	L 0.21   D 0.2   K 0.16   F 0.15   Y 0.12   C 0.07   N 0.03   R 0.01   I 0.01   

	C Shift Assignments>> 	C :: 176.637	 	CA :: 56.059	 	CB :: 41.191	
	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 :: 8.190	 	HA :: 4.423	 	HB2 :: 2.185	 	HB3 :: 1.579(S)	
	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 :: 125.720	
	Ave N Shift Values>> 	N :: 120.65(3.86)



1.Y69	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	Y 0.61   C 0.38   

	C Shift Assignments>> 	C :: 174.928	 	CA :: 57.797	 	CB :: 38.227	 	CD1 :: 132.921	 	CD2 :: 132.921	 	CE1 :: 118.173	
			 	CE2 :: 118.173	
	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 :: 9.832	 	HA :: 4.518	 	HB2 :: 2.650	 	HB3 :: 1.322(S)	 	HD1 :: 6.924	 	HD2 :: 6.924	
			 	HE1 :: 6.814	 	HE2 :: 6.814	
	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 :: 120.669	
	Ave N Shift Values>> 	N :: 120.52(4.2)



1.C70	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.21   E 0.18   R 0.15   H 0.14   Q 0.12   K 0.09   I 0.04   V 0.03   

	C Shift Assignments>> 	C :: 173.292	 	CA :: 58.673	 	CB :: 30.135	
	Ave C Shift Values>> 	C :: 174.95(2.07) 	CA :: 58.3(3.33) 	CB :: 32.49(6.01)

	H Shift Assignments>> 	H :: 7.997	 	HA :: 5.020	 	HB2 :: 3.487	 	HB3 :: 3.360	
	Ave H Shift Values>> 	H :: 8.39(0.67) 	HA :: 4.66(0.55) 	HB2 :: 2.96(0.44) 	HB3 :: 2.89(0.46) 	HG :: 1.98(1.38)

	N Shift Assignments>> 	N :: 119.762	
	Ave N Shift Values>> 	N :: 120.17(4.64)



1.S71	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.99   

	C Shift Assignments>> 	C :: 174.097	 	CA :: 59.646	 	CB :: 63.681	
	Ave C Shift Values>> 	C :: 174.62(1.72) 	CA :: 58.72(2.07) 	CB :: 63.8(1.48)

	H Shift Assignments>> 	H :: 8.137	 	HA :: 4.552	 	HB2 :: 4.151	 	HB3 :: 3.962	
	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 :: 111.551	
	Ave N Shift Values>> 	N :: 116.28(3.52)



1.F72	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.77   C 0.22   

	C Shift Assignments>> 	C :: 174.521	 	CA :: 60.543	 	CB :: 41.338	 	CD1 :: 131.271	 	CD2 :: 131.271	 	CE1 :: 130.450	
			 	CE2 :: 130.450	 	CZ :: 129.555	
	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 :: 9.215	 	HA :: 4.307	 	HB2 :: 3.026	 	HB3 :: 2.279	 	HD1 :: 6.676	 	HD2 :: 6.676	
			 	HE1 :: 7.204	 	HE2 :: 7.204	 	HZ :: 6.992	
	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 :: 127.943	
	Ave N Shift Values>> 	N :: 120.45(4.18)



1.T73	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.53   C 0.45   

	C Shift Assignments>> 	C :: 171.863	 	CA :: 59.215	 	CB :: 72.651	 	CG2 :: 21.451	
	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 :: 7.145	 	HA :: 4.981	 	HB :: 3.925	 	HG21 :: 1.131	 	HG22 :: 1.131	 	HG23 :: 1.131	
	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 :: 117.992	
	Ave N Shift Values>> 	N :: 115.42(4.75)



1.C74	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.19   H 0.19   E 0.18   C 0.16   Q 0.15   K 0.08   V 0.01   

	C Shift Assignments>> 	C :: 173.604	 	CA :: 56.723	 	CB :: 30.515	
	Ave C Shift Values>> 	C :: 174.95(2.07) 	CA :: 58.3(3.33) 	CB :: 32.49(6.01)

	H Shift Assignments>> 	H :: 8.657	 	HA :: 4.821	 	HB2 :: 3.218	 	HB3 :: 2.829	
	Ave H Shift Values>> 	H :: 8.39(0.67) 	HA :: 4.66(0.55) 	HB2 :: 2.96(0.44) 	HB3 :: 2.89(0.46) 	HG :: 1.98(1.38)

	N Shift Assignments>> 	N :: 113.715	
	Ave N Shift Values>> 	N :: 120.17(4.64)



1.L75	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.57   C 0.27   R 0.08   G 0.04   A 0.02   

	C Shift Assignments>> 	C :: 176.923	 	CA :: 55.465	 	CB :: 42.997	 	CG :: 27.149	 	CD1 :: 25.213	 	CD2 :: 23.172	
	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 :: 8.707	 	HA :: 4.821	 	HB2 :: 1.837	 	HB3 :: 1.711	 	HG :: 1.639	 	HD11 :: 0.911	
			 	HD12 :: 0.911	 	HD13 :: 0.911	 	HD21 :: 0.845	 	HD22 :: 0.845	 	HD23 :: 0.845	
	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 :: 117.127	
	Ave N Shift Values>> 	N :: 121.86(3.9)



1.S76	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.97   T 0.02   

	C Shift Assignments>> 	C :: 173.717	 	CA :: 56.665	 	CB :: 65.879	
	Ave C Shift Values>> 	C :: 174.62(1.72) 	CA :: 58.72(2.07) 	CB :: 63.8(1.48)

	H Shift Assignments>> 	H :: 7.578	 	HA :: 4.641	 	HB2 :: 3.900	 	HB3 :: 3.691	
	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 :: 112.129	
	Ave N Shift Values>> 	N :: 116.28(3.52)



1.K77	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.45   K 0.43   R 0.09   

	C Shift Assignments>> 	C :: 179.202	 	CA :: 59.114	 	CB :: 31.964	 	CG :: 25.120	 	CD :: 29.237	 	CE :: 42.065	
	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 :: 8.558	 	HA :: 3.235	 	HB2 :: 1.524	 	HB3 :: 1.428	 	HG2 :: 1.101	 	HG3 :: 1.101	
			 	HE2 :: 2.937	 	HE3 :: 2.937	
	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 :: 125.679	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.G78	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	G 0.86   C 0.06   L 0.05   

	C Shift Assignments>> 	C :: 176.722	 	CA :: 46.992	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	HA2 :: 3.853	 	HA3 :: 3.799	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)



1.H79	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.58   H 0.41   

	C Shift Assignments>> 	C :: 178.415	 	CA :: 58.352	 	CB :: 31.674	 	CD2 :: 117.418	 	CE1 :: 138.762	
	Ave C Shift Values>> 	C :: 175.25(1.97) 	CA :: 56.52(2.31) 	CB :: 30.24(2.07) 	CG :: 131.52(3.27) 	CD2 :: 120.49(3.42) 	CE1 :: 137.71(2.12)

	H Shift Assignments>> 	H :: 7.662	 	HA :: 4.543	 	HB2 :: 3.308	 	HB3 :: 3.308	 	HD2 :: 7.100	 	HE1 :: 7.816	
	Ave H Shift Values>> 	H :: 8.24(0.68) 	HA :: 4.61(0.43) 	HB2 :: 3.1(0.36) 	HB3 :: 3.04(0.38) 	HD1 :: 8.68(2.62) 	HD2 :: 7(0.43)
			 	HE1 :: 7.95(0.48) 	HE2 :: 9.64(2.6)

	N Shift Assignments>> 	N :: 121.227	
	Ave N Shift Values>> 	N :: 119.69(4) 	ND1 :: 195.02(18.51) 	NE2 :: 182.41(14.4)



1.L80	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.49   L 0.46   R 0.03   

	C Shift Assignments>> 	C :: 177.522	 	CA :: 58.123	 	CB :: 41.367	 	CG :: 26.802	 	CD1 :: 26.359	 	CD2 :: 22.392	
	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 :: 7.718	 	HA :: 4.361	 	HB2 :: 2.088	 	HB3 :: 1.385	 	HG :: 1.838	 	HD11 :: 1.022	
			 	HD12 :: 1.022	 	HD13 :: 1.022	 	HD21 :: 1.083	 	HD22 :: 1.083	 	HD23 :: 1.083	
	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 :: 123.600	
	Ave N Shift Values>> 	N :: 121.86(3.9)



1.K81	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.49   K 0.43   R 0.06   G 0.01   

	C Shift Assignments>> 	C :: 178.911	 	CA :: 60.138	 	CB :: 32.501	 	CG :: 24.831	 	CD :: 29.613	 	CE :: 42.215	
	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 :: 7.967	 	HA :: 4.004	 	HB2 :: 1.981	 	HB3 :: 1.981	 	HG2 :: 1.563	 	HG3 :: 1.403	
			 	HD2 :: 1.725	 	HD3 :: 1.677	 	HE2 :: 2.986	 	HE3 :: 2.986	
	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 :: 119.317	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.V82	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.9   C 0.09   

	C Shift Assignments>> 	C :: 177.533	 	CA :: 66.051	 	CB :: 31.959	 	CG1 :: 22.584	 	CG2 :: 21.050	
	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 :: 7.426	 	HA :: 3.793	 	HB :: 2.116	 	HG11 :: 1.095	 	HG12 :: 1.095	 	HG13 :: 1.095	
			 	HG21 :: 0.969	 	HG22 :: 0.969	 	HG23 :: 0.969	
	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 :: 117.712	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.H83	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.85   H 0.14   

	C Shift Assignments>> 	C :: 176.507	 	CA :: 59.949	 	CB :: 28.084	 	CD2 :: 127.235	 	CE1 :: 138.595	
	Ave C Shift Values>> 	C :: 175.25(1.97) 	CA :: 56.52(2.31) 	CB :: 30.24(2.07) 	CG :: 131.52(3.27) 	CD2 :: 120.49(3.42) 	CE1 :: 137.71(2.12)

	H Shift Assignments>> 	H :: 7.805	 	HA :: 4.052	 	HB2 :: 3.456	 	HB3 :: 2.595	 	HD2 :: 7.140	 	HE1 :: 7.495	
	Ave H Shift Values>> 	H :: 8.24(0.68) 	HA :: 4.61(0.43) 	HB2 :: 3.1(0.36) 	HB3 :: 3.04(0.38) 	HD1 :: 8.68(2.62) 	HD2 :: 7(0.43)
			 	HE1 :: 7.95(0.48) 	HE2 :: 9.64(2.6)

	N Shift Assignments>> 	N :: 119.162	
	Ave N Shift Values>> 	N :: 119.69(4) 	ND1 :: 195.02(18.51) 	NE2 :: 182.41(14.4)



1.I84	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.78   C 0.21   

	C Shift Assignments>> 	C :: 178.563	 	CA :: 66.762	 	CB :: 38.399	 	CG1 :: 31.113	 	CG2 :: 18.033	 	CD1 :: 14.433	
	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 :: 8.718	 	HA :: 3.477	 	HB :: 2.044	 	HG12 :: 2.320	 	HG13 :: 1.587	 	HG21 :: 1.083	
			 	HG22 :: 1.083	 	HG23 :: 1.083	 	HD11 :: 1.217	 	HD12 :: 1.217	 	HD13 :: 1.217	
	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 :: 118.862	
	Ave N Shift Values>> 	N :: 121.46(4.28)



1.E85	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.39   E 0.36   I 0.15   K 0.05   Q 0.02   

	C Shift Assignments>> 	C :: 178.082	 	CA :: 59.246	 	CB :: 29.735	 	CG :: 36.493	
	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 :: 7.942	 	HA :: 3.925	 	HB2 :: 2.134	 	HB3 :: 2.002	 	HG2 :: 2.440	 	HG3 :: 2.218	
	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 :: 118.254	
	Ave N Shift Values>> 	N :: 120.67(3.48)



1.R86	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.43   R 0.41   K 0.08   G 0.06   

	HN Overlap>>	 1.V87 1.V87

	C Shift Assignments>> 	C :: 178.108	 	CA :: 58.482	 	CB :: 31.113	 	CG :: 27.648	 	CD :: 43.357	
	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 :: 8.205	 	HA :: 4.079	 	HB2 :: 1.818	 	HB3 :: 1.723	 	HG2 :: 1.772	 	HG3 :: 1.560	
			 	HD2 :: 3.081	 	HD3 :: 3.081	
	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 :: 116.065	
	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.V87	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Suspicious 	N Shifts: Consistent

	PRTL>>	V 0.82   C 0.17   

	HN Overlap>>	 1.R86 1.R86

	C Shift Assignments>> 	C :: 176.420	 	CA :: 64.286	 	CB :: 32.314	 	CG1 :: 22.376	 	CG2 :: 20.999	
	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 :: 3.663	 	HB :: 0.712(S)	 	HG11 :: 0.501	 	HG12 :: 0.501	 	HG13 :: 0.501	
			 	HG21 :: 0.212	 	HG22 :: 0.212	 	HG23 :: 0.212	
	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 :: 116.065	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.H88	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.77   H 0.22   

	HN Overlap>>	 1.H60 1.H60

	C Shift Assignments>> 	C :: 174.464	 	CA :: 54.399	 	CB :: 28.350	 	CD2 :: 127.770	 	CE1 :: 140.052	
	Ave C Shift Values>> 	C :: 175.25(1.97) 	CA :: 56.52(2.31) 	CB :: 30.24(2.07) 	CG :: 131.52(3.27) 	CD2 :: 120.49(3.42) 	CE1 :: 137.71(2.12)

	H Shift Assignments>> 	H :: 7.160	 	HA :: 4.844	 	HB2 :: 3.018	 	HB3 :: 2.825	 	HD2 :: 6.643	 	HE1 :: 7.929	
	Ave H Shift Values>> 	H :: 8.24(0.68) 	HA :: 4.61(0.43) 	HB2 :: 3.1(0.36) 	HB3 :: 3.04(0.38) 	HD1 :: 8.68(2.62) 	HD2 :: 7(0.43)
			 	HE1 :: 7.95(0.48) 	HE2 :: 9.64(2.6)

	N Shift Assignments>> 	N :: 115.396	
	Ave N Shift Values>> 	N :: 119.69(4) 	ND1 :: 195.02(18.51) 	NE2 :: 182.41(14.4)



1.K89	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.42   C 0.37   R 0.18   

	C Shift Assignments>> 	C :: 176.065	 	CA :: 56.712	 	CB :: 31.561	 	CG :: 24.783	 	CD :: 29.068	 	CE :: 42.215	
	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 :: 7.393	 	HA :: 4.200	 	HB2 :: 1.851	 	HB3 :: 1.851	 	HG2 :: 1.331	 	HG3 :: 1.271	
			 	HD2 :: 1.624	 	HD3 :: 1.624	 	HE2 :: 2.931	 	HE3 :: 2.931	
	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 :: 118.288	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.K90	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.49   C 0.36   R 0.12   

	C Shift Assignments>> 	C :: 176.007	 	CA :: 55.763	 	CB :: 33.024	 	CG :: 24.584	 	CD :: 29.033	 	CE :: 42.215	
	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 :: 7.765	 	HA :: 4.343	 	HB2 :: 1.766	 	HB3 :: 1.611	 	HG2 :: 1.269	 	HG3 :: 1.269	
			 	HE2 :: 2.860	 	HE3 :: 2.860	
	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 :: 119.970	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.I91	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.67   C 0.32   

	C Shift Assignments>> 	C :: 175.304	 	CA :: 61.117	 	CB :: 38.692	 	CG1 :: 27.138	 	CG2 :: 17.574	 	CD1 :: 12.814	
	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 :: 8.125	 	HA :: 4.134	 	HB :: 1.834	 	HG12 :: 1.364	 	HG13 :: 1.111	 	HG21 :: 0.845	
			 	HG22 :: 0.845	 	HG23 :: 0.845	 	HD11 :: 0.772	 	HD12 :: 0.772	 	HD13 :: 0.772	
	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 :: 121.568	
	Ave N Shift Values>> 	N :: 121.46(4.28)



1.K92	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.45   C 0.45   R 0.07   G 0.01   

	C Shift Assignments>> 	C :: 180.861	 	CA :: 57.669	 	CB :: 33.856	 	CG :: 24.570	 	CD :: 29.237	 	CE :: 42.314	
	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 :: 7.856	 	HA :: 4.148	 	HB2 :: 1.786	 	HB3 :: 1.707	 	HG2 :: 1.374	 	HG3 :: 1.374	
			 	HD2 :: 1.665	 	HD3 :: 1.665	 	HE2 :: 2.971	 	HE3 :: 2.971	
	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 :: 129.415	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



2.ZN1 Overall Status: Residue type ZN not supported.





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

Overall Results:

	      #Consistent:  86      #Clerical:   0      #Suspicious:   6      #Anomalous:   0      #Mistyped:   0      #Indeterminable:   0


Typing Results:

	      #Consistent:  86      #Suspicious:   0      #Mistyped:   0      #Indeterminable:   6


Shift Relative Order (SRO) Results:

	      #Consistent:  91      #Suspicious:   1


C Shift Results:

	      #Consistent: 415      #Duplicate:   0      #Unknown:   0      #Suspicious:   0      #Anomalous:   0


H Shift Results:

	      #Consistent: 620      #Duplicate:   0      #Unknown:   0      #Suspicious:   5      #Anomalous:   0


N Shift Results:

	      #Consistent:  86      #Duplicate:   0      #Unknown:   0      #Suspicious:   0      #Anomalous:   0



Error Summary:

1.K22	SRO Rule Break>>  HA > HE2 : 0.99351606248158
1.Q42	HB3 = 0.908(S),	 Expected =  2.02, Std = 0.2800, ChiSquare = 7.1443e-05
1.K50	HB3 = 0.819(S),	 Expected =  1.74, Std = 0.2700, ChiSquare = 6.4699e-04
1.D68	HB3 = 1.579(S),	 Expected =  2.66, Std = 0.2800, ChiSquare = 1.1306e-04
1.Y69	HB3 = 1.322(S),	 Expected =  2.84, Std = 0.3900, ChiSquare = 9.9295e-05
1.V87	HB = 0.712(S),	 Expected =  1.98, Std = 0.3200, ChiSquare = 7.4169e-05