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


1.R1	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	R 0.45   C 0.33   K 0.15   G 0.05   

	C Shift Assignments>> 	CA :: 55.072	 	CB :: 30.804	 	CG :: 26.019	 	CD :: 43.109	
	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>> 	HA :: 4.058	 	HB2 :: 1.919	 	HG2 :: 1.660	 	HG3 :: 1.629	 	HD2 :: 3.188	
	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)



1.N2	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	N 0.58   D 0.17   C 0.1   Y 0.07   L 0.04   

	C Shift Assignments>> 	CA :: 53.148	 	CB :: 38.666	
	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 :: 8.989	 	HA :: 4.767	 	HB2 :: 2.846	 	HB3 :: 2.785	
	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 :: 122.641	
	Ave N Shift Values>> 	N :: 118.93(4.03) 	ND2 :: 112.75(2.23)



1.R3	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.5   C 0.37   K 0.07   G 0.04   

	C Shift Assignments>> 	CA :: 55.921	 	CB :: 30.804	 	CG :: 27.045	 	CD :: 43.109	
	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 :: 8.610	 	HA :: 4.346	 	HB2 :: 1.851	 	HB3 :: 1.730	 	HG2 :: 1.653	 	HD2 :: 3.184	
	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 :: 122.870	
	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.R4	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.49   C 0.38   K 0.07   G 0.04   

	C Shift Assignments>> 	CA :: 56.041	 	CB :: 30.804	 	CG :: 27.045	 	CD :: 43.109	
	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 :: 8.388	 	HA :: 4.273	 	HB2 :: 1.784	 	HB3 :: 1.740	 	HG2 :: 1.582	 	HG3 :: 1.544	
			 	HD2 :: 3.057	
	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 :: 122.870	
	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.R5	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.47   C 0.34   K 0.13   G 0.02   L 0.01   

	C Shift Assignments>> 	CA :: 55.759	 	CB :: 30.121	 	CG :: 26.703	 	CD :: 42.767	
	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 :: 8.116	 	HA :: 4.164	 	HB2 :: 1.378	 	HB3 :: 1.213	 	HG2 :: 1.290	 	HG3 :: 1.125	
			 	HD2 :: 2.918	
	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 :: 123.745	
	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.V6	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.66   V 0.33   

	C Shift Assignments>> 	CA :: 58.883	 	CB :: 35.248	 	CG1 :: 21.576	 	CG2 :: 21.908	
	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 :: 7.500	 	HA :: 4.801	 	HB :: 2.366	 	HG11 :: 0.812	 	HG12 :: 0.812	 	HG13 :: 0.812	
			 	HG21 :: 0.741	 	HG22 :: 0.741	 	HG23 :: 0.741	
	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 :: 115.114	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.C7	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.26   W 0.18   I 0.12   V 0.1   E 0.1   R 0.08   H 0.07   K 0.04   P 0.02   

	C Shift Assignments>> 	CA :: 60.665	 	CB :: 30.121	
	Ave C Shift Values>> 	C :: 174.95(2.07) 	CA :: 58.3(3.33) 	CB :: 32.49(6.01)

	H Shift Assignments>> 	H :: 8.629	 	HA :: 4.513	 	HB2 :: 2.808	
	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 :: 123.745	
	Ave N Shift Values>> 	N :: 120.17(4.64)



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

	PRTL>>	K 0.53   C 0.33   R 0.13   

	C Shift Assignments>> 	CA :: 54.504	 	CB :: 32.172	 	CG :: 23.968	 	CD :: 28.754	 	CE :: 41.742	
	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 :: 9.030	 	HA :: 4.666	 	HB2 :: 2.092	 	HB3 :: 1.649	 	HG2 :: 1.523	 	HG3 :: 1.469	
			 	HD2 :: 1.700	 	HE2 :: 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 :: 130.864	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.C9	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.34   C 0.22   W 0.12   R 0.07   K 0.06   E 0.05   P 0.05   H 0.04   L 0.01   V 0.01   

	C Shift Assignments>> 	CA :: 60.641	 	CB :: 28.070	
	Ave C Shift Values>> 	C :: 174.95(2.07) 	CA :: 58.3(3.33) 	CB :: 32.49(6.01)

	H Shift Assignments>> 	H :: 9.882	 	HA :: 4.201	 	HB2 :: 2.936	 	HB3 :: 2.452	
	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 :: 129.651	
	Ave N Shift Values>> 	N :: 120.17(4.64)



1.P10	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	P 0.79   C 0.2   

	C Shift Assignments>> 	CA :: 63.760	 	CB :: 31.583	 	CG :: 27.417	 	CD :: 50.219	
	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 :: 4.334	 	HB2 :: 2.328	 	HD2 :: 3.884	 	HD3 :: 3.717	
	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.R11	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.58   C 0.26   G 0.09   K 0.04   

	C Shift Assignments>> 	CA :: 53.050	 	CB :: 30.463	 	CG :: 26.703	 	CD :: 43.109	
	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 :: 7.944	 	HA :: 4.648	 	HB2 :: 1.803	 	HB3 :: 1.660	 	HG2 :: 1.603	 	HD2 :: 3.221	
	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 :: 119.370	
	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.P12	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	P 0.71   C 0.28   

	C Shift Assignments>> 	CA :: 62.915	 	CB :: 32.513	 	CG :: 27.386	 	CD :: 50.629	
	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 :: 4.474	 	HB2 :: 2.553	 	HB3 :: 1.780	 	HG2 :: 2.103	 	HG3 :: 1.997	 	HD2 :: 3.633	
			 	HD3 :: 3.589	
	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.V13	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.64   C 0.35   

	C Shift Assignments>> 	CA :: 61.990	 	CB :: 33.197	 	CG1 :: 20.892	 	CG2 :: 20.892	
	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 :: 8.227	 	HA :: 4.169	 	HB :: 1.972	 	HG11 :: 0.988	 	HG12 :: 0.988	 	HG13 :: 0.988	
			 	HG21 :: 0.906	 	HG22 :: 0.906	 	HG23 :: 0.906	
	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 :: 123.307	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.V14	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.61   C 0.38   

	C Shift Assignments>> 	CA :: 61.542	 	CB :: 33.197	 	CG1 :: 20.892	 	CG2 :: 20.780	
	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 :: 8.305	 	HA :: 4.244	 	HB :: 2.011	 	HG11 :: 0.905	 	HG12 :: 0.905	 	HG13 :: 0.905	
	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 :: 125.495	
	Ave N Shift Values>> 	N :: 121.14(4.54)



1.K15	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.49   C 0.4   R 0.1   

	C Shift Assignments>> 	CA :: 56.188	 	CB :: 33.001	 	CG :: 24.483	 	CD :: 29.046	 	CE :: 41.942	
	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 :: 8.712	 	HA :: 4.367	 	HB2 :: 1.845	 	HG2 :: 1.438	 	HD2 :: 1.702	 	HE2 :: 3.001	
	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 :: 127.026	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



1.S16	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.99   

	C Shift Assignments>> 	CA :: 58.259	 	CB :: 59.867	
	Ave C Shift Values>> 	C :: 174.62(1.72) 	CA :: 58.72(2.07) 	CB :: 63.8(1.48)

	H Shift Assignments>> 	H :: 8.482	 	HA :: 4.478	 	HB2 :: 3.906	 	HB3 :: 3.872	
	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 :: 118.932	
	Ave N Shift Values>> 	N :: 116.28(3.52)



1.G17	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.82   L 0.11   C 0.03   R 0.01   

	C Shift Assignments>> 	CA :: 45.198	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	H :: 8.489	 	HA2 :: 4.014	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)

	N Shift Assignments>> 	N :: 111.495	
	Ave N Shift Values>> 	N :: 109.67(3.87)



1.D18	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.37   L 0.21   N 0.17   Y 0.09   C 0.07   K 0.06   

	C Shift Assignments>> 	CA :: 54.260	 	CB :: 40.717	
	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 :: 8.308	 	HA :: 4.636	 	HB2 :: 2.721	 	HB3 :: 2.645	
	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 :: 120.901	
	Ave N Shift Values>> 	N :: 120.65(3.86)



1.K19	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.47   C 0.45   R 0.07   

	C Shift Assignments>> 	CA :: 57.425	 	CB :: 33.539	 	CG :: 24.310	 	CD :: 28.754	 	CE :: 41.742	
	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 :: 7.881	 	HA :: 4.192	 	HB2 :: 1.849	 	HB3 :: 1.737	 	HG2 :: 1.413	 	HD2 :: 1.690	
			 	HE2 :: 3.004	
	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 :: 125.932	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



2.S1	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Indeterminable 	N Shifts: Indeterminable




2.H2	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	H 0.2   K 0.18   C 0.17   W 0.13   R 0.12   E 0.09   L 0.07   

	C Shift Assignments>> 	CA :: 53.705	 	CB :: 28.754	
	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 :: 5.061	 	HB2 :: 3.298	 	HB3 :: 3.130	
	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)



2.P3	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	P 0.79   C 0.2   

	C Shift Assignments>> 	CA :: 63.805	 	CB :: 31.830	 	CG :: 27.386	 	CD :: 50.629	
	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 :: 4.389	 	HB2 :: 2.316	 	HB3 :: 1.942	 	HG2 :: 2.033	 	HD2 :: 3.773	 	HD3 :: 3.634	
	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)



2.E4	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.37   C 0.34   K 0.22   I 0.04   R 0.01   

	C Shift Assignments>> 	CA :: 56.946	 	CB :: 29.090	 	CG :: 35.404	
	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 :: 8.868	 	HA :: 4.199	 	HB2 :: 2.020	 	HG2 :: 2.323	
	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 :: 120.245	
	Ave N Shift Values>> 	N :: 120.67(3.48)



2.D5	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.36   L 0.21   N 0.17   Y 0.1   C 0.07   K 0.05   

	C Shift Assignments>> 	CA :: 54.444	 	CB :: 40.595	
	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 :: 8.174	 	HA :: 4.574	 	HB2 :: 2.637	
	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 :: 120.682	
	Ave N Shift Values>> 	N :: 120.65(3.86)



2.D6	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.35   N 0.2   L 0.19   Y 0.11   C 0.08   K 0.03   

	C Shift Assignments>> 	CA :: 54.481	 	CB :: 40.375	
	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 :: 8.162	 	HA :: 4.568	 	HB2 :: 2.674	
	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 :: 120.245	
	Ave N Shift Values>> 	N :: 120.65(3.86)



2.W7	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.18   W 0.16   E 0.16   C 0.15   H 0.14   R 0.12   I 0.04   L 0.01   

	C Shift Assignments>> 	CA :: 57.474	 	CB :: 29.095	
	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 :: 7.987	 	HA :: 4.621	 	HB2 :: 3.324	 	HB3 :: 3.256	 	HD1 :: 7.292	 	HE1 :: 10.205	
			 	HE3 :: 7.576	 	HZ2 :: 7.455	 	HZ3 :: 7.092	 	HH2 :: 7.172	
	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 :: 121.120	 	NE1 :: 129.989	
	Ave N Shift Values>> 	N :: 121.68(4.18) 	NE1 :: 129.32(2.11)



2.L8	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.68   C 0.28   R 0.02   G 0.01   

	C Shift Assignments>> 	CA :: 55.254	 	CB :: 42.084	 	CG :: 26.703	 	CD1 :: 24.994	 	CD2 :: 23.285	
	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 :: 7.776	 	HA :: 4.149	 	HB2 :: 1.497	 	HB3 :: 1.437	 	HG :: 1.260	 	HD11 :: 0.818	
			 	HD12 :: 0.818	 	HD13 :: 0.818	 	HD21 :: 0.698	 	HD22 :: 0.698	 	HD23 :: 0.698	
	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 :: 122.432	
	Ave N Shift Values>> 	N :: 121.86(3.9)



2.E9	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.43   C 0.35   K 0.17   I 0.02   

	C Shift Assignments>> 	CA :: 56.553	 	CB :: 29.779	 	CG :: 35.590	
	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 :: 7.964	 	HA :: 4.196	 	HB2 :: 2.050	 	HB3 :: 1.943	 	HG2 :: 2.316	
	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 :: 119.589	
	Ave N Shift Values>> 	N :: 120.67(3.48)



2.N10	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	N 0.56   D 0.17   C 0.1   Y 0.08   L 0.04   

	C Shift Assignments>> 	CA :: 53.264	 	CB :: 38.666	
	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 :: 8.309	 	HA :: 4.707	 	HB2 :: 2.843	 	HB3 :: 2.741	
	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 :: 118.495	
	Ave N Shift Values>> 	N :: 118.93(4.03) 	ND2 :: 112.75(2.23)



2.I11	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.96   I 0.03   

	C Shift Assignments>> 	CA :: 60.289	 	CB :: 39.349	 	CG1 :: 27.045	 	CG2 :: 21.566	 	CD1 :: 16.781	
	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 :: 7.697	 	HA :: 4.297	 	HB :: 1.864	 	HG12 :: 1.431	 	HG13 :: 1.195	 	HG21 :: 0.894	
			 	HG22 :: 0.894	 	HG23 :: 0.894	 	HD11 :: 0.829	 	HD12 :: 0.829	 	HD13 :: 0.829	
	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 :: 120.026	
	Ave N Shift Values>> 	N :: 121.46(4.28)



2.D12	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.32   L 0.28   K 0.15   N 0.07   Y 0.05   R 0.05   C 0.05   

	C Shift Assignments>> 	CA :: 53.999	 	CB :: 41.742	
	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 :: 8.572	 	HA :: 4.740	 	HB2 :: 2.670	
	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 :: 125.057	
	Ave N Shift Values>> 	N :: 120.65(3.86)



2.V13	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.55   C 0.44   

	HN Overlap>>	 2.Y19 2.Y19

	C Shift Assignments>> 	CA :: 60.854	 	CB :: 33.881	 	CG1 :: 20.892	 	CG2 :: 20.892	
	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 :: 8.274	 	HA :: 4.196	 	HB :: 1.753	 	HG11 :: 0.786	 	HG12 :: 0.786	 	HG13 :: 0.786	
			 	HG21 :: 0.677	 	HG22 :: 0.677	 	HG23 :: 0.677	
	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 :: 119.807	
	Ave N Shift Values>> 	N :: 121.14(4.54)



2.C14	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.27   K 0.15   V 0.14   W 0.13   R 0.11   H 0.09   E 0.08   

	C Shift Assignments>> 	CA :: 59.247	 	CB :: 32.172	
	Ave C Shift Values>> 	C :: 174.95(2.07) 	CA :: 58.3(3.33) 	CB :: 32.49(6.01)

	H Shift Assignments>> 	H :: 8.202	 	HA :: 4.432	 	HB2 :: 3.509	 	HB3 :: 3.153	
	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 :: 129.432	
	Ave N Shift Values>> 	N :: 120.17(4.64)



2.E15	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.41   C 0.37   K 0.15   I 0.04   

	C Shift Assignments>> 	CA :: 57.685	 	CB :: 29.779	 	CG :: 35.590	
	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 :: 9.429	 	HA :: 4.059	 	HB2 :: 2.095	 	HB3 :: 1.908	 	HG2 :: 2.374	
	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 :: 128.995	
	Ave N Shift Values>> 	N :: 120.67(3.48)



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

	PRTL>>	D 0.29   N 0.24   Y 0.17   L 0.14   C 0.11   I 0.01   

	C Shift Assignments>> 	CA :: 55.017	 	CB :: 39.691	
	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 :: 9.557	 	HA :: 4.655	 	HB2 :: 2.874	
	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 :: 120.245	
	Ave N Shift Values>> 	N :: 118.93(4.03) 	ND2 :: 112.75(2.23)



2.C17	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.2   R 0.16   W 0.15   K 0.14   H 0.13   E 0.13   V 0.05   

	C Shift Assignments>> 	CA :: 58.100	 	CB :: 31.488	
	Ave C Shift Values>> 	C :: 174.95(2.07) 	CA :: 58.3(3.33) 	CB :: 32.49(6.01)

	H Shift Assignments>> 	H :: 8.558	 	HA :: 4.570	 	HB2 :: 3.179	 	HB3 :: 2.642	
	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 :: 118.714	
	Ave N Shift Values>> 	N :: 120.17(4.64)



2.H18	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.33   L 0.31   C 0.15   R 0.1   I 0.02   W 0.02   H 0.02   

	C Shift Assignments>> 	CA :: 56.556	 	CB :: 25.336	
	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 :: 7.504	 	HA :: 4.368	 	HB2 :: 3.351	 	HB3 :: 3.219	 	HD2 :: 6.980	
	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 :: 113.901	
	Ave N Shift Values>> 	N :: 119.69(4) 	ND1 :: 195.02(18.51) 	NE2 :: 182.41(14.4)



2.Y19	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.24   N 0.24   Y 0.21   E 0.15   D 0.06   I 0.03   L 0.02   K 0.01   

	HN Overlap>>	 2.V13 2.V13

	C Shift Assignments>> 	CA :: 55.484	 	CB :: 37.640	
	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 :: 8.261	 	HA :: 5.223	 	HB2 :: 2.992	 	HB3 :: 2.920	 	HD1 :: 7.204	 	HE1 :: 6.836	
	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 :: 119.807	
	Ave N Shift Values>> 	N :: 120.52(4.2)



2.P20	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	P 0.7   C 0.29   

	C Shift Assignments>> 	CA :: 62.898	 	CB :: 32.721	 	CG :: 27.779	 	CD :: 50.643	
	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 :: 4.711	 	HB2 :: 2.205	 	HB3 :: 1.840	 	HG2 :: 2.191	 	HG3 :: 1.956	 	HD2 :: 4.195	
			 	HD3 :: 3.955	
	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)



2.I21	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.92   V 0.06   

	C Shift Assignments>> 	CA :: 61.011	 	CB :: 38.666	 	CG1 :: 28.070	 	CG2 :: 21.224	 	CD1 :: 18.490	
	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 :: 8.435	 	HA :: 4.248	 	HB :: 1.670	 	HG12 :: 1.695	 	HG13 :: 1.129	 	HG21 :: 0.859	
			 	HG22 :: 0.859	 	HG23 :: 0.859	 	HD11 :: 0.756	 	HD12 :: 0.756	 	HD13 :: 0.756	
	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 :: 123.526	
	Ave N Shift Values>> 	N :: 121.46(4.28)



2.V22	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.59   V 0.4   

	C Shift Assignments>> 	CA :: 59.078	 	CB :: 32.855	 	CG1 :: 20.892	
	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 :: 8.456	 	HA :: 4.525	 	HB :: 2.074	 	HG11 :: 0.960	 	HG12 :: 0.960	 	HG13 :: 0.960	
			 	HG21 :: 0.918	 	HG22 :: 0.918	 	HG23 :: 0.918	
	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 :: 126.807	
	Ave N Shift Values>> 	N :: 121.14(4.54)



2.P23	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	P 0.7   C 0.29   

	C Shift Assignments>> 	CA :: 62.811	 	CB :: 32.172	 	CG :: 27.386	 	CD :: 50.970	
	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 :: 4.437	 	HB2 :: 2.316	 	HG2 :: 2.022	 	HD2 :: 3.881	 	HD3 :: 3.698	
	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)



2.L24	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.68   C 0.28   R 0.01   G 0.01   

	C Shift Assignments>> 	CA :: 55.242	 	CB :: 42.084	 	CG :: 26.703	 	CD1 :: 24.652	 	CD2 :: 23.285	
	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 :: 8.412	 	HA :: 4.310	 	HB2 :: 1.627	 	HG :: 1.701	 	HD11 :: 0.948	 	HD12 :: 0.948	
			 	HD13 :: 0.948	 	HD21 :: 0.898	 	HD22 :: 0.898	 	HD23 :: 0.898	
	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 :: 123.089	
	Ave N Shift Values>> 	N :: 121.86(3.9)



2.D25	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.38   L 0.2   N 0.19   Y 0.08   C 0.06   K 0.05   

	C Shift Assignments>> 	CA :: 53.932	 	CB :: 40.717	
	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 :: 8.311	 	HA :: 4.614	 	HB2 :: 2.742	
	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 :: 120.464	
	Ave N Shift Values>> 	N :: 120.65(3.86)



2.G26	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.86   L 0.08   C 0.02   

	C Shift Assignments>> 	CA :: 45.408	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	H :: 8.296	 	HA2 :: 3.956	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)

	N Shift Assignments>> 	N :: 109.307	
	Ave N Shift Values>> 	N :: 109.67(3.87)



2.K27	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.48   C 0.4   R 0.1   

	C Shift Assignments>> 	CA :: 56.351	 	CB :: 32.855	 	CG :: 24.652	 	CD :: 28.754	 	CE :: 41.742	
	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 :: 8.219	 	HA :: 4.353	 	HB2 :: 1.877	 	HG2 :: 1.456	 	HD2 :: 1.706	 	HE2 :: 3.025	
	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 :: 121.120	
	Ave N Shift Values>> 	N :: 121.05(3.77) 	NZ :: 33.81(2.81)



2.G28	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.84   L 0.09   C 0.02   R 0.01   

	C Shift Assignments>> 	CA :: 45.289	
	Ave C Shift Values>> 	C :: 173.87(1.88) 	CA :: 45.35(1.34)

	H Shift Assignments>> 	H :: 8.505	 	HA2 :: 4.007	
	Ave H Shift Values>> 	H :: 8.33(0.65) 	HA2 :: 3.97(0.37) 	HA3 :: 3.9(0.37)

	N Shift Assignments>> 	N :: 110.401	
	Ave N Shift Values>> 	N :: 109.67(3.87)



2.T29	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.74   C 0.2   S 0.04   

	C Shift Assignments>> 	CA :: 62.878	 	CB :: 66.703	 	CG2 :: 21.918	
	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 :: 7.701	 	HA :: 4.200	 	HB :: 4.255	 	HG21 :: 1.162	 	HG22 :: 1.162	 	HG23 :: 1.162	
	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 :: 118.495	
	Ave N Shift Values>> 	N :: 115.42(4.75)



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





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

Overall Results:

	      #Consistent:  48      #Clerical:   0      #Suspicious:   0      #Anomalous:   0      #Mistyped:   0      #Indeterminable:   0


Typing Results:

	      #Consistent:  47      #Suspicious:   0      #Mistyped:   0      #Indeterminable:   1


Shift Relative Order (SRO) Results:

	      #Consistent:  48      #Suspicious:   0


C Shift Results:

	      #Consistent: 148      #Duplicate:   0      #Unknown:   0      #Suspicious:   0      #Anomalous:   0


H Shift Results:

	      #Consistent: 268      #Duplicate:   0      #Unknown:   0      #Suspicious:   0      #Anomalous:   0


N Shift Results:

	      #Consistent:  41      #Duplicate:   0      #Unknown:   0      #Suspicious:   0      #Anomalous:   0