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


1.A1	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	A 0.4   M 0.26   V 0.13   I 0.1   T 0.06   C 0.01   

	C Shift Assignments>> 	CB :: 19.3538	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	HA :: 4.6268	 	HB1 :: 1.5108	 	HB2 :: 1.5108	 	HB3 :: 1.5108	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)



1.D2	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.23   L 0.21   K 0.15   C 0.1   F 0.08   Y 0.07   N 0.06   R 0.05   

	C Shift Assignments>> 	C :: 172.776	 	CA :: 54.7208	 	CB :: 41.4108	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.6498	 	HA :: 4.6238	 	HB2 :: 2.6578	 	HB3 :: 2.5778	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 120.408	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.Q3	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Q 0.26   C 0.24   K 0.22   E 0.1   M 0.1   R 0.04   

	C Shift Assignments>> 	C :: 172.795	 	CA :: 55.5088	 	CB :: 29.6228	 	CG :: 33.7638	
	Ave C Shift Values>> 	C :: 176.39(1.96) 	CA :: 56.62(2.19) 	CB :: 29.1(1.97) 	CG :: 33.72(1.1) 	CD :: 179.68(1.17)

	H Shift Assignments>> 	H :: 8.3488	 	HA :: 4.3718	 	HB2 :: 2.0998	 	HB3 :: 1.9848	 	HG2 :: 2.3438	
	Ave H Shift Values>> 	H :: 8.22(0.62) 	HA :: 4.28(0.44) 	HB2 :: 2.05(0.28) 	HB3 :: 2.04(0.29) 	HG2 :: 2.32(0.29) 	HG3 :: 2.32(0.29)
			 	HE21 :: 7.17(0.46) 	HE22 :: 7.07(0.49)

	N Shift Assignments>> 	N :: 119.406	
	Ave N Shift Values>> 	N :: 119.92(4.01) 	NE2 :: 111.81(2.2)



1.L4	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.53   C 0.22   G 0.11   R 0.1   A 0.01   

	C Shift Assignments>> 	C :: 174.846	 	CA :: 54.4288	 	CB :: 43.4358	 	CG :: 26.7118	 	CD1 :: 26.5188	 	CD2 :: 23.6078	
	Ave C Shift Values>> 	C :: 176.97(2.09) 	CA :: 55.65(2.21) 	CB :: 42.37(1.86) 	CG :: 26.77(1.25) 	CD1 :: 24.73(1.71) 	CD2 :: 24.1(1.78)

	H Shift Assignments>> 	H :: 8.2758	 	HA :: 4.6658	 	HB2 :: 1.7198	 	HB3 :: 1.5088	 	HD11 :: 0.9218	 	HD12 :: 0.9218	
			 	HD13 :: 0.9218	 	HD21 :: 0.9138	 	HD22 :: 0.9138	 	HD23 :: 0.9138	
	Ave H Shift Values>> 	H :: 8.22(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.63(0.34) 	HB3 :: 1.57(0.36) 	HG :: 1.54(0.33) 	HD1 :: 0.77(0.27)
			 	HD2 :: 0.76(0.28)

	N Shift Assignments>> 	N :: 122.558	
	Ave N Shift Values>> 	N :: 121.98(4.07)



1.T5	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.99   

	C Shift Assignments>> 	C :: 172.634	 	CA :: 60.4938	 	CB :: 71.0398	
	Ave C Shift Values>> 	C :: 174.6(1.8) 	CA :: 62.15(2.72) 	CB :: 69.64(1.7) 	CG2 :: 21.44(1.39)

	H Shift Assignments>> 	H :: 8.6608	 	HA :: 4.4578	 	HB :: 4.7428	 	HG21 :: 1.3348	 	HG22 :: 1.3348	 	HG23 :: 1.3348	
	Ave H Shift Values>> 	H :: 8.27(0.62) 	HA :: 4.48(0.5) 	HB :: 4.17(0.37) 	HG1 :: 4.4(1.92) 	HG2 :: 1.16(0.28) 	HG21 :: 1.16(0.28)
			 	HG22 :: 1.16(0.28) 	HG23 :: 1.16(0.28)

	N Shift Assignments>> 	N :: 112.406	
	Ave N Shift Values>> 	N :: 115.7(5.05)



1.E6	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.33   I 0.31   E 0.27   K 0.05   Q 0.01   

	C Shift Assignments>> 	C :: 176.679	 	CA :: 60.1138	 	CB :: 28.8778	 	CG :: 36.4658	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 9.0168	 	HA :: 3.9888	 	HB2 :: 2.0698	 	HG2 :: 2.3698	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 120.053	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.E7	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.33   E 0.31   I 0.24   K 0.06   Q 0.01   M 0.01   

	C Shift Assignments>> 	C :: 176.396	 	CA :: 59.4768	 	CB :: 29.2168	 	CG :: 36.5738	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.6658	 	HA :: 4.0888	 	HB2 :: 2.1128	 	HB3 :: 1.9568	 	HG2 :: 2.3488	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 118.929	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.Q8	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.3   E 0.25   K 0.16   Q 0.15   I 0.08   M 0.03   R 0.01   

	HN Overlap>>	 1.K77 1.K77

	C Shift Assignments>> 	C :: 175.426	 	CA :: 59.2018	 	CB :: 29.2978	 	CG :: 34.9948	
	Ave C Shift Values>> 	C :: 176.39(1.96) 	CA :: 56.62(2.19) 	CB :: 29.1(1.97) 	CG :: 33.72(1.1) 	CD :: 179.68(1.17)

	H Shift Assignments>> 	H :: 7.7268	 	HA :: 4.0168	 	HB2 :: 2.0748	 	HB3 :: 1.9518	 	HG2 :: 2.3468	
	Ave H Shift Values>> 	H :: 8.22(0.62) 	HA :: 4.28(0.44) 	HB2 :: 2.05(0.28) 	HB3 :: 2.04(0.29) 	HG2 :: 2.32(0.29) 	HG3 :: 2.32(0.29)
			 	HE21 :: 7.17(0.46) 	HE22 :: 7.07(0.49)

	N Shift Assignments>> 	N :: 119.631	
	Ave N Shift Values>> 	N :: 119.92(4.01) 	NE2 :: 111.81(2.2)



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

	PRTL>>	I 0.92   C 0.07   

	C Shift Assignments>> 	C :: 174.972	 	CA :: 66.2438	 	CB :: 37.6528	 	CG1 :: 30.0558	 	CG2 :: 17.3308	
	Ave C Shift Values>> 	C :: 175.82(1.95) 	CA :: 61.59(2.78) 	CB :: 38.58(2.09) 	CG1 :: 27.65(2.32) 	CG2 :: 17.36(1.6) 	CD1 :: 13.41(1.91)

	H Shift Assignments>> 	H :: 8.3558	 	HA :: 3.6678	 	HB :: 1.9468	 	HG12 :: 1.7898	 	HG13 :: 1.1008	 	HG21 :: 1.1088	
			 	HG22 :: 1.1088	 	HG23 :: 1.1088	 	HD11 :: 0.8698	 	HD12 :: 0.8698	 	HD13 :: 0.8698	
	Ave H Shift Values>> 	H :: 8.26(0.71) 	HA :: 4.2(0.56) 	HB :: 1.8(0.31) 	HG2 :: 0.8(0.29) 	HG12 :: 1.3(0.4) 	HG13 :: 1.24(0.4)
			 	HD1 :: 0.7(0.3)

	N Shift Assignments>> 	N :: 119.286	
	Ave N Shift Values>> 	N :: 121.6(4.72)



1.A10	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	M 0.6   A 0.3   I 0.05   C 0.02   

	C Shift Assignments>> 	C :: 178.227	 	CA :: 55.3388	 	CB :: 17.7468	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 8.0378	 	HA :: 4.1148	 	HB1 :: 1.5208	 	HB2 :: 1.5208	 	HB3 :: 1.5208	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 120.740	
	Ave N Shift Values>> 	N :: 123.23(3.7)



1.E11	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.29   E 0.22   I 0.09   Y 0.08   V 0.06   M 0.06   K 0.06   Q 0.03   F 0.03   W 0.01   

	HN Overlap>>	 1.Q143 1.E114 1.Q143 1.E114

	C Shift Assignments>> 	C :: 177.704	 	CA :: 59.4538	 	CG :: 35.5888	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 7.8478	 	HA :: 4.1628	 	HB2 :: 2.0978	 	HB3 :: 2.0178	 	HG2 :: 2.0148	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 118.942	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.F12	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.72   Y 0.23   F 0.02   

	C Shift Assignments>> 	C :: 175.906	 	CA :: 58.9768	 	CB :: 37.4318	 	CD1 :: 128.343	 	CD2 :: 128.343	
	Ave C Shift Values>> 	C :: 175.49(2.13) 	CA :: 58.25(2.73) 	CB :: 39.95(2.04) 	CG :: 138.35(1.12) 	CD1 :: 131.38(1.38) 	CD2 :: 131.33(1.48)
			 	CE1 :: 130.48(1.29) 	CE2 :: 130.6(0.97) 	CZ :: 129.11(1.68)

	H Shift Assignments>> 	H :: 8.6068	 	HA :: 5.0048	 	HB2 :: 3.5338	 	HB3 :: 3.4618	 	HD1 :: 7.1668	 	HD2 :: 7.1668	
			 	HE1 :: 7.2128	 	HE2 :: 7.2128	 	HZ :: 6.7078	
	Ave H Shift Values>> 	H :: 8.42(0.74) 	HA :: 4.62(0.58) 	HB2 :: 2.99(0.37) 	HB3 :: 2.97(0.38) 	HD1 :: 6.91(0.82) 	HD2 :: 6.89(0.86)
			 	HE1 :: 6.95(0.82) 	HE2 :: 6.94(0.86) 	HZ :: 6.92(0.8)

	N Shift Assignments>> 	N :: 119.640	
	Ave N Shift Values>> 	N :: 120.69(4.18)



1.K13	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent


	C Shift Assignments>> 	C :: 176.515	
	Ave C Shift Values>> 	C :: 176.46(2.05) 	CA :: 56.84(2.25) 	CB :: 32.83(1.88) 	CG :: 24.91(1.31) 	CD :: 28.78(1.39) 	CE :: 41.78(0.98)

	H Shift Assignments>> 	H :: 9.2148	 	HA :: 4.0098	 	HB2 :: 1.9098	 	HG2 :: 0.6978	 	HD2 :: 1.2578	 	HD3 :: 1.1078	
			 	HE2 :: 2.5478	
	Ave H Shift Values>> 	H :: 8.22(0.64) 	HA :: 4.28(0.45) 	HB2 :: 1.79(0.25) 	HB3 :: 1.78(0.26) 	HG2 :: 1.38(0.27) 	HG3 :: 1.37(0.29)
			 	HD2 :: 1.61(0.25) 	HD3 :: 1.61(0.25) 	HE2 :: 2.93(0.2) 	HE3 :: 2.93(0.2) 	HZ :: 7.52(0.36)

	N Shift Assignments>> 	N :: 122.920	
	Ave N Shift Values>> 	N :: 121.16(4.11) 	NZ :: 71.86(52.41)



1.E14	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent


	C Shift Assignments>> 	C :: 176.562	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 7.7328	 	HA :: 3.8078	 	HB2 :: 1.8978	 	HG2 :: 2.0778	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 119.254	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.A15	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	M 0.55   A 0.35   I 0.03   C 0.03   V 0.01   

	C Shift Assignments>> 	C :: 176.200	 	CA :: 55.2968	 	CB :: 18.4428	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 8.0278	 	HA :: 4.2028	 	HB1 :: 1.9258	 	HB2 :: 1.9258	 	HB3 :: 1.9258	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 121.803	
	Ave N Shift Values>> 	N :: 123.23(3.7)



1.F16	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.39   F 0.37   C 0.22   

	C Shift Assignments>> 	C :: 174.515	 	CA :: 61.9028	 	CB :: 39.7248	 	CE1 :: 129.482	 	CE2 :: 129.482	
	Ave C Shift Values>> 	C :: 175.49(2.13) 	CA :: 58.25(2.73) 	CB :: 39.95(2.04) 	CG :: 138.35(1.12) 	CD1 :: 131.38(1.38) 	CD2 :: 131.33(1.48)
			 	CE1 :: 130.48(1.29) 	CE2 :: 130.6(0.97) 	CZ :: 129.11(1.68)

	H Shift Assignments>> 	H :: 8.7548	 	HA :: 3.2708	 	HB2 :: 2.9218	 	HD1 :: 6.5058	 	HD2 :: 6.5058	 	HE1 :: 6.9738	
			 	HE2 :: 6.9738	
	Ave H Shift Values>> 	H :: 8.42(0.74) 	HA :: 4.62(0.58) 	HB2 :: 2.99(0.37) 	HB3 :: 2.97(0.38) 	HD1 :: 6.91(0.82) 	HD2 :: 6.89(0.86)
			 	HE1 :: 6.95(0.82) 	HE2 :: 6.94(0.86) 	HZ :: 6.92(0.8)

	N Shift Assignments>> 	N :: 118.544	
	Ave N Shift Values>> 	N :: 120.69(4.18)



1.S17	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.99   

	C Shift Assignments>> 	C :: 172.086	 	CA :: 61.6608	 	CB :: 63.2668	
	Ave C Shift Values>> 	C :: 174.53(1.73) 	CA :: 58.57(2.12) 	CB :: 63.8(1.57)

	H Shift Assignments>> 	H :: 8.0948	 	HA :: 4.1188	 	HB2 :: 4.1028	
	Ave H Shift Values>> 	H :: 8.29(0.62) 	HA :: 4.51(0.43) 	HB2 :: 3.88(0.29) 	HB3 :: 3.87(0.31) 	HG :: 5.33(1.16)

	N Shift Assignments>> 	N :: 112.660	
	Ave N Shift Values>> 	N :: 116.3(3.95)



1.L18	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.2   D 0.19   L 0.17   F 0.13   Y 0.08   C 0.08   I 0.05   R 0.03   N 0.03   

	C Shift Assignments>> 	C :: 174.982	 	CB :: 41.4138	
	Ave C Shift Values>> 	C :: 176.97(2.09) 	CA :: 55.65(2.21) 	CB :: 42.37(1.86) 	CG :: 26.77(1.25) 	CD1 :: 24.73(1.71) 	CD2 :: 24.1(1.78)

	H Shift Assignments>> 	H :: 7.4048	 	HA :: 3.9878	 	HB2 :: 1.6978	 	HB3 :: 1.4898	 	HG :: 1.3278	 	HD11 :: 0.6838	
			 	HD12 :: 0.6838	 	HD13 :: 0.6838	 	HD21 :: 0.8008	 	HD22 :: 0.8008	 	HD23 :: 0.8008	
	Ave H Shift Values>> 	H :: 8.22(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.63(0.34) 	HB3 :: 1.57(0.36) 	HG :: 1.54(0.33) 	HD1 :: 0.77(0.27)
			 	HD2 :: 0.76(0.28)

	N Shift Assignments>> 	N :: 120.184	
	Ave N Shift Values>> 	N :: 121.98(4.07)



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

	PRTL>>	Y 0.78   F 0.18   G 0.02   

	C Shift Assignments>> 	C :: 173.816	 	CB :: 41.4328	 	CD1 :: 128.595	 	CD2 :: 128.595	
	Ave C Shift Values>> 	C :: 175.49(2.13) 	CA :: 58.25(2.73) 	CB :: 39.95(2.04) 	CG :: 138.35(1.12) 	CD1 :: 131.38(1.38) 	CD2 :: 131.33(1.48)
			 	CE1 :: 130.48(1.29) 	CE2 :: 130.6(0.97) 	CZ :: 129.11(1.68)

	H Shift Assignments>> 	H :: 7.0848	 	HA :: 3.8578	 	HB2 :: 2.631	 	HD1 :: 7.3118	 	HD2 :: 7.3118	 	HE1 :: 7.2768	
			 	HE2 :: 7.2768	
	Ave H Shift Values>> 	H :: 8.42(0.74) 	HA :: 4.62(0.58) 	HB2 :: 2.99(0.37) 	HB3 :: 2.97(0.38) 	HD1 :: 6.91(0.82) 	HD2 :: 6.89(0.86)
			 	HE1 :: 6.95(0.82) 	HE2 :: 6.94(0.86) 	HZ :: 6.92(0.8)

	N Shift Assignments>> 	N :: 114.926	
	Ave N Shift Values>> 	N :: 120.69(4.18)



1.D20	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.22   N 0.19   I 0.19   F 0.15   C 0.11   D 0.07   L 0.01   E 0.01   

	C Shift Assignments>> 	C :: 174.355	 	CB :: 39.0518	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 7.7588	 	HA :: 4.5518	 	HB2 :: 2.4478	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 116.333	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.K21	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.37   C 0.37   R 0.22   M 0.01   

	C Shift Assignments>> 	C :: 175.352	 	CA :: 58.4158	 	CB :: 32.6218	 	CG :: 24.1018	 	CD :: 28.1138	 	CE :: 41.9438	
	Ave C Shift Values>> 	C :: 176.46(2.05) 	CA :: 56.84(2.25) 	CB :: 32.83(1.88) 	CG :: 24.91(1.31) 	CD :: 28.78(1.39) 	CE :: 41.78(0.98)

	H Shift Assignments>> 	H :: 7.6578	 	HA :: 3.9788	 	HB2 :: 1.8628	 	HG2 :: 1.5388	 	HD2 :: 1.8878	 	HE2 :: 2.9678	
	Ave H Shift Values>> 	H :: 8.22(0.64) 	HA :: 4.28(0.45) 	HB2 :: 1.79(0.25) 	HB3 :: 1.78(0.26) 	HG2 :: 1.38(0.27) 	HG3 :: 1.37(0.29)
			 	HD2 :: 1.61(0.25) 	HD3 :: 1.61(0.25) 	HE2 :: 2.93(0.2) 	HE3 :: 2.93(0.2) 	HZ :: 7.52(0.36)

	N Shift Assignments>> 	N :: 123.905	
	Ave N Shift Values>> 	N :: 121.16(4.11) 	NZ :: 71.86(52.41)



1.D22	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	N 0.35   D 0.27   C 0.13   L 0.07   Y 0.06   F 0.06   K 0.01   

	C Shift Assignments>> 	C :: 174.872	 	CA :: 52.9928	 	CB :: 39.6798	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.1708	 	HA :: 4.5878	 	HB2 :: 2.7078	 	HB3 :: 2.2978	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 113.617	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.G23	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.68   C 0.22   L 0.03   A 0.02   P 0.02   

	C Shift Assignments>> 	C :: 172.439	 	CA :: 47.3378	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 7.7238	 	HA2 :: 3.8868	 	HA3 :: 3.8808	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 108.896	
	Ave N Shift Values>> 	N :: 109.91(4.29)



1.D24	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.31   N 0.19   L 0.13   C 0.12   F 0.08   Y 0.07   K 0.05   

	C Shift Assignments>> 	C :: 174.627	 	CA :: 53.8208	 	CB :: 40.4658	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.4838	 	HA :: 4.4938	 	HB2 :: 3.0608	 	HB3 :: 2.4508	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 120.446	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.G25	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.76   L 0.09   C 0.08   R 0.04   

	C Shift Assignments>> 	C :: 170.854	 	CA :: 45.2538	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 10.6268	 	HA2 :: 4.3938	 	HA3 :: 3.7288	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 112.712	
	Ave N Shift Values>> 	N :: 109.91(4.29)



1.T26	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.98   V 0.01   

	C Shift Assignments>> 	C :: 170.112	 	CB :: 72.5468	 	CG2 :: 21.7198	
	Ave C Shift Values>> 	C :: 174.6(1.8) 	CA :: 62.15(2.72) 	CB :: 69.64(1.7) 	CG2 :: 21.44(1.39)

	H Shift Assignments>> 	H :: 8.2408	 	HA :: 5.4288	 	HB :: 3.8598	 	HG21 :: 1.0698	 	HG22 :: 1.0698	 	HG23 :: 1.0698	
	Ave H Shift Values>> 	H :: 8.27(0.62) 	HA :: 4.48(0.5) 	HB :: 4.17(0.37) 	HG1 :: 4.4(1.92) 	HG2 :: 1.16(0.28) 	HG21 :: 1.16(0.28)
			 	HG22 :: 1.16(0.28) 	HG23 :: 1.16(0.28)

	N Shift Assignments>> 	N :: 111.977	
	Ave N Shift Values>> 	N :: 115.7(5.05)



1.I27	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent


	C Shift Assignments>> 	C :: 173.259	
	Ave C Shift Values>> 	C :: 175.82(1.95) 	CA :: 61.59(2.78) 	CB :: 38.58(2.09) 	CG1 :: 27.65(2.32) 	CG2 :: 17.36(1.6) 	CD1 :: 13.41(1.91)

	H Shift Assignments>> 	H :: 9.9298	 	HA :: 4.8338	 	HB :: 1.8038	 	HG12 :: 1.2588	 	HG13 :: 0.9878	 	HG21 :: 0.3518	
			 	HG22 :: 0.3518	 	HG23 :: 0.3518	
	Ave H Shift Values>> 	H :: 8.26(0.71) 	HA :: 4.2(0.56) 	HB :: 1.8(0.31) 	HG2 :: 0.8(0.29) 	HG12 :: 1.3(0.4) 	HG13 :: 1.24(0.4)
			 	HD1 :: 0.7(0.3)

	N Shift Assignments>> 	N :: 126.544	
	Ave N Shift Values>> 	N :: 121.6(4.72)



1.T28	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.99   

	C Shift Assignments>> 	C :: 173.729	 	CA :: 59.1738	 	CB :: 72.1978	
	Ave C Shift Values>> 	C :: 174.6(1.8) 	CA :: 62.15(2.72) 	CB :: 69.64(1.7) 	CG2 :: 21.44(1.39)

	H Shift Assignments>> 	H :: 8.3888	 	HA :: 4.8678	 	HB :: 4.8228	 	HG21 :: 1.2978	 	HG22 :: 1.2978	 	HG23 :: 1.2978	
	Ave H Shift Values>> 	H :: 8.27(0.62) 	HA :: 4.48(0.5) 	HB :: 4.17(0.37) 	HG1 :: 4.4(1.92) 	HG2 :: 1.16(0.28) 	HG21 :: 1.16(0.28)
			 	HG22 :: 1.16(0.28) 	HG23 :: 1.16(0.28)

	N Shift Assignments>> 	N :: 115.935	
	Ave N Shift Values>> 	N :: 115.7(5.05)



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

	PRTL>>	T 0.94   C 0.05   

	C Shift Assignments>> 	C :: 174.376	 	CA :: 66.4158	 	CB :: 68.1808	 	CG2 :: 23.4908	
	Ave C Shift Values>> 	C :: 174.6(1.8) 	CA :: 62.15(2.72) 	CB :: 69.64(1.7) 	CG2 :: 21.44(1.39)

	H Shift Assignments>> 	H :: 9.1708	 	HA :: 3.7388	 	HB :: 4.1838	 	HG21 :: 1.1998	 	HG22 :: 1.1998	 	HG23 :: 1.1998	
	Ave H Shift Values>> 	H :: 8.27(0.62) 	HA :: 4.48(0.5) 	HB :: 4.17(0.37) 	HG1 :: 4.4(1.92) 	HG2 :: 1.16(0.28) 	HG21 :: 1.16(0.28)
			 	HG22 :: 1.16(0.28) 	HG23 :: 1.16(0.28)

	N Shift Assignments>> 	N :: 112.731	
	Ave N Shift Values>> 	N :: 115.7(5.05)



1.K30	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.42   C 0.37   R 0.17   M 0.02   

	C Shift Assignments>> 	C :: 177.096	 	CA :: 59.2648	 	CB :: 32.4218	 	CG :: 24.6968	 	CD :: 28.9608	 	CE :: 41.8798	
	Ave C Shift Values>> 	C :: 176.46(2.05) 	CA :: 56.84(2.25) 	CB :: 32.83(1.88) 	CG :: 24.91(1.31) 	CD :: 28.78(1.39) 	CE :: 41.78(0.98)

	H Shift Assignments>> 	H :: 7.6038	 	HA :: 4.1078	 	HB2 :: 1.8228	 	HG2 :: 1.4218	 	HD2 :: 1.6858	 	HE2 :: 2.9798	
	Ave H Shift Values>> 	H :: 8.22(0.64) 	HA :: 4.28(0.45) 	HB2 :: 1.79(0.25) 	HB3 :: 1.78(0.26) 	HG2 :: 1.38(0.27) 	HG3 :: 1.37(0.29)
			 	HD2 :: 1.61(0.25) 	HD3 :: 1.61(0.25) 	HE2 :: 2.93(0.2) 	HE3 :: 2.93(0.2) 	HZ :: 7.52(0.36)

	N Shift Assignments>> 	N :: 120.172	
	Ave N Shift Values>> 	N :: 121.16(4.11) 	NZ :: 71.86(52.41)



1.E31	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.26   F 0.23   I 0.23   C 0.2   E 0.03   L 0.01   

	C Shift Assignments>> 	C :: 176.336	 	CA :: 59.5238	 	CG :: 38.8128	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 7.7168	 	HA :: 4.1198	 	HB2 :: 2.7148	 	HG2 :: 2.4038	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 121.065	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.L32	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.59   C 0.32   R 0.05   G 0.02   

	C Shift Assignments>> 	C :: 176.129	 	CA :: 57.7408	 	CB :: 42.2968	 	CG :: 25.9618	 	CD1 :: 25.8618	 	CD2 :: 23.5738	
	Ave C Shift Values>> 	C :: 176.97(2.09) 	CA :: 55.65(2.21) 	CB :: 42.37(1.86) 	CG :: 26.77(1.25) 	CD1 :: 24.73(1.71) 	CD2 :: 24.1(1.78)

	H Shift Assignments>> 	H :: 8.6388	 	HA :: 4.0978	 	HB2 :: 1.8158	 	HB3 :: 1.3948	 	HG :: 0.5868	 	HD11 :: 0.6208	
			 	HD12 :: 0.6208	 	HD13 :: 0.6208	 	HD21 :: 0.6018	 	HD22 :: 0.6018	 	HD23 :: 0.6018	
	Ave H Shift Values>> 	H :: 8.22(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.63(0.34) 	HB3 :: 1.57(0.36) 	HG :: 1.54(0.33) 	HD1 :: 0.77(0.27)
			 	HD2 :: 0.76(0.28)

	N Shift Assignments>> 	N :: 119.776	
	Ave N Shift Values>> 	N :: 121.98(4.07)



1.G33	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	P 0.3   G 0.25   C 0.23   A 0.1   N 0.04   D 0.01   L 0.01   

	C Shift Assignments>> 	C :: 172.329	 	CA :: 48.2338	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 8.7038	 	HA2 :: 3.9738	 	HA3 :: 3.5418	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 105.213	
	Ave N Shift Values>> 	N :: 109.91(4.29)



1.T34	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.99   

	C Shift Assignments>> 	CA :: 66.7648	 	CB :: 68.6728	
	Ave C Shift Values>> 	C :: 174.6(1.8) 	CA :: 62.15(2.72) 	CB :: 69.64(1.7) 	CG2 :: 21.44(1.39)

	H Shift Assignments>> 	H :: 7.9948	 	HA :: 3.9408	 	HB :: 4.3668	 	HG21 :: 1.2878	 	HG22 :: 1.2878	 	HG23 :: 1.2878	
	Ave H Shift Values>> 	H :: 8.27(0.62) 	HA :: 4.48(0.5) 	HB :: 4.17(0.37) 	HG1 :: 4.4(1.92) 	HG2 :: 1.16(0.28) 	HG21 :: 1.16(0.28)
			 	HG22 :: 1.16(0.28) 	HG23 :: 1.16(0.28)

	N Shift Assignments>> 	N :: 117.782	
	Ave N Shift Values>> 	N :: 115.7(5.05)



1.V35	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.91   C 0.04   I 0.03   

	C Shift Assignments>> 	C :: 176.416	 	CA :: 66.5858	 	CB :: 31.4628	 	CG2 :: 20.5538	
	Ave C Shift Values>> 	C :: 175.69(2.03) 	CA :: 62.48(3.04) 	CB :: 32.66(1.91) 	CG1 :: 21.38(1.53) 	CG2 :: 21.31(1.76)

	H Shift Assignments>> 	H :: 7.8458	 	HA :: 3.6148	 	HB :: 2.0888	 	HG11 :: 0.8688	 	HG12 :: 0.8688	 	HG13 :: 0.8688	
			 	HG21 :: 0.5318	 	HG22 :: 0.5318	 	HG23 :: 0.5318	
	Ave H Shift Values>> 	H :: 8.29(0.71) 	HA :: 4.16(0.57) 	HB :: 1.99(0.33) 	HG1 :: 0.84(0.27) 	HG2 :: 0.83(0.29)

	N Shift Assignments>> 	N :: 121.773	
	Ave N Shift Values>> 	N :: 121.02(4.96)



1.M36	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.51   M 0.34   I 0.06   V 0.06   

	C Shift Assignments>> 	C :: 176.427	 	CA :: 59.0398	 	CG :: 32.9598	 	CE :: 17.4538	
	Ave C Shift Values>> 	C :: 176.3(2.13) 	CA :: 56.16(2.34) 	CB :: 32.9(2.23) 	CG :: 32.07(1.45) 	CE :: 17.21(3.42)

	H Shift Assignments>> 	H :: 8.6078	 	HA :: 4.1078	 	HB2 :: 1.6478	 	HG2 :: 2.4908	 	HE1 :: 1.8768	 	HE2 :: 1.8768	
			 	HE3 :: 1.8768	
	Ave H Shift Values>> 	H :: 8.26(0.6) 	HA :: 4.39(0.46) 	HB2 :: 2.03(0.38) 	HB3 :: 2.01(0.36) 	HG2 :: 2.44(0.36) 	HG3 :: 2.41(0.4)
			 	HE :: 1.86(0.47)

	N Shift Assignments>> 	N :: 117.819	
	Ave N Shift Values>> 	N :: 120.1(3.88)



1.R37	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.44   R 0.36   G 0.1   K 0.08   

	C Shift Assignments>> 	C :: 178.461	 	CA :: 59.2508	 	CB :: 29.5288	 	CG :: 29.3938	 	CD :: 43.3388	
	Ave C Shift Values>> 	C :: 176.49(2.16) 	CA :: 56.95(2.41) 	CB :: 30.66(1.77) 	CG :: 27.31(1.65) 	CD :: 43.1(1.1) 	CZ :: 159.01(0.87)

	H Shift Assignments>> 	H :: 8.5168	 	HA :: 4.7788	 	HB2 :: 1.9028	 	HG2 :: 1.8178	 	HD2 :: 3.2908	 	HD3 :: 3.1358	
	Ave H Shift Values>> 	H :: 8.24(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.79(0.28) 	HB3 :: 1.78(0.28) 	HG2 :: 1.58(0.27) 	HG3 :: 1.58(0.27)
			 	HD2 :: 3.13(0.23) 	HD3 :: 3.13(0.22) 	HE :: 7.32(0.52) 	HH11 :: 6.74(0.31) 	HH12 :: 6.75(0.32) 	HH21 :: 6.72(0.32)
			 	HH22 :: 6.72(0.33)

	N Shift Assignments>> 	N :: 118.513	
	Ave N Shift Values>> 	N :: 120.61(3.9) 	NE :: 89.8(12.83) 	NH1 :: 74.78(11.38) 	NH2 :: 75.84(11.44)



1.S38	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.99   

	C Shift Assignments>> 	C :: 172.053	 	CA :: 61.2398	 	CB :: 63.1948	
	Ave C Shift Values>> 	C :: 174.53(1.73) 	CA :: 58.57(2.12) 	CB :: 63.8(1.57)

	H Shift Assignments>> 	H :: 7.9658	 	HA :: 4.4128	 	HB2 :: 4.0548	
	Ave H Shift Values>> 	H :: 8.29(0.62) 	HA :: 4.51(0.43) 	HB2 :: 3.88(0.29) 	HB3 :: 3.87(0.31) 	HG :: 5.33(1.16)

	N Shift Assignments>> 	N :: 118.269	
	Ave N Shift Values>> 	N :: 116.3(3.95)



1.L39	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.61   C 0.25   A 0.09   R 0.02   G 0.01   

	C Shift Assignments>> 	C :: 174.161	 	CA :: 54.5358	 	CB :: 42.0178	 	CG :: 25.9148	 	CD1 :: 25.6788	 	CD2 :: 22.4138	
	Ave C Shift Values>> 	C :: 176.97(2.09) 	CA :: 55.65(2.21) 	CB :: 42.37(1.86) 	CG :: 26.77(1.25) 	CD1 :: 24.73(1.71) 	CD2 :: 24.1(1.78)

	H Shift Assignments>> 	H :: 7.4338	 	HA :: 4.4918	 	HB2 :: 1.8358	 	HG :: 0.8018	 	HD11 :: 0.8268	 	HD12 :: 0.8268	
			 	HD13 :: 0.8268	 	HD21 :: 0.8108	 	HD22 :: 0.8108	 	HD23 :: 0.8108	
	Ave H Shift Values>> 	H :: 8.22(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.63(0.34) 	HB3 :: 1.57(0.36) 	HG :: 1.54(0.33) 	HD1 :: 0.77(0.27)
			 	HD2 :: 0.76(0.28)

	N Shift Assignments>> 	N :: 120.296	
	Ave N Shift Values>> 	N :: 121.98(4.07)



1.G40	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.79   L 0.08   C 0.08   R 0.02   

	C Shift Assignments>> 	C :: 171.564	 	CA :: 45.4398	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 7.8938	 	HA2 :: 4.2518	 	HA3 :: 3.7918	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 106.425	
	Ave N Shift Values>> 	N :: 109.91(4.29)



1.Q41	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	M 0.25   C 0.25   Q 0.24   K 0.14   E 0.07   R 0.01   

	C Shift Assignments>> 	C :: 171.332	 	CA :: 54.4658	 	CB :: 30.6968	 	CG :: 33.5098	
	Ave C Shift Values>> 	C :: 176.39(1.96) 	CA :: 56.62(2.19) 	CB :: 29.1(1.97) 	CG :: 33.72(1.1) 	CD :: 179.68(1.17)

	H Shift Assignments>> 	H :: 7.7978	 	HA :: 4.4858	 	HB2 :: 1.6168	 	HG2 :: 2.1668	 	HG3 :: 2.1138	 	HE21 :: 7.4098	
			 	HE22 :: 6.7788	
	Ave H Shift Values>> 	H :: 8.22(0.62) 	HA :: 4.28(0.44) 	HB2 :: 2.05(0.28) 	HB3 :: 2.04(0.29) 	HG2 :: 2.32(0.29) 	HG3 :: 2.32(0.29)
			 	HE21 :: 7.17(0.46) 	HE22 :: 7.07(0.49)

	N Shift Assignments>> 	N :: 117.557	 	NE2 :: 110.556	
	Ave N Shift Values>> 	N :: 119.92(4.01) 	NE2 :: 111.81(2.2)



1.N42	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Consistent 	N Shifts: Consistent


	H Shift Assignments>> 	H :: 8.7018	 	HA :: 4.3298	 	HB2 :: 2.6418	 	HD21 :: 7.7668	 	HD22 :: 6.9678	
	Ave H Shift Values>> 	H :: 8.37(0.65) 	HA :: 4.7(0.39) 	HB2 :: 2.8(0.34) 	HB3 :: 2.78(0.34) 	HD21 :: 7.27(0.52) 	HD22 :: 7.2(0.52)

	N Shift Assignments>> 	N :: 116.151	 	ND2 :: 114.422	
	Ave N Shift Values>> 	N :: 119.13(4.42) 	ND2 :: 112.83(2.6)



1.P43	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Indeterminable

	PRTL>>	V 0.33   P 0.26   C 0.14   W 0.07   I 0.06   R 0.03   E 0.02   K 0.02   M 0.01   H 0.01   

	C Shift Assignments>> 	C :: 174.906	 	CA :: 61.9858	 	CB :: 31.9148	
	Ave C Shift Values>> 	C :: 176.7(1.69) 	CA :: 63.3(1.64) 	CB :: 31.81(1.54) 	CG :: 27.14(1.18) 	CD :: 50.28(1.04)

	H Shift Assignments>> 	HA :: 4.7228	 	HB2 :: 1.9038	 	HG2 :: 1.9418	 	HD2 :: 3.5758	 	HD3 :: 3.2618	
	Ave H Shift Values>> 	HA :: 4.41(0.36) 	HB2 :: 2.05(0.39) 	HB3 :: 2.05(0.39) 	HG2 :: 1.93(0.36) 	HG3 :: 1.92(0.37) 	HD2 :: 3.64(0.36)
			 	HD3 :: 3.63(0.4)



1.T44	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.99   

	C Shift Assignments>> 	C :: 172.336	 	CA :: 60.5658	 	CB :: 70.7718	
	Ave C Shift Values>> 	C :: 174.6(1.8) 	CA :: 62.15(2.72) 	CB :: 69.64(1.7) 	CG2 :: 21.44(1.39)

	H Shift Assignments>> 	H :: 8.6648	 	HA :: 4.4338	 	HB :: 4.7188	 	HG21 :: 1.4328	 	HG22 :: 1.4328	 	HG23 :: 1.4328	
	Ave H Shift Values>> 	H :: 8.27(0.62) 	HA :: 4.48(0.5) 	HB :: 4.17(0.37) 	HG1 :: 4.4(1.92) 	HG2 :: 1.16(0.28) 	HG21 :: 1.16(0.28)
			 	HG22 :: 1.16(0.28) 	HG23 :: 1.16(0.28)

	N Shift Assignments>> 	N :: 112.272	
	Ave N Shift Values>> 	N :: 115.7(5.05)



1.E45	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.33   E 0.3   I 0.26   K 0.05   Q 0.01   M 0.01   

	C Shift Assignments>> 	C :: 176.176	 	CA :: 59.9988	 	CB :: 29.4078	 	CG :: 36.3798	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.8228	 	HA :: 3.9828	 	HB2 :: 1.4588	 	HG2 :: 2.3548	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 120.212	
	Ave N Shift Values>> 	N :: 120.68(3.68)



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

	PRTL>>	M 0.53   A 0.38   I 0.03   C 0.03   

	HN Overlap>>	 1.A88 1.A88

	C Shift Assignments>> 	C :: 177.394	 	CA :: 55.0398	 	CB :: 18.1898	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 8.2698	 	HA :: 4.0878	 	HB1 :: 1.3958	 	HB2 :: 1.3958	 	HB3 :: 1.3958	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 120.147	
	Ave N Shift Values>> 	N :: 123.23(3.7)



1.E47	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.29   Q 0.23   K 0.22   E 0.11   R 0.06   I 0.03   M 0.01   

	HN Overlap>>	 1.K75 1.K75

	C Shift Assignments>> 	C :: 177.405	 	CA :: 58.9238	 	CB :: 28.2468	 	CG :: 33.9888	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 7.6948	 	HA :: 3.9848	 	HB2 :: 1.8868	 	HG2 :: 2.4058	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 118.332	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.L48	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.29   L 0.23   R 0.23   C 0.17   I 0.05   

	HN Overlap>>	 1.D50 1.D50

	C Shift Assignments>> 	C :: 175.752	 	CA :: 57.8508	 	CB :: 42.1988	 	CG :: 25.8498	
	Ave C Shift Values>> 	C :: 176.97(2.09) 	CA :: 55.65(2.21) 	CB :: 42.37(1.86) 	CG :: 26.77(1.25) 	CD1 :: 24.73(1.71) 	CD2 :: 24.1(1.78)

	H Shift Assignments>> 	H :: 8.1268	 	HA :: 4.0138	 	HB2 :: 2.0508	 	HG :: 1.0458	 	HD11 :: 0.7938	 	HD12 :: 0.7938	
			 	HD13 :: 0.7938	 	HD21 :: 0.6978	 	HD22 :: 0.6978	 	HD23 :: 0.6978	
	Ave H Shift Values>> 	H :: 8.22(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.63(0.34) 	HB3 :: 1.57(0.36) 	HG :: 1.54(0.33) 	HD1 :: 0.77(0.27)
			 	HD2 :: 0.76(0.28)

	N Shift Assignments>> 	N :: 119.439	
	Ave N Shift Values>> 	N :: 121.98(4.07)



1.Q49	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.25   Y 0.2   I 0.18   E 0.16   F 0.13   M 0.02   K 0.01   

	C Shift Assignments>> 	C :: 175.703	 	CA :: 59.1438	 	CG :: 37.2758	
	Ave C Shift Values>> 	C :: 176.39(1.96) 	CA :: 56.62(2.19) 	CB :: 29.1(1.97) 	CG :: 33.72(1.1) 	CD :: 179.68(1.17)

	H Shift Assignments>> 	H :: 8.2468	 	HA :: 3.8418	 	HB2 :: 1.8108	 	HG2 :: 2.4358	 	HE21 :: 7.5158	 	HE22 :: 6.9308	
	Ave H Shift Values>> 	H :: 8.22(0.62) 	HA :: 4.28(0.44) 	HB2 :: 2.05(0.28) 	HB3 :: 2.04(0.29) 	HG2 :: 2.32(0.29) 	HG3 :: 2.32(0.29)
			 	HE21 :: 7.17(0.46) 	HE22 :: 7.07(0.49)

	N Shift Assignments>> 	N :: 117.775	 	NE2 :: 112.455	
	Ave N Shift Values>> 	N :: 119.92(4.01) 	NE2 :: 111.81(2.2)



1.D50	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.23   Y 0.22   C 0.17   D 0.11   L 0.09   I 0.05   K 0.05   N 0.03   

	HN Overlap>>	 1.L48 1.L48

	C Shift Assignments>> 	CA :: 57.1128	 	CB :: 40.0358	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.1208	 	HA :: 4.4378	 	HB2 :: 2.8628	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 119.405	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.M51	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Consistent 	N Shifts: Consistent


	H Shift Assignments>> 	H :: 7.9218	 	HA :: 4.0798	 	HB2 :: 1.9378	 	HB3 :: 1.6278	 	HG2 :: 2.4078	 	HG3 :: 2.1978	
			 	HE1 :: 1.6978	 	HE2 :: 1.6978	 	HE3 :: 1.6978	
	Ave H Shift Values>> 	H :: 8.26(0.6) 	HA :: 4.39(0.46) 	HB2 :: 2.03(0.38) 	HB3 :: 2.01(0.36) 	HG2 :: 2.44(0.36) 	HG3 :: 2.41(0.4)
			 	HE :: 1.86(0.47)

	N Shift Assignments>> 	N :: 118.728	
	Ave N Shift Values>> 	N :: 120.1(3.88)



1.I52	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.77   C 0.22   

	C Shift Assignments>> 	C :: 174.965	 	CA :: 64.1228	 	CB :: 36.377	 	CG2 :: 16.2578	 	CD1 :: 11.4728	
	Ave C Shift Values>> 	C :: 175.82(1.95) 	CA :: 61.59(2.78) 	CB :: 38.58(2.09) 	CG1 :: 27.65(2.32) 	CG2 :: 17.36(1.6) 	CD1 :: 13.41(1.91)

	H Shift Assignments>> 	H :: 7.5878	 	HA :: 3.7538	 	HB :: 2.0858	 	HG12 :: 1.5958	 	HG13 :: 1.2778	 	HG21 :: 0.7698	
			 	HG22 :: 0.7698	 	HG23 :: 0.7698	 	HD11 :: 0.6988	 	HD12 :: 0.6988	 	HD13 :: 0.6988	
	Ave H Shift Values>> 	H :: 8.26(0.71) 	HA :: 4.2(0.56) 	HB :: 1.8(0.31) 	HG2 :: 0.8(0.29) 	HG12 :: 1.3(0.4) 	HG13 :: 1.24(0.4)
			 	HD1 :: 0.7(0.3)

	N Shift Assignments>> 	N :: 117.735	
	Ave N Shift Values>> 	N :: 121.6(4.72)



1.N53	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.23   N 0.2   C 0.17   Y 0.17   F 0.09   E 0.06   D 0.02   

	HN Overlap>>	 1.R106 1.R106

	C Shift Assignments>> 	C :: 174.533	 	CB :: 37.9058	
	Ave C Shift Values>> 	C :: 175.16(1.76) 	CA :: 53.43(1.94) 	CB :: 38.66(1.78) 	CG :: 176.61(1.33)

	H Shift Assignments>> 	H :: 8.7088	 	HA :: 4.4348	 	HB2 :: 2.9978	 	HB3 :: 2.8708	 	HD21 :: 7.8368	 	HD22 :: 6.9718	
	Ave H Shift Values>> 	H :: 8.37(0.65) 	HA :: 4.7(0.39) 	HB2 :: 2.8(0.34) 	HB3 :: 2.78(0.34) 	HD21 :: 7.27(0.52) 	HD22 :: 7.2(0.52)

	N Shift Assignments>> 	N :: 117.691	 	ND2 :: 110.953	
	Ave N Shift Values>> 	N :: 119.13(4.42) 	ND2 :: 112.83(2.6)



1.E54	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.28   E 0.27   Y 0.11   I 0.08   M 0.07   K 0.05   F 0.04   V 0.03   Q 0.02   

	HN Overlap>>	 1.Y99 1.Y99

	C Shift Assignments>> 	CA :: 58.6148	 	CG :: 35.9758	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 7.6898	 	HA :: 4.0438	 	HB2 :: 1.8668	 	HG2 :: 2.3468	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 115.838	
	Ave N Shift Values>> 	N :: 120.68(3.68)



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

	PRTL>>	V 0.82   C 0.13   I 0.02   L 0.01   

	C Shift Assignments>> 	C :: 172.915	 	CA :: 60.9138	 	CG1 :: 22.5128	 	CG2 :: 20.8048	
	Ave C Shift Values>> 	C :: 175.69(2.03) 	CA :: 62.48(3.04) 	CB :: 32.66(1.91) 	CG1 :: 21.38(1.53) 	CG2 :: 21.31(1.76)

	H Shift Assignments>> 	H :: 7.2148	 	HA :: 4.2588	 	HB :: 2.1608	 	HG11 :: 0.8278	 	HG12 :: 0.8278	 	HG13 :: 0.8278	
			 	HG21 :: 0.8788	 	HG22 :: 0.8788	 	HG23 :: 0.8788	
	Ave H Shift Values>> 	H :: 8.29(0.71) 	HA :: 4.16(0.57) 	HB :: 1.99(0.33) 	HG1 :: 0.84(0.27) 	HG2 :: 0.83(0.29)

	N Shift Assignments>> 	N :: 110.912	
	Ave N Shift Values>> 	N :: 121.02(4.96)



1.D56	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.29   N 0.22   C 0.12   L 0.11   F 0.09   Y 0.08   K 0.03   

	C Shift Assignments>> 	C :: 173.361	 	CA :: 53.8648	 	CB :: 40.1588	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 7.7608	 	HA :: 4.5098	 	HB2 :: 3.0068	 	HB3 :: 2.7238	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 120.629	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.A57	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.53   M 0.38   C 0.04   L 0.01   

	C Shift Assignments>> 	C :: 175.842	 	CA :: 54.2908	 	CB :: 19.4558	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 8.2438	 	HA :: 4.2228	 	HB1 :: 1.5318	 	HB2 :: 1.5318	 	HB3 :: 1.5318	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 131.226	
	Ave N Shift Values>> 	N :: 123.23(3.7)



1.D58	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	N 0.36   D 0.28   C 0.13   L 0.07   Y 0.06   F 0.06   K 0.01   

	C Shift Assignments>> 	C :: 175.471	 	CA :: 52.7878	 	CB :: 39.7758	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.2578	 	HA :: 4.6198	 	HB2 :: 3.0668	 	HB3 :: 2.6918	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 113.496	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.G59	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.76   C 0.17   L 0.04   

	HN Overlap>>	 1.T62 1.T62

	C Shift Assignments>> 	C :: 172.107	 	CA :: 46.9268	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 7.6128	 	HA2 :: 3.8788	 	HA3 :: 3.8278	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 108.087	
	Ave N Shift Values>> 	N :: 109.91(4.29)



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

	PRTL>>	I 0.21   C 0.2   N 0.19   Y 0.16   E 0.09   F 0.08   D 0.02   M 0.01   

	C Shift Assignments>> 	C :: 174.007	 	CB :: 37.6628	
	Ave C Shift Values>> 	C :: 175.16(1.76) 	CA :: 53.43(1.94) 	CB :: 38.66(1.78) 	CG :: 176.61(1.33)

	H Shift Assignments>> 	H :: 8.1948	 	HA :: 4.6068	 	HB2 :: 3.3368	 	HB3 :: 2.6538	
	Ave H Shift Values>> 	H :: 8.37(0.65) 	HA :: 4.7(0.39) 	HB2 :: 2.8(0.34) 	HB3 :: 2.78(0.34) 	HD21 :: 7.27(0.52) 	HD22 :: 7.2(0.52)

	N Shift Assignments>> 	N :: 118.324	
	Ave N Shift Values>> 	N :: 119.13(4.42) 	ND2 :: 112.83(2.6)



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

	PRTL>>	G 0.79   L 0.08   C 0.08   R 0.02   

	C Shift Assignments>> 	C :: 170.445	 	CA :: 45.4348	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 10.5728	 	HA2 :: 4.2558	 	HA3 :: 3.4938	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 112.871	
	Ave N Shift Values>> 	N :: 109.91(4.29)



1.T62	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.98   V 0.01   

	HN Overlap>>	 1.G59 1.G59

	C Shift Assignments>> 	C :: 170.378	 	CB :: 72.1128	 	CG2 :: 22.1088	
	Ave C Shift Values>> 	C :: 174.6(1.8) 	CA :: 62.15(2.72) 	CB :: 69.64(1.7) 	CG2 :: 21.44(1.39)

	H Shift Assignments>> 	H :: 7.6938	 	HA :: 4.7958	 	HB :: 4.0208	 	HG21 :: 1.1598	 	HG22 :: 1.1598	 	HG23 :: 1.1598	
	Ave H Shift Values>> 	H :: 8.27(0.62) 	HA :: 4.48(0.5) 	HB :: 4.17(0.37) 	HG1 :: 4.4(1.92) 	HG2 :: 1.16(0.28) 	HG21 :: 1.16(0.28)
			 	HG22 :: 1.16(0.28) 	HG23 :: 1.16(0.28)

	N Shift Assignments>> 	N :: 108.099	
	Ave N Shift Values>> 	N :: 115.7(5.05)



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

	PRTL>>	I 0.54   C 0.44   A 0.01   

	C Shift Assignments>> 	C :: 172.687	 	CA :: 58.9958	 	CG1 :: 27.365	 	CG2 :: 18.3588	 	CD1 :: 15.3698	
	Ave C Shift Values>> 	C :: 175.82(1.95) 	CA :: 61.59(2.78) 	CB :: 38.58(2.09) 	CG1 :: 27.65(2.32) 	CG2 :: 17.36(1.6) 	CD1 :: 13.41(1.91)

	H Shift Assignments>> 	H :: 8.8238	 	HA :: 5.2228	 	HB :: 2.1488	 	HG13 :: 0.9158	 	HG21 :: 1.1978	 	HG22 :: 1.1978	
			 	HG23 :: 1.1978	 	HD11 :: 0.3718	 	HD12 :: 0.3718	 	HD13 :: 0.3718	
	Ave H Shift Values>> 	H :: 8.26(0.71) 	HA :: 4.2(0.56) 	HB :: 1.8(0.31) 	HG2 :: 0.8(0.29) 	HG12 :: 1.3(0.4) 	HG13 :: 1.24(0.4)
			 	HD1 :: 0.7(0.3)

	N Shift Assignments>> 	N :: 123.323	
	Ave N Shift Values>> 	N :: 121.6(4.72)



1.D64	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.29   L 0.23   C 0.13   N 0.09   R 0.07   K 0.07   F 0.03   G 0.03   Y 0.02   

	C Shift Assignments>> 	C :: 173.494	 	CA :: 51.8118	 	CB :: 42.2468	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.8928	 	HA :: 5.4908	 	HB2 :: 3.1518	 	HB3 :: 2.8708	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 127.718	
	Ave N Shift Values>> 	N :: 120.73(4.2)



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

	PRTL>>	Y 0.57   F 0.41   H 0.01   

	C Shift Assignments>> 	CB :: 35.6308	 	CD1 :: 129.971	 	CD2 :: 129.971	 	CE1 :: 128.531	 	CE2 :: 128.531	
	Ave C Shift Values>> 	C :: 175.49(2.13) 	CA :: 58.25(2.73) 	CB :: 39.95(2.04) 	CG :: 138.35(1.12) 	CD1 :: 131.38(1.38) 	CD2 :: 131.33(1.48)
			 	CE1 :: 130.48(1.29) 	CE2 :: 130.6(0.97) 	CZ :: 129.11(1.68)

	H Shift Assignments>> 	H :: 8.9878	 	HA :: 3.7838	 	HB2 :: 2.8208	 	HB3 :: 2.0848	 	HD1 :: 6.7628	 	HD2 :: 6.7628	
			 	HE1 :: 7.2108	 	HE2 :: 7.2108	
	Ave H Shift Values>> 	H :: 8.42(0.74) 	HA :: 4.62(0.58) 	HB2 :: 2.99(0.37) 	HB3 :: 2.97(0.38) 	HD1 :: 6.91(0.82) 	HD2 :: 6.89(0.86)
			 	HE1 :: 6.95(0.82) 	HE2 :: 6.94(0.86) 	HZ :: 6.92(0.8)

	N Shift Assignments>> 	N :: 118.282	
	Ave N Shift Values>> 	N :: 120.69(4.18)



1.P66	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Consistent 	N Shifts: Indeterminable


	H Shift Assignments>> 	HA :: 3.8528	 	HB2 :: 2.1578	 	HB3 :: 1.8038	 	HG2 :: 1.3648	 	HD2 :: 3.7078	
	Ave H Shift Values>> 	HA :: 4.41(0.36) 	HB2 :: 2.05(0.39) 	HB3 :: 2.05(0.39) 	HG2 :: 1.93(0.36) 	HG3 :: 1.92(0.37) 	HD2 :: 3.64(0.36)
			 	HD3 :: 3.63(0.4)



1.E67	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Consistent 	N Shifts: Consistent


	H Shift Assignments>> 	H :: 8.1738	 	HA :: 4.4498	 	HB2 :: 1.7678	 	HB3 :: 1.7678	 	HG2 :: 2.6078	 	HG3 :: 2.2878	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 116.980	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.F68	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.69   Y 0.25   H 0.03   W 0.01   

	C Shift Assignments>> 	CD1 :: 129.642	 	CD2 :: 129.642	 	CE1 :: 129.082	 	CE2 :: 129.082	
	Ave C Shift Values>> 	C :: 175.49(2.13) 	CA :: 58.25(2.73) 	CB :: 39.95(2.04) 	CG :: 138.35(1.12) 	CD1 :: 131.38(1.38) 	CD2 :: 131.33(1.48)
			 	CE1 :: 130.48(1.29) 	CE2 :: 130.6(0.97) 	CZ :: 129.11(1.68)

	H Shift Assignments>> 	H :: 8.6708	 	HA :: 3.6278	 	HB2 :: 3.1278	 	HB3 :: 2.8278	 	HD1 :: 6.9108	 	HD2 :: 6.9108	
			 	HE1 :: 7.1818	 	HE2 :: 7.1818	
	Ave H Shift Values>> 	H :: 8.42(0.74) 	HA :: 4.62(0.58) 	HB2 :: 2.99(0.37) 	HB3 :: 2.97(0.38) 	HD1 :: 6.91(0.82) 	HD2 :: 6.89(0.86)
			 	HE1 :: 6.95(0.82) 	HE2 :: 6.94(0.86) 	HZ :: 6.92(0.8)

	N Shift Assignments>> 	N :: 122.872	
	Ave N Shift Values>> 	N :: 120.69(4.18)



1.L69	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.82   L 0.14   E 0.01   

	HN Overlap>>	 2.R16 2.R16

	C Shift Assignments>> 	CB :: 38.6428	 	CD1 :: 25.5958	
	Ave C Shift Values>> 	C :: 176.97(2.09) 	CA :: 55.65(2.21) 	CB :: 42.37(1.86) 	CG :: 26.77(1.25) 	CD1 :: 24.73(1.71) 	CD2 :: 24.1(1.78)

	H Shift Assignments>> 	H :: 8.6748	 	HA :: 3.9398	 	HB2 :: 1.3058	 	HG :: 0.6778	 	HD11 :: 0.8388	 	HD12 :: 0.8388	
			 	HD13 :: 0.8388	 	HD21 :: 0.0638	 	HD22 :: 0.0638	 	HD23 :: 0.0638	
	Ave H Shift Values>> 	H :: 8.22(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.63(0.34) 	HB3 :: 1.57(0.36) 	HG :: 1.54(0.33) 	HD1 :: 0.77(0.27)
			 	HD2 :: 0.76(0.28)

	N Shift Assignments>> 	N :: 119.155	
	Ave N Shift Values>> 	N :: 121.98(4.07)



1.T70	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.7   V 0.19   I 0.06   S 0.02   P 0.01   

	C Shift Assignments>> 	CB :: 67.8278	
	Ave C Shift Values>> 	C :: 174.6(1.8) 	CA :: 62.15(2.72) 	CB :: 69.64(1.7) 	CG2 :: 21.44(1.39)

	H Shift Assignments>> 	H :: 7.5458	 	HA :: 3.4478	 	HB :: 4.1948	 	HG21 :: 1.2488	 	HG22 :: 1.2488	 	HG23 :: 1.2488	
	Ave H Shift Values>> 	H :: 8.27(0.62) 	HA :: 4.48(0.5) 	HB :: 4.17(0.37) 	HG1 :: 4.4(1.92) 	HG2 :: 1.16(0.28) 	HG21 :: 1.16(0.28)
			 	HG22 :: 1.16(0.28) 	HG23 :: 1.16(0.28)

	N Shift Assignments>> 	N :: 114.017	
	Ave N Shift Values>> 	N :: 115.7(5.05)



1.M71	Overall: Consistent 	Typing: Indeterminable 	SRO: Consistent 	C Shifts: Indeterminable 	H Shifts: Consistent 	N Shifts: Consistent


	H Shift Assignments>> 	H :: 7.6178	 	HA :: 3.4178	 	HB2 :: 1.7678	 	HG2 :: 2.0978	 	HE1 :: 1.3978	 	HE2 :: 1.3978	
			 	HE3 :: 1.3978	
	Ave H Shift Values>> 	H :: 8.26(0.6) 	HA :: 4.39(0.46) 	HB2 :: 2.03(0.38) 	HB3 :: 2.01(0.36) 	HG2 :: 2.44(0.36) 	HG3 :: 2.41(0.4)
			 	HE :: 1.86(0.47)

	N Shift Assignments>> 	N :: 119.160	
	Ave N Shift Values>> 	N :: 120.1(3.88)



1.M72	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.19   V 0.18   W 0.13   R 0.09   K 0.08   E 0.07   M 0.06   H 0.05   I 0.04   P 0.03   Q 0.02   

	C Shift Assignments>> 	C :: 175.697	 	CA :: 60.0268	 	CG :: 31.9708	
	Ave C Shift Values>> 	C :: 176.3(2.13) 	CA :: 56.16(2.34) 	CB :: 32.9(2.23) 	CG :: 32.07(1.45) 	CE :: 17.21(3.42)

	H Shift Assignments>> 	H :: 8.1888	 	HA :: 3.6478	 	HB2 :: 1.0678	 	HB3 :: 0.9978	 	HG2 :: 1.4578	 	HG3 :: 1.3778	
	Ave H Shift Values>> 	H :: 8.26(0.6) 	HA :: 4.39(0.46) 	HB2 :: 2.03(0.38) 	HB3 :: 2.01(0.36) 	HG2 :: 2.44(0.36) 	HG3 :: 2.41(0.4)
			 	HE :: 1.86(0.47)

	N Shift Assignments>> 	N :: 115.879	
	Ave N Shift Values>> 	N :: 120.1(3.88)



1.A73	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	M 0.34   A 0.33   I 0.26   V 0.03   T 0.01   

	C Shift Assignments>> 	C :: 177.075	 	CB :: 18.2718	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 7.8968	 	HA :: 4.0248	 	HB1 :: 1.3728	 	HB2 :: 1.3728	 	HB3 :: 1.3728	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 120.060	
	Ave N Shift Values>> 	N :: 123.23(3.7)



1.R74	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.44   L 0.35   G 0.13   K 0.04   I 0.02   

	C Shift Assignments>> 	C :: 175.040	 	CG :: 27.3618	 	CD :: 43.7328	
	Ave C Shift Values>> 	C :: 176.49(2.16) 	CA :: 56.95(2.41) 	CB :: 30.66(1.77) 	CG :: 27.31(1.65) 	CD :: 43.1(1.1) 	CZ :: 159.01(0.87)

	H Shift Assignments>> 	H :: 7.4768	 	HA :: 3.7378	 	HB2 :: 1.4878	 	HB3 :: 1.3178	 	HG2 :: 1.0778	 	HD2 :: 2.7378	
	Ave H Shift Values>> 	H :: 8.24(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.79(0.28) 	HB3 :: 1.78(0.28) 	HG2 :: 1.58(0.27) 	HG3 :: 1.58(0.27)
			 	HD2 :: 3.13(0.23) 	HD3 :: 3.13(0.22) 	HE :: 7.32(0.52) 	HH11 :: 6.74(0.31) 	HH12 :: 6.75(0.32) 	HH21 :: 6.72(0.32)
			 	HH22 :: 6.72(0.33)

	N Shift Assignments>> 	N :: 116.115	
	Ave N Shift Values>> 	N :: 120.61(3.9) 	NE :: 89.8(12.83) 	NH1 :: 74.78(11.38) 	NH2 :: 75.84(11.44)



1.K75	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.25   F 0.18   Y 0.12   L 0.1   C 0.08   K 0.08   I 0.07   N 0.06   

	HN Overlap>>	 1.E47 1.E47

	C Shift Assignments>> 	C :: 174.877	 	CE :: 40.7878	
	Ave C Shift Values>> 	C :: 176.46(2.05) 	CA :: 56.84(2.25) 	CB :: 32.83(1.88) 	CG :: 24.91(1.31) 	CD :: 28.78(1.39) 	CE :: 41.78(0.98)

	H Shift Assignments>> 	H :: 7.7728	 	HA :: 3.9348	 	HB2 :: 1.8288	 	HG2 :: 1.4908	 	HD2 :: 1.6878	 	HE2 :: 3.5488	
	Ave H Shift Values>> 	H :: 8.22(0.64) 	HA :: 4.28(0.45) 	HB2 :: 1.79(0.25) 	HB3 :: 1.78(0.26) 	HG2 :: 1.38(0.27) 	HG3 :: 1.37(0.29)
			 	HD2 :: 1.61(0.25) 	HD3 :: 1.61(0.25) 	HE2 :: 2.93(0.2) 	HE3 :: 2.93(0.2) 	HZ :: 7.52(0.36)

	N Shift Assignments>> 	N :: 118.389	
	Ave N Shift Values>> 	N :: 121.16(4.11) 	NZ :: 71.86(52.41)



1.M76	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	M 0.45   C 0.42   A 0.07   I 0.02   

	HN Overlap>>	 1.L112 1.L112

	C Shift Assignments>> 	C :: 173.683	 	CA :: 56.4598	 	CG :: 32.1808	 	CE :: 17.0608	
	Ave C Shift Values>> 	C :: 176.3(2.13) 	CA :: 56.16(2.34) 	CB :: 32.9(2.23) 	CG :: 32.07(1.45) 	CE :: 17.21(3.42)

	H Shift Assignments>> 	H :: 7.9748	 	HA :: 4.3438	 	HB2 :: 2.1528	 	HB3 :: 2.1098	 	HG2 :: 2.6608	 	HG3 :: 2.6188	
			 	HE1 :: 2.0868	 	HE2 :: 2.0868	 	HE3 :: 2.0868	
	Ave H Shift Values>> 	H :: 8.26(0.6) 	HA :: 4.39(0.46) 	HB2 :: 2.03(0.38) 	HB3 :: 2.01(0.36) 	HG2 :: 2.44(0.36) 	HG3 :: 2.41(0.4)
			 	HE :: 1.86(0.47)

	N Shift Assignments>> 	N :: 117.535	
	Ave N Shift Values>> 	N :: 120.1(3.88)



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

	PRTL>>	K 0.39   C 0.37   R 0.18   M 0.03   

	HN Overlap>>	 1.Q8 1.Q8

	C Shift Assignments>> 	C :: 173.704	 	CA :: 56.8018	 	CB :: 32.7798	 	CG :: 24.5088	 	CD :: 28.8688	 	CE :: 41.9038	
	Ave C Shift Values>> 	C :: 176.46(2.05) 	CA :: 56.84(2.25) 	CB :: 32.83(1.88) 	CG :: 24.91(1.31) 	CD :: 28.78(1.39) 	CE :: 41.78(0.98)

	H Shift Assignments>> 	H :: 7.7548	 	HA :: 4.2988	 	HB2 :: 1.8628	 	HB3 :: 1.8208	 	HG2 :: 1.4828	 	HD2 :: 1.6868	
			 	HE2 :: 2.9838	
	Ave H Shift Values>> 	H :: 8.22(0.64) 	HA :: 4.28(0.45) 	HB2 :: 1.79(0.25) 	HB3 :: 1.78(0.26) 	HG2 :: 1.38(0.27) 	HG3 :: 1.37(0.29)
			 	HD2 :: 1.61(0.25) 	HD3 :: 1.61(0.25) 	HE2 :: 2.93(0.2) 	HE3 :: 2.93(0.2) 	HZ :: 7.52(0.36)

	N Shift Assignments>> 	N :: 119.562	
	Ave N Shift Values>> 	N :: 121.16(4.11) 	NZ :: 71.86(52.41)



1.D78	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.28   L 0.17   C 0.11   N 0.11   K 0.1   F 0.09   Y 0.08   R 0.02   

	HN Overlap>>	 2.E27 2.E25 2.E27 2.E25

	C Shift Assignments>> 	C :: 173.716	 	CA :: 54.3988	 	CB :: 40.8618	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.1648	 	HA :: 4.7048	 	HB2 :: 2.8028	 	HB3 :: 2.7438	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 120.459	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.T79	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 :: 171.541	 	CA :: 62.1658	 	CB :: 69.7638	 	CG2 :: 21.4248	
	Ave C Shift Values>> 	C :: 174.6(1.8) 	CA :: 62.15(2.72) 	CB :: 69.64(1.7) 	CG2 :: 21.44(1.39)

	H Shift Assignments>> 	H :: 8.0398	 	HA :: 4.3208	 	HB :: 4.2538	 	HG21 :: 1.2238	 	HG22 :: 1.2238	 	HG23 :: 1.2238	
	Ave H Shift Values>> 	H :: 8.27(0.62) 	HA :: 4.48(0.5) 	HB :: 4.17(0.37) 	HG1 :: 4.4(1.92) 	HG2 :: 1.16(0.28) 	HG21 :: 1.16(0.28)
			 	HG22 :: 1.16(0.28) 	HG23 :: 1.16(0.28)

	N Shift Assignments>> 	N :: 113.759	
	Ave N Shift Values>> 	N :: 115.7(5.05)



1.D80	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.27   L 0.18   C 0.11   K 0.11   N 0.1   F 0.09   Y 0.08   R 0.02   

	C Shift Assignments>> 	C :: 173.897	 	CA :: 54.4298	 	CB :: 40.9508	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.4268	 	HA :: 4.7098	 	HB2 :: 2.7928	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 122.666	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.S81	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.99   

	HN Overlap>>	 1.R126 1.R126

	C Shift Assignments>> 	C :: 172.788	 	CA :: 59.4528	 	CB :: 63.0578	
	Ave C Shift Values>> 	C :: 174.53(1.73) 	CA :: 58.57(2.12) 	CB :: 63.8(1.57)

	H Shift Assignments>> 	H :: 8.4558	 	HA :: 4.4138	 	HB2 :: 3.9998	
	Ave H Shift Values>> 	H :: 8.29(0.62) 	HA :: 4.51(0.43) 	HB2 :: 3.88(0.29) 	HB3 :: 3.87(0.31) 	HG :: 5.33(1.16)

	N Shift Assignments>> 	N :: 117.057	
	Ave N Shift Values>> 	N :: 116.3(3.95)



1.E82	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.36   C 0.34   I 0.16   K 0.06   M 0.03   Q 0.01   

	C Shift Assignments>> 	C :: 175.133	 	CA :: 58.6118	 	CB :: 29.7828	 	CG :: 36.6058	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.5098	 	HA :: 4.1568	 	HB2 :: 2.1328	 	HG2 :: 2.3588	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 122.235	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.E83	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.33   C 0.32   I 0.15   K 0.09   Q 0.05   M 0.03   

	HN Overlap>>	 1.E123 1.E123

	C Shift Assignments>> 	C :: 176.436	 	CA :: 59.2618	 	CB :: 29.5468	 	CG :: 35.8858	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.2248	 	HA :: 4.1048	 	HB2 :: 2.0948	 	HG2 :: 2.3658	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 119.203	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.E84	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.35   C 0.34   I 0.17   M 0.05   K 0.04   Q 0.02   

	HN Overlap>>	 1.E139 1.E139

	C Shift Assignments>> 	C :: 177.343	 	CA :: 59.6828	 	CB :: 30.3448	 	CG :: 36.2148	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.1158	 	HA :: 4.1448	 	HB2 :: 2.1508	 	HG2 :: 2.4798	 	HG3 :: 2.3118	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 117.902	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.I85	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.91   C 0.08   

	C Shift Assignments>> 	C :: 174.656	 	CA :: 65.6048	 	CB :: 37.4178	 	CG1 :: 29.7868	 	CG2 :: 18.5638	 	CD1 :: 13.3228	
	Ave C Shift Values>> 	C :: 175.82(1.95) 	CA :: 61.59(2.78) 	CB :: 38.58(2.09) 	CG1 :: 27.65(2.32) 	CG2 :: 17.36(1.6) 	CD1 :: 13.41(1.91)

	H Shift Assignments>> 	H :: 8.0018	 	HA :: 4.0898	 	HB :: 2.2168	 	HG12 :: 1.9488	 	HG13 :: 0.9628	 	HG21 :: 1.1078	
			 	HG22 :: 1.1078	 	HG23 :: 1.1078	 	HD11 :: 0.7028	 	HD12 :: 0.7028	 	HD13 :: 0.7028	
	Ave H Shift Values>> 	H :: 8.26(0.71) 	HA :: 4.2(0.56) 	HB :: 1.8(0.31) 	HG2 :: 0.8(0.29) 	HG12 :: 1.3(0.4) 	HG13 :: 1.24(0.4)
			 	HD1 :: 0.7(0.3)

	N Shift Assignments>> 	N :: 119.580	
	Ave N Shift Values>> 	N :: 121.6(4.72)



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

	PRTL>>	R 0.46   C 0.38   K 0.08   G 0.06   

	C Shift Assignments>> 	CA :: 60.3318	 	CB :: 29.9378	 	CG :: 27.3348	 	CD :: 42.9598	
	Ave C Shift Values>> 	C :: 176.49(2.16) 	CA :: 56.95(2.41) 	CB :: 30.66(1.77) 	CG :: 27.31(1.65) 	CD :: 43.1(1.1) 	CZ :: 159.01(0.87)

	H Shift Assignments>> 	H :: 8.3748	 	HA :: 4.1548	 	HB2 :: 2.0668	 	HB3 :: 1.8628	 	HG2 :: 1.6538	 	HG3 :: 1.5228	
			 	HD2 :: 2.9658	
	Ave H Shift Values>> 	H :: 8.24(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.79(0.28) 	HB3 :: 1.78(0.28) 	HG2 :: 1.58(0.27) 	HG3 :: 1.58(0.27)
			 	HD2 :: 3.13(0.23) 	HD3 :: 3.13(0.22) 	HE :: 7.32(0.52) 	HH11 :: 6.74(0.31) 	HH12 :: 6.75(0.32) 	HH21 :: 6.72(0.32)
			 	HH22 :: 6.72(0.33)

	N Shift Assignments>> 	N :: 121.213	
	Ave N Shift Values>> 	N :: 120.61(3.9) 	NE :: 89.8(12.83) 	NH1 :: 74.78(11.38) 	NH2 :: 75.84(11.44)



1.E87	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.34   C 0.33   I 0.17   K 0.07   Q 0.03   M 0.03   

	C Shift Assignments>> 	CA :: 59.2028	 	CB :: 29.6808	 	CG :: 36.2078	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.3608	 	HA :: 4.0938	 	HB2 :: 2.0958	 	HG2 :: 2.3498	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 117.579	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.A88	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	M 0.5   A 0.42   C 0.03   I 0.02   

	HN Overlap>>	 1.A46 1.A46

	C Shift Assignments>> 	C :: 176.595	 	CA :: 54.9348	 	CB :: 18.5808	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 8.3528	 	HA :: 4.1738	 	HB1 :: 1.9338	 	HB2 :: 1.9338	 	HB3 :: 1.9338	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 120.095	
	Ave N Shift Values>> 	N :: 123.23(3.7)



1.F89	Overall: Suspicious 	Typing: Consistent 	SRO: Consistent 	C Shifts: Suspicious 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.7   Y 0.24   F 0.04   

	C Shift Assignments>> 	C :: 173.566	 	CA :: 61.8048	 	CB :: 38.9878	 	CE1 :: 126.947	 	CE2 :: 126.947(S)	
	Ave C Shift Values>> 	C :: 175.49(2.13) 	CA :: 58.25(2.73) 	CB :: 39.95(2.04) 	CG :: 138.35(1.12) 	CD1 :: 131.38(1.38) 	CD2 :: 131.33(1.48)
			 	CE1 :: 130.48(1.29) 	CE2 :: 130.6(0.97) 	CZ :: 129.11(1.68)

	H Shift Assignments>> 	H :: 8.8348	 	HA :: 3.3128	 	HB2 :: 3.0008	 	HD1 :: 6.5598	 	HD2 :: 6.5598	 	HE1 :: 7.0808	
			 	HE2 :: 7.0808	 	HZ :: 7.2848	
	Ave H Shift Values>> 	H :: 8.42(0.74) 	HA :: 4.62(0.58) 	HB2 :: 2.99(0.37) 	HB3 :: 2.97(0.38) 	HD1 :: 6.91(0.82) 	HD2 :: 6.89(0.86)
			 	HE1 :: 6.95(0.82) 	HE2 :: 6.94(0.86) 	HZ :: 6.92(0.8)

	N Shift Assignments>> 	N :: 118.860	
	Ave N Shift Values>> 	N :: 120.69(4.18)



1.R90	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.43   C 0.36   K 0.12   G 0.07   

	C Shift Assignments>> 	C :: 174.665	 	CA :: 58.3618	 	CB :: 30.3938	 	CG :: 27.8308	 	CD :: 43.3538	
	Ave C Shift Values>> 	C :: 176.49(2.16) 	CA :: 56.95(2.41) 	CB :: 30.66(1.77) 	CG :: 27.31(1.65) 	CD :: 43.1(1.1) 	CZ :: 159.01(0.87)

	H Shift Assignments>> 	H :: 7.6278	 	HA :: 3.9408	 	HB2 :: 1.9898	 	HB3 :: 1.9528	 	HG2 :: 1.9688	 	HG3 :: 1.7988	
			 	HD2 :: 3.2628	
	Ave H Shift Values>> 	H :: 8.24(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.79(0.28) 	HB3 :: 1.78(0.28) 	HG2 :: 1.58(0.27) 	HG3 :: 1.58(0.27)
			 	HD2 :: 3.13(0.23) 	HD3 :: 3.13(0.22) 	HE :: 7.32(0.52) 	HH11 :: 6.74(0.31) 	HH12 :: 6.75(0.32) 	HH21 :: 6.72(0.32)
			 	HH22 :: 6.72(0.33)

	N Shift Assignments>> 	N :: 114.460	
	Ave N Shift Values>> 	N :: 120.61(3.9) 	NE :: 89.8(12.83) 	NH1 :: 74.78(11.38) 	NH2 :: 75.84(11.44)



1.V91	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 :: 174.176	 	CA :: 65.6048	 	CB :: 31.0978	 	CG1 :: 22.5558	 	CG2 :: 20.9048	
	Ave C Shift Values>> 	C :: 175.69(2.03) 	CA :: 62.48(3.04) 	CB :: 32.66(1.91) 	CG1 :: 21.38(1.53) 	CG2 :: 21.31(1.76)

	H Shift Assignments>> 	H :: 7.4118	 	HA :: 3.5488	 	HB :: 2.2488	 	HG11 :: 1.0318	 	HG12 :: 1.0318	 	HG13 :: 1.0318	
			 	HG21 :: 0.7098	 	HG22 :: 0.7098	 	HG23 :: 0.7098	
	Ave H Shift Values>> 	H :: 8.29(0.71) 	HA :: 4.16(0.57) 	HB :: 1.99(0.33) 	HG1 :: 0.84(0.27) 	HG2 :: 0.83(0.29)

	N Shift Assignments>> 	N :: 117.632	
	Ave N Shift Values>> 	N :: 121.02(4.96)



1.F92	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.49   Y 0.28   C 0.21   

	C Shift Assignments>> 	C :: 173.432	 	CA :: 60.5698	 	CB :: 41.0488	 	CD1 :: 130.697	 	CD2 :: 130.697	 	CE1 :: 129.847	
			 	CE2 :: 129.847	
	Ave C Shift Values>> 	C :: 175.49(2.13) 	CA :: 58.25(2.73) 	CB :: 39.95(2.04) 	CG :: 138.35(1.12) 	CD1 :: 131.38(1.38) 	CD2 :: 131.33(1.48)
			 	CE1 :: 130.48(1.29) 	CE2 :: 130.6(0.97) 	CZ :: 129.11(1.68)

	H Shift Assignments>> 	H :: 7.2058	 	HA :: 4.1938	 	HB2 :: 2.7418	 	HD1 :: 7.5308	 	HD2 :: 7.5308	 	HE1 :: 7.2868	
			 	HE2 :: 7.2868	
	Ave H Shift Values>> 	H :: 8.42(0.74) 	HA :: 4.62(0.58) 	HB2 :: 2.99(0.37) 	HB3 :: 2.97(0.38) 	HD1 :: 6.91(0.82) 	HD2 :: 6.89(0.86)
			 	HE1 :: 6.95(0.82) 	HE2 :: 6.94(0.86) 	HZ :: 6.92(0.8)

	N Shift Assignments>> 	N :: 114.928	
	Ave N Shift Values>> 	N :: 120.69(4.18)



1.D93	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	N 0.5   D 0.18   C 0.15   Y 0.06   F 0.05   L 0.03   

	C Shift Assignments>> 	C :: 174.487	 	CA :: 52.4208	 	CB :: 38.8108	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 7.8908	 	HA :: 4.5588	 	HB2 :: 2.2178	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 114.746	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.K94	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.4   K 0.39   R 0.16   M 0.02   

	C Shift Assignments>> 	C :: 175.567	 	CA :: 59.3298	 	CB :: 32.5108	 	CG :: 23.7708	 	CD :: 28.2778	 	CE :: 41.5298	
	Ave C Shift Values>> 	C :: 176.46(2.05) 	CA :: 56.84(2.25) 	CB :: 32.83(1.88) 	CG :: 24.91(1.31) 	CD :: 28.78(1.39) 	CE :: 41.78(0.98)

	H Shift Assignments>> 	H :: 7.4178	 	HA :: 3.8858	 	HB2 :: 1.8608	 	HG2 :: 1.5198	 	HG3 :: 1.4738	 	HD2 :: 1.6468	
			 	HD3 :: 1.4968	 	HE2 :: 2.8508	
	Ave H Shift Values>> 	H :: 8.22(0.64) 	HA :: 4.28(0.45) 	HB2 :: 1.79(0.25) 	HB3 :: 1.78(0.26) 	HG2 :: 1.38(0.27) 	HG3 :: 1.37(0.29)
			 	HD2 :: 1.61(0.25) 	HD3 :: 1.61(0.25) 	HE2 :: 2.93(0.2) 	HE3 :: 2.93(0.2) 	HZ :: 7.52(0.36)

	N Shift Assignments>> 	N :: 124.290	
	Ave N Shift Values>> 	N :: 121.16(4.11) 	NZ :: 71.86(52.41)



1.D95	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.28   N 0.24   C 0.13   L 0.1   F 0.09   Y 0.09   K 0.02   

	C Shift Assignments>> 	C :: 175.057	 	CA :: 53.9748	 	CB :: 39.9358	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.4428	 	HA :: 4.5038	 	HB2 :: 2.6828	 	HB3 :: 2.1948	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 113.716	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.G96	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.75   C 0.17   L 0.04   

	C Shift Assignments>> 	C :: 172.324	 	CA :: 46.9648	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 7.9008	 	HA2 :: 3.9218	 	HA3 :: 3.8578	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 109.038	
	Ave N Shift Values>> 	N :: 109.91(4.29)



1.N97	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	N 0.54   C 0.23   D 0.05   Y 0.04   E 0.02   F 0.02   M 0.02   

	C Shift Assignments>> 	C :: 173.111	 	CA :: 51.9718	 	CB :: 37.3228	
	Ave C Shift Values>> 	C :: 175.16(1.76) 	CA :: 53.43(1.94) 	CB :: 38.66(1.78) 	CG :: 176.61(1.33)

	H Shift Assignments>> 	H :: 8.4328	 	HA :: 4.6208	 	HB2 :: 3.3158	 	HB3 :: 2.6908	 	HD21 :: 8.0918	 	HD22 :: 7.4058	
	Ave H Shift Values>> 	H :: 8.37(0.65) 	HA :: 4.7(0.39) 	HB2 :: 2.8(0.34) 	HB3 :: 2.78(0.34) 	HD21 :: 7.27(0.52) 	HD22 :: 7.2(0.52)

	N Shift Assignments>> 	N :: 119.490	 	ND2 :: 116.123	
	Ave N Shift Values>> 	N :: 119.13(4.42) 	ND2 :: 112.83(2.6)



1.G98	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.54   L 0.17   R 0.12   C 0.1   F 0.01   D 0.01   Y 0.01   

	C Shift Assignments>> 	C :: 169.922	 	CA :: 44.6868	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 10.7648	 	HA2 :: 4.0968	 	HA3 :: 3.4538	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 112.415	
	Ave N Shift Values>> 	N :: 109.91(4.29)



1.Y99	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.5   C 0.42   G 0.07   

	HN Overlap>>	 1.E54 1.E54

	C Shift Assignments>> 	C :: 171.883	 	CA :: 55.7868	 	CB :: 42.7778	 	CD1 :: 131.470	 	CD2 :: 131.470	 	CE1 :: 116.395	
			 	CE2 :: 116.395	
	Ave C Shift Values>> 	C :: 175.39(1.89) 	CA :: 58.02(2.64) 	CB :: 39.16(2.23) 	CG :: 129.29(1.21) 	CD1 :: 132.54(1.35) 	CD2 :: 132.26(1.99)
			 	CE1 :: 117.81(2.09) 	CE2 :: 117.91(2.6) 	CZ :: 156.37(2.5)

	H Shift Assignments>> 	H :: 7.6948	 	HA :: 5.0578	 	HB2 :: 2.5608	 	HB3 :: 2.5378	 	HD1 :: 6.7708	 	HD2 :: 6.7708	
			 	HE1 :: 6.9438	 	HE2 :: 6.9438	
	Ave H Shift Values>> 	H :: 8.37(0.75) 	HA :: 4.63(0.56) 	HB2 :: 2.91(0.37) 	HB3 :: 2.91(0.37) 	HD1 :: 6.87(0.65) 	HD2 :: 6.86(0.68)
			 	HE1 :: 6.64(0.58) 	HE2 :: 6.63(0.61) 	HH :: 9.25(1.34)

	N Shift Assignments>> 	N :: 115.788	
	Ave N Shift Values>> 	N :: 120.79(4.69)



1.I100	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.68   C 0.31   

	C Shift Assignments>> 	C :: 172.814	 	CA :: 61.4788	 	CB :: 39.6218	 	CG1 :: 26.7908	 	CG2 :: 17.5398	 	CD1 :: 16.1228	
	Ave C Shift Values>> 	C :: 175.82(1.95) 	CA :: 61.59(2.78) 	CB :: 38.58(2.09) 	CG1 :: 27.65(2.32) 	CG2 :: 17.36(1.6) 	CD1 :: 13.41(1.91)

	H Shift Assignments>> 	H :: 10.2758	 	HA :: 4.7148	 	HB :: 1.9998	 	HG12 :: 1.5078	 	HG13 :: 0.6148	 	HG21 :: 1.1548	
			 	HG22 :: 1.1548	 	HG23 :: 1.1548	 	HD11 :: 0.6218	 	HD12 :: 0.6218	 	HD13 :: 0.6218	
	Ave H Shift Values>> 	H :: 8.26(0.71) 	HA :: 4.2(0.56) 	HB :: 1.8(0.31) 	HG2 :: 0.8(0.29) 	HG12 :: 1.3(0.4) 	HG13 :: 1.24(0.4)
			 	HD1 :: 0.7(0.3)

	N Shift Assignments>> 	N :: 126.892	
	Ave N Shift Values>> 	N :: 121.6(4.72)



1.S101	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.86   T 0.13   

	C Shift Assignments>> 	C :: 172.611	 	CA :: 55.3568	 	CB :: 66.6608	
	Ave C Shift Values>> 	C :: 174.53(1.73) 	CA :: 58.57(2.12) 	CB :: 63.8(1.57)

	H Shift Assignments>> 	H :: 8.9958	 	HA :: 5.0128	 	HB2 :: 4.0118	
	Ave H Shift Values>> 	H :: 8.29(0.62) 	HA :: 4.51(0.43) 	HB2 :: 3.88(0.29) 	HB3 :: 3.87(0.31) 	HG :: 5.33(1.16)

	N Shift Assignments>> 	N :: 123.234	
	Ave N Shift Values>> 	N :: 116.3(3.95)



1.A102	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	M 0.65   A 0.22   I 0.07   C 0.03   

	C Shift Assignments>> 	C :: 176.445	 	CA :: 55.9148	 	CB :: 17.7798	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 9.3348	 	HA :: 3.9268	 	HB1 :: 1.5048	 	HB2 :: 1.5048	 	HB3 :: 1.5048	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 122.755	
	Ave N Shift Values>> 	N :: 123.23(3.7)



1.A103	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	M 0.51   A 0.41   C 0.03   I 0.02   

	HN Overlap>>	 1.Y138 2.N7 1.Y138 2.N7

	C Shift Assignments>> 	C :: 178.770	 	CA :: 54.8718	 	CB :: 18.3008	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 8.3158	 	HA :: 4.0298	 	HB1 :: 1.4298	 	HB2 :: 1.4298	 	HB3 :: 1.4298	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 118.198	
	Ave N Shift Values>> 	N :: 123.23(3.7)



1.E104	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.24   C 0.23   I 0.19   F 0.18   E 0.09   M 0.01   

	C Shift Assignments>> 	C :: 176.136	 	CA :: 59.0858	 	CG :: 37.9988	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 7.9448	 	HA :: 4.0258	 	HB2 :: 1.8718	 	HG2 :: 2.6128	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 119.337	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.L105	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.6   C 0.35   R 0.02   G 0.01   

	C Shift Assignments>> 	C :: 175.538	 	CA :: 57.9358	 	CB :: 42.1528	 	CG :: 26.6848	 	CD1 :: 23.8488	 	CD2 :: 23.777	
	Ave C Shift Values>> 	C :: 176.97(2.09) 	CA :: 55.65(2.21) 	CB :: 42.37(1.86) 	CG :: 26.77(1.25) 	CD1 :: 24.73(1.71) 	CD2 :: 24.1(1.78)

	H Shift Assignments>> 	H :: 8.6268	 	HA :: 4.1598	 	HB2 :: 1.9418	 	HG :: 1.5638	 	HD11 :: 0.7698	 	HD12 :: 0.7698	
			 	HD13 :: 0.7698	 	HD21 :: 0.7538	 	HD22 :: 0.7538	 	HD23 :: 0.7538	
	Ave H Shift Values>> 	H :: 8.22(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.63(0.34) 	HB3 :: 1.57(0.36) 	HG :: 1.54(0.33) 	HD1 :: 0.77(0.27)
			 	HD2 :: 0.76(0.28)

	N Shift Assignments>> 	N :: 120.144	
	Ave N Shift Values>> 	N :: 121.98(4.07)



1.R106	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.45   C 0.37   G 0.1   K 0.05   

	HN Overlap>>	 1.N53 1.N53

	C Shift Assignments>> 	C :: 175.898	 	CA :: 59.8628	 	CB :: 30.0268	 	CG :: 27.4768	 	CD :: 43.4158	
	Ave C Shift Values>> 	C :: 176.49(2.16) 	CA :: 56.95(2.41) 	CB :: 30.66(1.77) 	CG :: 27.31(1.65) 	CD :: 43.1(1.1) 	CZ :: 159.01(0.87)

	H Shift Assignments>> 	H :: 8.7128	 	HA :: 3.8018	 	HB2 :: 1.9498	 	HB3 :: 1.7308	 	HG2 :: 1.6418	 	HD2 :: 3.2588	
			 	HD3 :: 3.1358	
	Ave H Shift Values>> 	H :: 8.24(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.79(0.28) 	HB3 :: 1.78(0.28) 	HG2 :: 1.58(0.27) 	HG3 :: 1.58(0.27)
			 	HD2 :: 3.13(0.23) 	HD3 :: 3.13(0.22) 	HE :: 7.32(0.52) 	HH11 :: 6.74(0.31) 	HH12 :: 6.75(0.32) 	HH21 :: 6.72(0.32)
			 	HH22 :: 6.72(0.33)

	N Shift Assignments>> 	N :: 117.740	
	Ave N Shift Values>> 	N :: 120.61(3.9) 	NE :: 89.8(12.83) 	NH1 :: 74.78(11.38) 	NH2 :: 75.84(11.44)



1.H107	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	H 0.38   C 0.32   W 0.28   

	C Shift Assignments>> 	C :: 175.029	 	CA :: 59.0188	 	CB :: 28.6158	 	CD2 :: 118.538	 	CE1 :: 134.929	
	Ave C Shift Values>> 	C :: 175.19(2.14) 	CA :: 56.37(2.4) 	CB :: 29.95(2.15) 	CG :: 130.59(3.41) 	CD2 :: 119.84(3.3) 	CE1 :: 136.05(3.58)

	H Shift Assignments>> 	H :: 7.8868	 	HA :: 4.3998	 	HB2 :: 3.4228	 	HB3 :: 3.3728	 	HD2 :: 7.2578	 	HE1 :: 8.5098	
	Ave H Shift Values>> 	H :: 8.25(0.74) 	HA :: 4.62(0.51) 	HB2 :: 3.12(0.43) 	HB3 :: 3.11(0.45) 	HD1 :: 10.14(3.5) 	HD2 :: 7.08(0.5)
			 	HE1 :: 8.08(0.57) 	HE2 :: 10.43(3.11)

	N Shift Assignments>> 	N :: 117.720	
	Ave N Shift Values>> 	N :: 119.44(4.52) 	ND1 :: 190.74(22.84) 	NE2 :: 179.81(13.86)



1.V108	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 :: 175.248	 	CA :: 66.5638	 	CB :: 31.5708	 	CG1 :: 23.7288	 	CG2 :: 20.5588	
	Ave C Shift Values>> 	C :: 175.69(2.03) 	CA :: 62.48(3.04) 	CB :: 32.66(1.91) 	CG1 :: 21.38(1.53) 	CG2 :: 21.31(1.76)

	H Shift Assignments>> 	H :: 8.4398	 	HA :: 3.5928	 	HB :: 2.0938	 	HG11 :: 1.0148	 	HG12 :: 1.0148	 	HG13 :: 1.0148	
			 	HG21 :: 0.4988	 	HG22 :: 0.4988	 	HG23 :: 0.4988	
	Ave H Shift Values>> 	H :: 8.29(0.71) 	HA :: 4.16(0.57) 	HB :: 1.99(0.33) 	HG1 :: 0.84(0.27) 	HG2 :: 0.83(0.29)

	N Shift Assignments>> 	N :: 119.959	
	Ave N Shift Values>> 	N :: 121.02(4.96)



1.M109	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.57   M 0.37   A 0.04   I 0.01   

	C Shift Assignments>> 	C :: 176.437	 	CA :: 57.3908	 	CB :: 29.5328	 	CG :: 32.3898	 	CE :: 16.9208	
	Ave C Shift Values>> 	C :: 176.3(2.13) 	CA :: 56.16(2.34) 	CB :: 32.9(2.23) 	CG :: 32.07(1.45) 	CE :: 17.21(3.42)

	H Shift Assignments>> 	H :: 8.4358	 	HA :: 4.2358	 	HB2 :: 2.3128	 	HG2 :: 2.7948	 	HG3 :: 2.3318	 	HE1 :: 1.8318	
			 	HE2 :: 1.8318	 	HE3 :: 1.8318	
	Ave H Shift Values>> 	H :: 8.26(0.6) 	HA :: 4.39(0.46) 	HB2 :: 2.03(0.38) 	HB3 :: 2.01(0.36) 	HG2 :: 2.44(0.36) 	HG3 :: 2.41(0.4)
			 	HE :: 1.86(0.47)

	N Shift Assignments>> 	N :: 115.295	
	Ave N Shift Values>> 	N :: 120.1(3.88)



1.T110	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.98   C 0.01   

	C Shift Assignments>> 	C :: 175.497	 	CA :: 66.5808	 	CB :: 68.5218	 	CG2 :: 21.3928	
	Ave C Shift Values>> 	C :: 174.6(1.8) 	CA :: 62.15(2.72) 	CB :: 69.64(1.7) 	CG2 :: 21.44(1.39)

	H Shift Assignments>> 	H :: 8.1258	 	HA :: 4.0568	 	HB :: 4.2578	 	HG21 :: 1.2748	 	HG22 :: 1.2748	 	HG23 :: 1.2748	
	Ave H Shift Values>> 	H :: 8.27(0.62) 	HA :: 4.48(0.5) 	HB :: 4.17(0.37) 	HG1 :: 4.4(1.92) 	HG2 :: 1.16(0.28) 	HG21 :: 1.16(0.28)
			 	HG22 :: 1.16(0.28) 	HG23 :: 1.16(0.28)

	N Shift Assignments>> 	N :: 115.318	
	Ave N Shift Values>> 	N :: 115.7(5.05)



1.N111	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.25   Y 0.2   N 0.14   F 0.13   E 0.1   D 0.07   I 0.03   M 0.02   L 0.01   

	C Shift Assignments>> 	CA :: 55.8368	 	CB :: 37.9678	
	Ave C Shift Values>> 	C :: 175.16(1.76) 	CA :: 53.43(1.94) 	CB :: 38.66(1.78) 	CG :: 176.61(1.33)

	H Shift Assignments>> 	H :: 7.9988	 	HA :: 4.4508	 	HB2 :: 2.7928	 	HD21 :: 7.5168	 	HD22 :: 6.7198	
	Ave H Shift Values>> 	H :: 8.37(0.65) 	HA :: 4.7(0.39) 	HB2 :: 2.8(0.34) 	HB3 :: 2.78(0.34) 	HD21 :: 7.27(0.52) 	HD22 :: 7.2(0.52)

	N Shift Assignments>> 	N :: 122.630	 	ND2 :: 111.625	
	Ave N Shift Values>> 	N :: 119.13(4.42) 	ND2 :: 112.83(2.6)



1.L112	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.54   C 0.24   A 0.11   R 0.06   G 0.03   

	HN Overlap>>	 1.M76 1.M76

	C Shift Assignments>> 	C :: 174.584	 	CA :: 54.8318	 	CB :: 42.5438	 	CG :: 26.2718	 	CD1 :: 25.9018	 	CD2 :: 22.0388	
	Ave C Shift Values>> 	C :: 176.97(2.09) 	CA :: 55.65(2.21) 	CB :: 42.37(1.86) 	CG :: 26.77(1.25) 	CD1 :: 24.73(1.71) 	CD2 :: 24.1(1.78)

	H Shift Assignments>> 	H :: 7.9058	 	HA :: 4.3308	 	HB2 :: 1.9378	 	HB3 :: 1.6348	 	HG :: 1.6608	 	HD11 :: 0.8158	
			 	HD12 :: 0.8158	 	HD13 :: 0.8158	 	HD21 :: 0.7718	 	HD22 :: 0.7718	 	HD23 :: 0.7718	
	Ave H Shift Values>> 	H :: 8.22(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.63(0.34) 	HB3 :: 1.57(0.36) 	HG :: 1.54(0.33) 	HD1 :: 0.77(0.27)
			 	HD2 :: 0.76(0.28)

	N Shift Assignments>> 	N :: 117.455	
	Ave N Shift Values>> 	N :: 121.98(4.07)



1.G113	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.79   C 0.08   L 0.08   R 0.02   

	C Shift Assignments>> 	C :: 171.823	 	CA :: 45.5118	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 7.9138	 	HA2 :: 4.1398	 	HA3 :: 3.7798	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 107.043	
	Ave N Shift Values>> 	N :: 109.91(4.29)



1.E114	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.28   E 0.25   M 0.18   Q 0.15   K 0.1   

	HN Overlap>>	 1.Q143 1.Q143 1.E11 1.E11

	C Shift Assignments>> 	C :: 172.814	 	CA :: 55.1648	 	CB :: 30.5298	 	CG :: 35.2058	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 7.8588	 	HA :: 4.3238	 	HB2 :: 1.7328	 	HG2 :: 2.1188	 	HG3 :: 1.9848	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 119.028	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.K115	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.42   C 0.33   R 0.18   M 0.04   

	C Shift Assignments>> 	C :: 172.455	 	CA :: 55.2348	 	CB :: 31.7618	 	CG :: 24.3778	 	CD :: 28.8418	 	CE :: 41.4828	
	Ave C Shift Values>> 	C :: 176.46(2.05) 	CA :: 56.84(2.25) 	CB :: 32.83(1.88) 	CG :: 24.91(1.31) 	CD :: 28.78(1.39) 	CE :: 41.78(0.98)

	H Shift Assignments>> 	H :: 8.6538	 	HA :: 4.3778	 	HB2 :: 1.7448	 	HB3 :: 1.6408	 	HG2 :: 1.2958	 	HD2 :: 1.6378	
			 	HE2 :: 2.9508	
	Ave H Shift Values>> 	H :: 8.22(0.64) 	HA :: 4.28(0.45) 	HB2 :: 1.79(0.25) 	HB3 :: 1.78(0.26) 	HG2 :: 1.38(0.27) 	HG3 :: 1.37(0.29)
			 	HD2 :: 1.61(0.25) 	HD3 :: 1.61(0.25) 	HE2 :: 2.93(0.2) 	HE3 :: 2.93(0.2) 	HZ :: 7.52(0.36)

	N Shift Assignments>> 	N :: 123.982	
	Ave N Shift Values>> 	N :: 121.16(4.11) 	NZ :: 71.86(52.41)



1.L116	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.51   G 0.24   C 0.2   R 0.01   A 0.01   

	C Shift Assignments>> 	C :: 175.378	 	CA :: 54.1328	 	CB :: 44.1758	 	CG :: 26.9828	 	CD1 :: 24.0658	 	CD2 :: 23.7548	
	Ave C Shift Values>> 	C :: 176.97(2.09) 	CA :: 55.65(2.21) 	CB :: 42.37(1.86) 	CG :: 26.77(1.25) 	CD1 :: 24.73(1.71) 	CD2 :: 24.1(1.78)

	H Shift Assignments>> 	H :: 8.0528	 	HA :: 4.6688	 	HB2 :: 1.5498	 	HB3 :: 1.3748	 	HG :: 0.6798	 	HD11 :: 0.6908	
			 	HD12 :: 0.6908	 	HD13 :: 0.6908	 	HD21 :: 0.6898	 	HD22 :: 0.6898	 	HD23 :: 0.6898	
	Ave H Shift Values>> 	H :: 8.22(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.63(0.34) 	HB3 :: 1.57(0.36) 	HG :: 1.54(0.33) 	HD1 :: 0.77(0.27)
			 	HD2 :: 0.76(0.28)

	N Shift Assignments>> 	N :: 124.274	
	Ave N Shift Values>> 	N :: 121.98(4.07)



1.T117	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	T 0.89   C 0.1   

	C Shift Assignments>> 	CA :: 60.9128	 	CB :: 70.9388	 	CG2 :: 21.5258	
	Ave C Shift Values>> 	C :: 174.6(1.8) 	CA :: 62.15(2.72) 	CB :: 69.64(1.7) 	CG2 :: 21.44(1.39)

	H Shift Assignments>> 	H :: 9.1258	 	HA :: 4.4238	 	HB :: 4.7248	 	HG21 :: 1.3388	 	HG22 :: 1.3388	 	HG23 :: 1.3388	
	Ave H Shift Values>> 	H :: 8.27(0.62) 	HA :: 4.48(0.5) 	HB :: 4.17(0.37) 	HG1 :: 4.4(1.92) 	HG2 :: 1.16(0.28) 	HG21 :: 1.16(0.28)
			 	HG22 :: 1.16(0.28) 	HG23 :: 1.16(0.28)

	N Shift Assignments>> 	N :: 113.635	
	Ave N Shift Values>> 	N :: 115.7(5.05)



1.D118	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.26   F 0.25   C 0.19   I 0.09   D 0.06   L 0.05   N 0.02   E 0.01   K 0.01   

	C Shift Assignments>> 	C :: 175.917	 	CA :: 57.6808	 	CB :: 39.5228	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.9128	 	HA :: 4.2238	 	HB2 :: 3.0378	 	HB3 :: 2.6168	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 120.870	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.E119	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.33   E 0.28   I 0.22   K 0.09   Q 0.04   M 0.01   

	C Shift Assignments>> 	C :: 176.438	 	CA :: 59.7978	 	CB :: 28.7848	 	CG :: 35.8818	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.6268	 	HA :: 4.1258	 	HB2 :: 2.3388	 	HB3 :: 2.0548	 	HG2 :: 2.3498	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 118.815	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.E120	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.45   I 0.3   E 0.21   M 0.02   

	HN Overlap>>	 2.A6 2.A6

	C Shift Assignments>> 	C :: 176.259	 	CA :: 59.5158	 	CB :: 30.8308	 	CG :: 38.2848	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 7.7748	 	HA :: 3.9208	 	HB2 :: 2.1208	 	HG2 :: 2.3668	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 120.193	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.V121	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.94   C 0.05   

	C Shift Assignments>> 	C :: 175.276	 	CA :: 66.8298	 	CB :: 31.1878	 	CG1 :: 23.3228	 	CG2 :: 21.8348	
	Ave C Shift Values>> 	C :: 175.69(2.03) 	CA :: 62.48(3.04) 	CB :: 32.66(1.91) 	CG1 :: 21.38(1.53) 	CG2 :: 21.31(1.76)

	H Shift Assignments>> 	H :: 8.0268	 	HA :: 3.5098	 	HB :: 2.1848	 	HG11 :: 0.8808	 	HG12 :: 0.8808	 	HG13 :: 0.8808	
			 	HG21 :: 0.9418	 	HG22 :: 0.9418	 	HG23 :: 0.9418	
	Ave H Shift Values>> 	H :: 8.29(0.71) 	HA :: 4.16(0.57) 	HB :: 1.99(0.33) 	HG1 :: 0.84(0.27) 	HG2 :: 0.83(0.29)

	N Shift Assignments>> 	N :: 121.619	
	Ave N Shift Values>> 	N :: 121.02(4.96)



1.D122	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.25   Y 0.23   C 0.17   D 0.08   L 0.08   I 0.06   K 0.05   N 0.02   

	C Shift Assignments>> 	C :: 176.327	 	CA :: 57.5188	 	CB :: 40.0848	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.1848	 	HA :: 4.3648	 	HB2 :: 2.7908	 	HB3 :: 2.6998	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 119.587	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.E123	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.35   C 0.34   I 0.18   K 0.05   M 0.04   Q 0.02   

	HN Overlap>>	 1.E83 1.E83

	C Shift Assignments>> 	C :: 175.641	 	CA :: 59.3828	 	CB :: 30.1128	 	CG :: 36.4218	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.1898	 	HA :: 3.9668	 	HB2 :: 2.2938	 	HG2 :: 2.4258	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 119.238	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.M124	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.66   M 0.25   I 0.08   

	C Shift Assignments>> 	C :: 177.098	 	CA :: 60.6858	 	CB :: 33.3538	 	CE :: 14.9908	
	Ave C Shift Values>> 	C :: 176.3(2.13) 	CA :: 56.16(2.34) 	CB :: 32.9(2.23) 	CG :: 32.07(1.45) 	CE :: 17.21(3.42)

	H Shift Assignments>> 	H :: 7.7708	 	HA :: 3.9128	 	HB2 :: 1.8458	 	HG2 :: 2.7888	 	HE1 :: 0.6608	 	HE2 :: 0.6608	
			 	HE3 :: 0.6608	
	Ave H Shift Values>> 	H :: 8.26(0.6) 	HA :: 4.39(0.46) 	HB2 :: 2.03(0.38) 	HB3 :: 2.01(0.36) 	HG2 :: 2.44(0.36) 	HG3 :: 2.41(0.4)
			 	HE :: 1.86(0.47)

	N Shift Assignments>> 	N :: 118.205	
	Ave N Shift Values>> 	N :: 120.1(3.88)



1.I125	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.53   I 0.46   

	C Shift Assignments>> 	CA :: 63.0148	 	CB :: 35.5488	 	CG1 :: 26.9728	 	CG2 :: 16.4428	 	CD1 :: 9.4738	
	Ave C Shift Values>> 	C :: 175.82(1.95) 	CA :: 61.59(2.78) 	CB :: 38.58(2.09) 	CG1 :: 27.65(2.32) 	CG2 :: 17.36(1.6) 	CD1 :: 13.41(1.91)

	H Shift Assignments>> 	H :: 7.8768	 	HA :: 3.8498	 	HB :: 2.3988	 	HG12 :: 1.7318	 	HG13 :: 1.4938	 	HG21 :: 0.8108	
			 	HG22 :: 0.8108	 	HG23 :: 0.8108	 	HD11 :: 0.8248	 	HD12 :: 0.8248	 	HD13 :: 0.8248	
	Ave H Shift Values>> 	H :: 8.26(0.71) 	HA :: 4.2(0.56) 	HB :: 1.8(0.31) 	HG2 :: 0.8(0.29) 	HG12 :: 1.3(0.4) 	HG13 :: 1.24(0.4)
			 	HD1 :: 0.7(0.3)

	N Shift Assignments>> 	N :: 119.224	
	Ave N Shift Values>> 	N :: 121.6(4.72)



1.R126	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.44   C 0.37   G 0.1   K 0.08   

	HN Overlap>>	 1.S81 1.S81

	C Shift Assignments>> 	C :: 176.484	 	CA :: 59.5788	 	CB :: 30.2498	 	CG :: 27.9058	 	CD :: 43.4668	
	Ave C Shift Values>> 	C :: 176.49(2.16) 	CA :: 56.95(2.41) 	CB :: 30.66(1.77) 	CG :: 27.31(1.65) 	CD :: 43.1(1.1) 	CZ :: 159.01(0.87)

	H Shift Assignments>> 	H :: 8.5118	 	HA :: 4.0908	 	HB2 :: 1.8898	 	HG2 :: 1.8238	 	HG3 :: 1.6708	 	HD2 :: 3.2478	
	Ave H Shift Values>> 	H :: 8.24(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.79(0.28) 	HB3 :: 1.78(0.28) 	HG2 :: 1.58(0.27) 	HG3 :: 1.58(0.27)
			 	HD2 :: 3.13(0.23) 	HD3 :: 3.13(0.22) 	HE :: 7.32(0.52) 	HH11 :: 6.74(0.31) 	HH12 :: 6.75(0.32) 	HH21 :: 6.72(0.32)
			 	HH22 :: 6.72(0.33)

	N Shift Assignments>> 	N :: 117.057	
	Ave N Shift Values>> 	N :: 120.61(3.9) 	NE :: 89.8(12.83) 	NH1 :: 74.78(11.38) 	NH2 :: 75.84(11.44)



1.E127	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	E 0.36   C 0.35   I 0.16   K 0.04   M 0.04   Q 0.01   

	C Shift Assignments>> 	C :: 174.423	 	CA :: 58.8898	 	CB :: 30.1128	 	CG :: 36.6448	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.2808	 	HA :: 4.0608	 	HB2 :: 2.3078	 	HG2 :: 2.4958	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 115.021	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.A128	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.72   M 0.14   L 0.06   C 0.05   

	C Shift Assignments>> 	C :: 174.788	 	CA :: 51.6648	 	CB :: 20.8668	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 7.2248	 	HA :: 4.3508	 	HB1 :: 1.2118	 	HB2 :: 1.2118	 	HB3 :: 1.2118	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 116.627	
	Ave N Shift Values>> 	N :: 123.23(3.7)



1.N129	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.28   N 0.17   L 0.13   C 0.13   F 0.1   Y 0.09   K 0.05   

	C Shift Assignments>> 	C :: 172.792	 	CA :: 54.3598	 	CB :: 40.3068	
	Ave C Shift Values>> 	C :: 175.16(1.76) 	CA :: 53.43(1.94) 	CB :: 38.66(1.78) 	CG :: 176.61(1.33)

	H Shift Assignments>> 	H :: 7.8978	 	HA :: 4.4838	 	HB2 :: 2.8958	 	HB3 :: 2.5088	
	Ave H Shift Values>> 	H :: 8.37(0.65) 	HA :: 4.7(0.39) 	HB2 :: 2.8(0.34) 	HB3 :: 2.78(0.34) 	HD21 :: 7.27(0.52) 	HD22 :: 7.2(0.52)

	N Shift Assignments>> 	N :: 117.321	
	Ave N Shift Values>> 	N :: 119.13(4.42) 	ND2 :: 112.83(2.6)



1.I130	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	I 0.83   C 0.16   

	C Shift Assignments>> 	C :: 175.157	 	CA :: 63.2378	 	CB :: 38.5768	 	CG1 :: 27.6178	 	CG2 :: 17.2438	 	CD1 :: 12.3058	
	Ave C Shift Values>> 	C :: 175.82(1.95) 	CA :: 61.59(2.78) 	CB :: 38.58(2.09) 	CG1 :: 27.65(2.32) 	CG2 :: 17.36(1.6) 	CD1 :: 13.41(1.91)

	H Shift Assignments>> 	H :: 8.2758	 	HA :: 3.8998	 	HB :: 1.9548	 	HG12 :: 1.6528	 	HG13 :: 1.2608	 	HG21 :: 0.9198	
			 	HG22 :: 0.9198	 	HG23 :: 0.9198	 	HD11 :: 0.8608	 	HD12 :: 0.8608	 	HD13 :: 0.8608	
	Ave H Shift Values>> 	H :: 8.26(0.71) 	HA :: 4.2(0.56) 	HB :: 1.8(0.31) 	HG2 :: 0.8(0.29) 	HG12 :: 1.3(0.4) 	HG13 :: 1.24(0.4)
			 	HD1 :: 0.7(0.3)

	N Shift Assignments>> 	N :: 127.388	
	Ave N Shift Values>> 	N :: 121.6(4.72)



1.D131	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.29   N 0.22   C 0.13   L 0.11   F 0.09   Y 0.09   K 0.03   

	C Shift Assignments>> 	C :: 175.047	 	CA :: 54.0058	 	CB :: 40.0758	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.4118	 	HA :: 4.5008	 	HB2 :: 3.0488	 	HB3 :: 2.6358	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 116.226	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.G132	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.71   C 0.2   L 0.03   A 0.01   P 0.01   

	C Shift Assignments>> 	C :: 172.439	 	CA :: 47.2278	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 7.6768	 	HA2 :: 3.9908	 	HA3 :: 3.8608	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 108.352	
	Ave N Shift Values>> 	N :: 109.91(4.29)



1.D133	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	D 0.28   N 0.23   C 0.13   L 0.1   F 0.09   Y 0.09   K 0.02   

	C Shift Assignments>> 	C :: 174.740	 	CA :: 53.9868	 	CB :: 39.9928	
	Ave C Shift Values>> 	C :: 176.41(1.77) 	CA :: 54.52(2.1) 	CB :: 40.7(1.67) 	CG :: 178.41(1.84)

	H Shift Assignments>> 	H :: 8.4278	 	HA :: 4.4988	 	HB2 :: 2.9688	 	HB3 :: 2.5268	
	Ave H Shift Values>> 	H :: 8.33(0.57) 	HA :: 4.61(0.31) 	HB2 :: 2.74(0.29) 	HB3 :: 2.7(0.29)

	N Shift Assignments>> 	N :: 120.564	
	Ave N Shift Values>> 	N :: 120.73(4.2)



1.G134	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	G 0.79   C 0.08   L 0.08   R 0.02   

	C Shift Assignments>> 	C :: 169.860	 	CA :: 45.5158	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 10.3178	 	HA2 :: 4.0688	 	HA3 :: 3.4518	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 112.342	
	Ave N Shift Values>> 	N :: 109.91(4.29)



1.Q135	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	M 0.5   C 0.35   Q 0.1   E 0.02   K 0.02   

	C Shift Assignments>> 	C :: 172.149	 	CA :: 53.2138	 	CB :: 32.3578	 	CG :: 33.0208	
	Ave C Shift Values>> 	C :: 176.39(1.96) 	CA :: 56.62(2.19) 	CB :: 29.1(1.97) 	CG :: 33.72(1.1) 	CD :: 179.68(1.17)

	H Shift Assignments>> 	H :: 7.9788	 	HA :: 4.9768	 	HB2 :: 1.7268	 	HG2 :: 2.0118	 	HG3 :: 1.6658	 	HE21 :: 6.5038	
			 	HE22 :: 5.9758	
	Ave H Shift Values>> 	H :: 8.22(0.62) 	HA :: 4.28(0.44) 	HB2 :: 2.05(0.28) 	HB3 :: 2.04(0.29) 	HG2 :: 2.32(0.29) 	HG3 :: 2.32(0.29)
			 	HE21 :: 7.17(0.46) 	HE22 :: 7.07(0.49)

	N Shift Assignments>> 	N :: 114.483	 	NE2 :: 108.133	
	Ave N Shift Values>> 	N :: 119.92(4.01) 	NE2 :: 111.81(2.2)



1.V136	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.82   C 0.13   I 0.02   L 0.01   

	C Shift Assignments>> 	C :: 172.968	 	CA :: 61.6478	 	CG1 :: 23.0538	 	CG2 :: 21.0718	
	Ave C Shift Values>> 	C :: 175.69(2.03) 	CA :: 62.48(3.04) 	CB :: 32.66(1.91) 	CG1 :: 21.38(1.53) 	CG2 :: 21.31(1.76)

	H Shift Assignments>> 	H :: 9.1448	 	HA :: 5.2068	 	HB :: 2.3778	 	HG11 :: 1.1408	 	HG12 :: 1.1408	 	HG13 :: 1.1408	
			 	HG21 :: 1.0668	 	HG22 :: 1.0668	 	HG23 :: 1.0668	
	Ave H Shift Values>> 	H :: 8.29(0.71) 	HA :: 4.16(0.57) 	HB :: 1.99(0.33) 	HG1 :: 0.84(0.27) 	HG2 :: 0.83(0.29)

	N Shift Assignments>> 	N :: 124.979	
	Ave N Shift Values>> 	N :: 121.02(4.96)



1.N137	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	N 0.6   C 0.19   D 0.11   Y 0.03   F 0.02   L 0.01   

	C Shift Assignments>> 	C :: 171.857	 	CA :: 50.7558	 	CB :: 38.3368	
	Ave C Shift Values>> 	C :: 175.16(1.76) 	CA :: 53.43(1.94) 	CB :: 38.66(1.78) 	CG :: 176.61(1.33)

	H Shift Assignments>> 	H :: 9.6288	 	HA :: 5.3468	 	HB2 :: 3.1808	 	HD21 :: 7.5038	 	HD22 :: 7.3288	
	Ave H Shift Values>> 	H :: 8.37(0.65) 	HA :: 4.7(0.39) 	HB2 :: 2.8(0.34) 	HB3 :: 2.78(0.34) 	HD21 :: 7.27(0.52) 	HD22 :: 7.2(0.52)

	N Shift Assignments>> 	N :: 128.916	 	ND2 :: 111.858	
	Ave N Shift Values>> 	N :: 119.13(4.42) 	ND2 :: 112.83(2.6)



1.Y138	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.62   Y 0.37   

	HN Overlap>>	 1.A103 1.A103 2.N7 2.N7

	C Shift Assignments>> 	C :: 173.214	 	CA :: 62.0288	 	CB :: 37.5368	 	CD1 :: 130.347	 	CD2 :: 130.347	 	CE1 :: 116.007	
			 	CE2 :: 116.007	
	Ave C Shift Values>> 	C :: 175.39(1.89) 	CA :: 58.02(2.64) 	CB :: 39.16(2.23) 	CG :: 129.29(1.21) 	CD1 :: 132.54(1.35) 	CD2 :: 132.26(1.99)
			 	CE1 :: 117.81(2.09) 	CE2 :: 117.91(2.6) 	CZ :: 156.37(2.5)

	H Shift Assignments>> 	H :: 8.3428	 	HA :: 3.2258	 	HB2 :: 2.3428	 	HB3 :: 2.0148	 	HD1 :: 6.2598	 	HD2 :: 6.2598	
			 	HE1 :: 6.4808	 	HE2 :: 6.4808	
	Ave H Shift Values>> 	H :: 8.37(0.75) 	HA :: 4.63(0.56) 	HB2 :: 2.91(0.37) 	HB3 :: 2.91(0.37) 	HD1 :: 6.87(0.65) 	HD2 :: 6.86(0.68)
			 	HE1 :: 6.64(0.58) 	HE2 :: 6.63(0.61) 	HH :: 9.25(1.34)

	N Shift Assignments>> 	N :: 118.187	
	Ave N Shift Values>> 	N :: 120.79(4.69)



1.E139	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.29   E 0.21   I 0.13   Y 0.1   V 0.06   M 0.04   F 0.04   K 0.04   Q 0.01   

	HN Overlap>>	 1.E84 1.E84

	C Shift Assignments>> 	C :: 177.373	 	CA :: 59.7578	 	CG :: 35.8908	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.0338	 	HA :: 3.5918	 	HB2 :: 2.0058	 	HG2 :: 2.3258	 	HG3 :: 2.2958	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 117.957	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.E140	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.37   E 0.29   I 0.27   K 0.03   

	C Shift Assignments>> 	C :: 176.476	 	CA :: 58.5078	 	CB :: 28.8998	 	CG :: 37.4508	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.7048	 	HA :: 3.8288	 	HB2 :: 2.1588	 	HB3 :: 1.9918	 	HG2 :: 2.8448	 	HG3 :: 2.3648	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 119.391	
	Ave N Shift Values>> 	N :: 120.68(3.68)



1.F141	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	F 0.49   C 0.29   Y 0.2   

	C Shift Assignments>> 	C :: 173.478	 	CA :: 61.5828	 	CB :: 39.8728	 	CD1 :: 129.982	 	CD2 :: 129.982	 	CE1 :: 129.459	
			 	CE2 :: 129.466	
	Ave C Shift Values>> 	C :: 175.49(2.13) 	CA :: 58.25(2.73) 	CB :: 39.95(2.04) 	CG :: 138.35(1.12) 	CD1 :: 131.38(1.38) 	CD2 :: 131.33(1.48)
			 	CE1 :: 130.48(1.29) 	CE2 :: 130.6(0.97) 	CZ :: 129.11(1.68)

	H Shift Assignments>> 	H :: 8.4738	 	HA :: 3.3988	 	HB2 :: 3.2698	 	HB3 :: 2.8878	 	HD1 :: 6.6488	 	HD2 :: 6.6488	
			 	HE1 :: 7.0578	 	HE2 :: 7.0578	 	HZ :: 8.5208	
	Ave H Shift Values>> 	H :: 8.42(0.74) 	HA :: 4.62(0.58) 	HB2 :: 2.99(0.37) 	HB3 :: 2.97(0.38) 	HD1 :: 6.91(0.82) 	HD2 :: 6.89(0.86)
			 	HE1 :: 6.95(0.82) 	HE2 :: 6.94(0.86) 	HZ :: 6.92(0.8)

	N Shift Assignments>> 	N :: 123.444	
	Ave N Shift Values>> 	N :: 120.69(4.18)



1.V142	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.95   C 0.03   

	C Shift Assignments>> 	C :: 176.735	 	CA :: 66.8108	 	CB :: 31.3188	 	CG1 :: 21.1198	 	CG2 :: 22.8868	
	Ave C Shift Values>> 	C :: 175.69(2.03) 	CA :: 62.48(3.04) 	CB :: 32.66(1.91) 	CG1 :: 21.38(1.53) 	CG2 :: 21.31(1.76)

	H Shift Assignments>> 	H :: 8.6118	 	HA :: 2.9608	 	HB :: 1.7098	 	HG11 :: 0.6598	 	HG12 :: 0.6598	 	HG13 :: 0.6598	
			 	HG21 :: 0.4038	 	HG22 :: 0.4038	 	HG23 :: 0.4038	
	Ave H Shift Values>> 	H :: 8.29(0.71) 	HA :: 4.16(0.57) 	HB :: 1.99(0.33) 	HG1 :: 0.84(0.27) 	HG2 :: 0.83(0.29)

	N Shift Assignments>> 	N :: 118.366	
	Ave N Shift Values>> 	N :: 121.02(4.96)



1.Q143	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.29   K 0.23   Q 0.23   R 0.09   E 0.08   I 0.02   M 0.01   

	HN Overlap>>	 1.E114 1.E11 1.E114 1.E11

	C Shift Assignments>> 	CA :: 58.7918	 	CB :: 27.9958	 	CG :: 33.7228	
	Ave C Shift Values>> 	C :: 176.39(1.96) 	CA :: 56.62(2.19) 	CB :: 29.1(1.97) 	CG :: 33.72(1.1) 	CD :: 179.68(1.17)

	H Shift Assignments>> 	H :: 7.8028	 	HA :: 3.7798	 	HB2 :: 2.0018	 	HG2 :: 2.3288	 	HE21 :: 7.3518	 	HE22 :: 6.7088	
	Ave H Shift Values>> 	H :: 8.22(0.62) 	HA :: 4.28(0.44) 	HB2 :: 2.05(0.28) 	HB3 :: 2.04(0.29) 	HG2 :: 2.32(0.29) 	HG3 :: 2.32(0.29)
			 	HE21 :: 7.17(0.46) 	HE22 :: 7.07(0.49)

	N Shift Assignments>> 	N :: 119.002	 	NE2 :: 111.126	
	Ave N Shift Values>> 	N :: 119.92(4.01) 	NE2 :: 111.81(2.2)



1.M144	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.45   M 0.42   I 0.06   A 0.04   

	C Shift Assignments>> 	C :: 173.938	 	CA :: 56.4348	 	CG :: 30.6068	 	CE :: 16.0918	
	Ave C Shift Values>> 	C :: 176.3(2.13) 	CA :: 56.16(2.34) 	CB :: 32.9(2.23) 	CG :: 32.07(1.45) 	CE :: 17.21(3.42)

	H Shift Assignments>> 	H :: 7.3888	 	HA :: 4.1898	 	HB2 :: 1.4298	 	HG2 :: 1.6998	 	HE1 :: 1.6808	 	HE2 :: 1.6808	
			 	HE3 :: 1.6808	
	Ave H Shift Values>> 	H :: 8.26(0.6) 	HA :: 4.39(0.46) 	HB2 :: 2.03(0.38) 	HB3 :: 2.01(0.36) 	HG2 :: 2.44(0.36) 	HG3 :: 2.41(0.4)
			 	HE :: 1.86(0.47)

	N Shift Assignments>> 	N :: 116.678	
	Ave N Shift Values>> 	N :: 120.1(3.88)



1.M145	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	M 0.41   C 0.32   A 0.25   

	C Shift Assignments>> 	C :: 174.791	 	CA :: 55.0798	 	CB :: 32.0368	 	CG :: 32.2298	 	CE :: 18.1958	
	Ave C Shift Values>> 	C :: 176.3(2.13) 	CA :: 56.16(2.34) 	CB :: 32.9(2.23) 	CG :: 32.07(1.45) 	CE :: 17.21(3.42)

	H Shift Assignments>> 	H :: 7.3048	 	HA :: 4.0238	 	HB2 :: 1.4938	 	HB3 :: 1.1088	 	HG2 :: 1.4608	 	HG3 :: 1.3398	
			 	HE1 :: 1.1438	 	HE2 :: 1.1438	 	HE3 :: 1.1438	
	Ave H Shift Values>> 	H :: 8.26(0.6) 	HA :: 4.39(0.46) 	HB2 :: 2.03(0.38) 	HB3 :: 2.01(0.36) 	HG2 :: 2.44(0.36) 	HG3 :: 2.41(0.4)
			 	HE :: 1.86(0.47)

	N Shift Assignments>> 	N :: 112.325	
	Ave N Shift Values>> 	N :: 120.1(3.88)



1.T146	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 :: 171.522	 	CA :: 61.8998	 	CB :: 70.5428	 	CG2 :: 21.1358	
	Ave C Shift Values>> 	C :: 174.6(1.8) 	CA :: 62.15(2.72) 	CB :: 69.64(1.7) 	CG2 :: 21.44(1.39)

	H Shift Assignments>> 	H :: 7.4728	 	HA :: 4.2518	 	HB :: 4.1468	 	HG21 :: 1.0658	 	HG22 :: 1.0658	 	HG23 :: 1.0658	
	Ave H Shift Values>> 	H :: 8.27(0.62) 	HA :: 4.48(0.5) 	HB :: 4.17(0.37) 	HG1 :: 4.4(1.92) 	HG2 :: 1.16(0.28) 	HG21 :: 1.16(0.28)
			 	HG22 :: 1.16(0.28) 	HG23 :: 1.16(0.28)

	N Shift Assignments>> 	N :: 108.155	
	Ave N Shift Values>> 	N :: 115.7(5.05)



1.A147	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.76   M 0.19   C 0.02   

	C Shift Assignments>> 	C :: 174.107	 	CA :: 52.4268	 	CB :: 19.0508	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 7.8608	 	HA :: 4.3328	 	HB1 :: 1.3908	 	HB2 :: 1.3908	 	HB3 :: 1.3908	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 126.675	
	Ave N Shift Values>> 	N :: 123.23(3.7)



1.K148	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	K 0.4   C 0.29   L 0.17   R 0.11   

	C Shift Assignments>> 	CA :: 57.6978	 	CG :: 24.7878	 	CD :: 28.8568	 	CE :: 41.6988	
	Ave C Shift Values>> 	C :: 176.46(2.05) 	CA :: 56.84(2.25) 	CB :: 32.83(1.88) 	CG :: 24.91(1.31) 	CD :: 28.78(1.39) 	CE :: 41.78(0.98)

	H Shift Assignments>> 	H :: 8.0078	 	HA :: 4.0798	 	HB2 :: 1.7998	 	HB3 :: 1.7308	 	HG2 :: 1.3938	 	HD2 :: 1.6478	
			 	HE2 :: 2.9868	
	Ave H Shift Values>> 	H :: 8.22(0.64) 	HA :: 4.28(0.45) 	HB2 :: 1.79(0.25) 	HB3 :: 1.78(0.26) 	HG2 :: 1.38(0.27) 	HG3 :: 1.37(0.29)
			 	HD2 :: 1.61(0.25) 	HD3 :: 1.61(0.25) 	HE2 :: 2.93(0.2) 	HE3 :: 2.93(0.2) 	HZ :: 7.52(0.36)

	N Shift Assignments>> 	N :: 126.400	
	Ave N Shift Values>> 	N :: 121.16(4.11) 	NZ :: 71.86(52.41)



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




2.S2	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.96   C 0.03   

	HN Overlap>>	 2.R10 2.R10

	C Shift Assignments>> 	C :: 172.550	 	CA :: 55.709	 	CB :: 61.137	
	Ave C Shift Values>> 	C :: 174.53(1.73) 	CA :: 58.57(2.12) 	CB :: 63.8(1.57)

	H Shift Assignments>> 	H :: 8.193	 	HB2 :: 3.879	
	Ave H Shift Values>> 	H :: 8.29(0.62) 	HA :: 4.51(0.43) 	HB2 :: 3.88(0.29) 	HB3 :: 3.87(0.31) 	HG :: 5.33(1.16)

	N Shift Assignments>> 	N :: 120.637	
	Ave N Shift Values>> 	N :: 116.3(3.95)



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

	PRTL>>	L 0.44   K 0.26   C 0.25   R 0.01   M 0.01   

	C Shift Assignments>> 	C :: 174.192	 	CA :: 55.993	 	CB :: 27.411	 	CG :: 23.675	
	Ave C Shift Values>> 	C :: 176.49(2.16) 	CA :: 56.95(2.41) 	CB :: 30.66(1.77) 	CG :: 27.31(1.65) 	CD :: 43.1(1.1) 	CZ :: 159.01(0.87)

	H Shift Assignments>> 	H :: 8.654	 	HA :: 3.838	 	HG2 :: 1.546	
	Ave H Shift Values>> 	H :: 8.24(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.79(0.28) 	HB3 :: 1.78(0.28) 	HG2 :: 1.58(0.27) 	HG3 :: 1.58(0.27)
			 	HD2 :: 3.13(0.23) 	HD3 :: 3.13(0.22) 	HE :: 7.32(0.52) 	HH11 :: 6.74(0.31) 	HH12 :: 6.75(0.32) 	HH21 :: 6.72(0.32)
			 	HH22 :: 6.72(0.33)

	N Shift Assignments>> 	N :: 125.365	
	Ave N Shift Values>> 	N :: 120.61(3.9) 	NE :: 89.8(12.83) 	NH1 :: 74.78(11.38) 	NH2 :: 75.84(11.44)



2.A4	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.5   M 0.47   C 0.01   

	C Shift Assignments>> 	C :: 176.557	 	CA :: 52.358	 	CB :: 15.958	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 8.193	 	HA :: 4.164	 	HB1 :: 1.353	 	HB2 :: 1.353	 	HB3 :: 1.353	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 120.862	
	Ave N Shift Values>> 	N :: 123.23(3.7)



2.K5	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.42   C 0.4   L 0.12   K 0.04   

	HN Overlap>>	 2.Q20 2.Q20

	C Shift Assignments>> 	C :: 175.175	 	CA :: 56.959	 	CB :: 28.819	 	CD :: 26.742	
	Ave C Shift Values>> 	C :: 176.46(2.05) 	CA :: 56.84(2.25) 	CB :: 32.83(1.88) 	CG :: 24.91(1.31) 	CD :: 28.78(1.39) 	CE :: 41.78(0.98)

	H Shift Assignments>> 	H :: 7.9	 	HA :: 4.185	 	HB2 :: 1.895	 	HB3 :: 1.863	
	Ave H Shift Values>> 	H :: 8.22(0.64) 	HA :: 4.28(0.45) 	HB2 :: 1.79(0.25) 	HB3 :: 1.78(0.26) 	HG2 :: 1.38(0.27) 	HG3 :: 1.37(0.29)
			 	HD2 :: 1.61(0.25) 	HD3 :: 1.61(0.25) 	HE2 :: 2.93(0.2) 	HE3 :: 2.93(0.2) 	HZ :: 7.52(0.36)

	N Shift Assignments>> 	N :: 118.064	
	Ave N Shift Values>> 	N :: 121.16(4.11) 	NZ :: 71.86(52.41)



2.A6	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	M 0.66   A 0.3   C 0.01   

	HN Overlap>>	 1.E120 1.E120

	C Shift Assignments>> 	C :: 178.002	 	CA :: 52.15	 	CB :: 14.865	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 7.778	 	HA :: 4.06	 	HB1 :: 1.444	 	HB2 :: 1.444	 	HB3 :: 1.444	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 120.253	
	Ave N Shift Values>> 	N :: 123.23(3.7)



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

	PRTL>>	C 0.34   M 0.16   N 0.16   E 0.1   K 0.07   Q 0.05   Y 0.03   F 0.01   H 0.01   

	HN Overlap>>	 1.A103 1.Y138 1.A103 1.Y138

	C Shift Assignments>> 	C :: 175.009	 	CA :: 53.033	 	CB :: 35.5	
	Ave C Shift Values>> 	C :: 175.16(1.76) 	CA :: 53.43(1.94) 	CB :: 38.66(1.78) 	CG :: 176.61(1.33)

	H Shift Assignments>> 	H :: 8.372	 	HA :: 4.459	 	HB2 :: 2.858	 	HB3 :: 2.683	
	Ave H Shift Values>> 	H :: 8.37(0.65) 	HA :: 4.7(0.39) 	HB2 :: 2.8(0.34) 	HB3 :: 2.78(0.34) 	HD21 :: 7.27(0.52) 	HD22 :: 7.2(0.52)

	N Shift Assignments>> 	N :: 118.243	
	Ave N Shift Values>> 	N :: 119.13(4.42) 	ND2 :: 112.83(2.6)



2.W8	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.5   H 0.32   W 0.16   

	C Shift Assignments>> 	C :: 175.578	 	CA :: 58.19	 	CB :: 26.538	 	CD1 :: 128.771	
	Ave C Shift Values>> 	C :: 176.1(1.89) 	CA :: 57.71(2.65) 	CB :: 30.16(2.19) 	CG :: 110.37(1.55) 	CD1 :: 126.16(1.76) 	CD2 :: 127.4(1.33)
			 	CE2 :: 137.38(2.86) 	CE3 :: 120.38(1.5) 	CZ2 :: 114.19(1.09) 	CZ3 :: 121.57(1.76) 	CH2 :: 123.75(1.34)

	H Shift Assignments>> 	H :: 8.533	 	HA :: 4.203	 	HB2 :: 3.382	 	HB3 :: 2.867	 	HD1 :: 7.313	 	HE1 :: 10.381	
			 	HZ2 :: 7.128	 	HH2 :: 6.987	
	Ave H Shift Values>> 	H :: 8.35(0.84) 	HA :: 4.74(0.55) 	HB2 :: 3.22(0.36) 	HB3 :: 3.18(0.36) 	HD1 :: 7.16(0.34) 	HE1 :: 10.13(0.53)
			 	HE3 :: 7.17(1.03) 	HZ2 :: 7.14(0.89) 	HZ3 :: 6.68(1.02) 	HH2 :: 6.82(0.94)

	N Shift Assignments>> 	N :: 121.805	 	NE1 :: 129.285	
	Ave N Shift Values>> 	N :: 121.87(4.58) 	NE1 :: 129.48(2.56)



2.L9	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.79   A 0.19   

	C Shift Assignments>> 	C :: 176.568	 	CA :: 55.499	 	CB :: 38.641	 	CG :: 23.208	 	CD1 :: 21.682	
	Ave C Shift Values>> 	C :: 176.97(2.09) 	CA :: 55.65(2.21) 	CB :: 42.37(1.86) 	CG :: 26.77(1.25) 	CD1 :: 24.73(1.71) 	CD2 :: 24.1(1.78)

	H Shift Assignments>> 	H :: 8.264	 	HA :: 4.172	 	HB2 :: 1.841	 	HB3 :: 1.6	 	HG :: 1.785	 	HD11 :: 0.881	
			 	HD12 :: 0.881	 	HD13 :: 0.881	 	HD21 :: 0.886	 	HD22 :: 0.886	 	HD23 :: 0.886	
	Ave H Shift Values>> 	H :: 8.22(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.63(0.34) 	HB3 :: 1.57(0.36) 	HG :: 1.54(0.33) 	HD1 :: 0.77(0.27)
			 	HD2 :: 0.76(0.28)

	N Shift Assignments>> 	N :: 118.722	
	Ave N Shift Values>> 	N :: 121.98(4.07)



2.R10	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.41   K 0.27   C 0.27   R 0.01   

	HN Overlap>>	 2.S2 2.S2

	C Shift Assignments>> 	C :: 175.900	 	CA :: 56.888	 	CB :: 27.368	 	CG :: 23.738	
	Ave C Shift Values>> 	C :: 176.49(2.16) 	CA :: 56.95(2.41) 	CB :: 30.66(1.77) 	CG :: 27.31(1.65) 	CD :: 43.1(1.1) 	CZ :: 159.01(0.87)

	H Shift Assignments>> 	H :: 8.264	 	HA :: 4.128	 	HB2 :: 1.927	 	HG2 :: 0.882	 	HD2 :: 3.251	
	Ave H Shift Values>> 	H :: 8.24(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.79(0.28) 	HB3 :: 1.78(0.28) 	HG2 :: 1.58(0.27) 	HG3 :: 1.58(0.27)
			 	HD2 :: 3.13(0.23) 	HD3 :: 3.13(0.22) 	HE :: 7.32(0.52) 	HH11 :: 6.74(0.31) 	HH12 :: 6.75(0.32) 	HH21 :: 6.72(0.32)
			 	HH22 :: 6.72(0.33)

	N Shift Assignments>> 	N :: 120.684	
	Ave N Shift Values>> 	N :: 120.61(3.9) 	NE :: 89.8(12.83) 	NH1 :: 74.78(11.38) 	NH2 :: 75.84(11.44)



2.A11	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.48   M 0.48   C 0.01   

	C Shift Assignments>> 	C :: 175.888	 	CA :: 52.558	 	CB :: 16.041	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 8.067	 	HA :: 3.978	 	HB1 :: 1.584	 	HB2 :: 1.584	 	HB3 :: 1.584	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 121.482	
	Ave N Shift Values>> 	N :: 123.23(3.7)



2.F12	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	Y 0.36   C 0.34   F 0.28   

	C Shift Assignments>> 	C :: 173.951	 	CA :: 58.326	 	CB :: 37.668	 	CE1 :: 129.841	 	CE2 :: 129.841	
	Ave C Shift Values>> 	C :: 175.49(2.13) 	CA :: 58.25(2.73) 	CB :: 39.95(2.04) 	CG :: 138.35(1.12) 	CD1 :: 131.38(1.38) 	CD2 :: 131.33(1.48)
			 	CE1 :: 130.48(1.29) 	CE2 :: 130.6(0.97) 	CZ :: 129.11(1.68)

	H Shift Assignments>> 	H :: 9.052	 	HA :: 4.35	 	HB2 :: 3.418	 	HB3 :: 3.354	 	HD1 :: 7.082	 	HD2 :: 7.082	
			 	HE1 :: 7.157	 	HE2 :: 7.157	
	Ave H Shift Values>> 	H :: 8.42(0.74) 	HA :: 4.62(0.58) 	HB2 :: 2.99(0.37) 	HB3 :: 2.97(0.38) 	HD1 :: 6.91(0.82) 	HD2 :: 6.89(0.86)
			 	HE1 :: 6.95(0.82) 	HE2 :: 6.94(0.86) 	HZ :: 6.92(0.8)

	N Shift Assignments>> 	N :: 117.615	
	Ave N Shift Values>> 	N :: 120.69(4.18)



2.N13	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.31   M 0.18   E 0.12   N 0.1   K 0.09   Q 0.08   Y 0.03   H 0.01   W 0.01   F 0.01   

	C Shift Assignments>> 	C :: 174.785	 	CA :: 53.709	 	CB :: 35.325	
	Ave C Shift Values>> 	C :: 175.16(1.76) 	CA :: 53.43(1.94) 	CB :: 38.66(1.78) 	CG :: 176.61(1.33)

	H Shift Assignments>> 	H :: 8.602	 	HA :: 4.166	 	HB2 :: 2.95	 	HB3 :: 2.703	
	Ave H Shift Values>> 	H :: 8.37(0.65) 	HA :: 4.7(0.39) 	HB2 :: 2.8(0.34) 	HB3 :: 2.78(0.34) 	HD21 :: 7.27(0.52) 	HD22 :: 7.2(0.52)

	N Shift Assignments>> 	N :: 116.425	
	Ave N Shift Values>> 	N :: 119.13(4.42) 	ND2 :: 112.83(2.6)



2.K14	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.87   K 0.03   A 0.03   L 0.02   V 0.02   M 0.01   

	C Shift Assignments>> 	C :: 176.194	 	CA :: 57.174	 	CB :: 30.526	 	CG :: 22.045	 	CD :: 26.002	
	Ave C Shift Values>> 	C :: 176.46(2.05) 	CA :: 56.84(2.25) 	CB :: 32.83(1.88) 	CG :: 24.91(1.31) 	CD :: 28.78(1.39) 	CE :: 41.78(0.98)

	H Shift Assignments>> 	H :: 8.076	 	HA :: 4.045	 	HB2 :: 2.01	 	HB3 :: 1.839	 	HG2 :: 1.681	 	HG3 :: 1.4	
			 	HD2 :: 1.681	 	HD3 :: 1.617	 	HE2 :: 2.928	
	Ave H Shift Values>> 	H :: 8.22(0.64) 	HA :: 4.28(0.45) 	HB2 :: 1.79(0.25) 	HB3 :: 1.78(0.26) 	HG2 :: 1.38(0.27) 	HG3 :: 1.37(0.29)
			 	HD2 :: 1.61(0.25) 	HD3 :: 1.61(0.25) 	HE2 :: 2.93(0.2) 	HE3 :: 2.93(0.2) 	HZ :: 7.52(0.36)

	N Shift Assignments>> 	N :: 119.958	
	Ave N Shift Values>> 	N :: 121.16(4.11) 	NZ :: 71.86(52.41)



2.V15	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	V 0.6   C 0.39   

	C Shift Assignments>> 	C :: 174.970	 	CA :: 64.19	 	CB :: 28.483	 	CG1 :: 22.436	 	CG2 :: 19.422	
	Ave C Shift Values>> 	C :: 175.69(2.03) 	CA :: 62.48(3.04) 	CB :: 32.66(1.91) 	CG1 :: 21.38(1.53) 	CG2 :: 21.31(1.76)

	H Shift Assignments>> 	H :: 8.41	 	HA :: 3.532	 	HB :: 2.218	 	HG11 :: 0.938	 	HG12 :: 0.938	 	HG13 :: 0.938	
			 	HG21 :: 0.839	 	HG22 :: 0.839	 	HG23 :: 0.839	
	Ave H Shift Values>> 	H :: 8.29(0.71) 	HA :: 4.16(0.57) 	HB :: 1.99(0.33) 	HG1 :: 0.84(0.27) 	HG2 :: 0.83(0.29)

	N Shift Assignments>> 	N :: 121.488	
	Ave N Shift Values>> 	N :: 121.02(4.96)



2.R16	Overall: Mistyped 	Typing: Mistyped 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.47   L 0.45   K 0.04   A 0.02   

	HN Overlap>>	 1.L69 1.L69

	C Shift Assignments>> 	C :: 175.887	 	CA :: 56.805	 	CB :: 26.506	 	CG :: 22.439	 	CD :: 40.184	
	Ave C Shift Values>> 	C :: 176.49(2.16) 	CA :: 56.95(2.41) 	CB :: 30.66(1.77) 	CG :: 27.31(1.65) 	CD :: 43.1(1.1) 	CZ :: 159.01(0.87)

	H Shift Assignments>> 	H :: 8.639	 	HA :: 3.763	 	HB2 :: 1.565	 	HG2 :: 1.335	 	HG3 :: 1.207	 	HD2 :: 3.333	
			 	HD3 :: 2.98	
	Ave H Shift Values>> 	H :: 8.24(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.79(0.28) 	HB3 :: 1.78(0.28) 	HG2 :: 1.58(0.27) 	HG3 :: 1.58(0.27)
			 	HD2 :: 3.13(0.23) 	HD3 :: 3.13(0.22) 	HE :: 7.32(0.52) 	HH11 :: 6.74(0.31) 	HH12 :: 6.75(0.32) 	HH21 :: 6.72(0.32)
			 	HH22 :: 6.72(0.33)

	N Shift Assignments>> 	N :: 119.209	
	Ave N Shift Values>> 	N :: 120.61(3.9) 	NE :: 89.8(12.83) 	NH1 :: 74.78(11.38) 	NH2 :: 75.84(11.44)



2.M17	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.54   M 0.31   I 0.1   A 0.04   

	HN Overlap>>	 2.R23 2.W33 2.R23 2.W33

	C Shift Assignments>> 	C :: 175.604	 	CA :: 55.673	 	CB :: 29.324	 	CE :: 14.99	
	Ave C Shift Values>> 	C :: 176.3(2.13) 	CA :: 56.16(2.34) 	CB :: 32.9(2.23) 	CG :: 32.07(1.45) 	CE :: 17.21(3.42)

	H Shift Assignments>> 	H :: 7.701	 	HA :: 4.105	 	HB2 :: 2.115	 	HB3 :: 2.1	 	HG2 :: 2.186	 	HE1 :: 2.509	
			 	HE2 :: 2.509	 	HE3 :: 2.509	
	Ave H Shift Values>> 	H :: 8.26(0.6) 	HA :: 4.39(0.46) 	HB2 :: 2.03(0.38) 	HB3 :: 2.01(0.36) 	HG2 :: 2.44(0.36) 	HG3 :: 2.41(0.4)
			 	HE :: 1.86(0.47)

	N Shift Assignments>> 	N :: 117.427	
	Ave N Shift Values>> 	N :: 120.1(3.88)



2.Q18	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.37   K 0.36   R 0.15   M 0.08   V 0.01   

	C Shift Assignments>> 	C :: 175.931	 	CA :: 55.976	 	CB :: 24.407	 	CG :: 31.276	
	Ave C Shift Values>> 	C :: 176.39(1.96) 	CA :: 56.62(2.19) 	CB :: 29.1(1.97) 	CG :: 33.72(1.1) 	CD :: 179.68(1.17)

	H Shift Assignments>> 	H :: 7.733	 	HA :: 4.049	 	HB2 :: 2.142	 	HB3 :: 2.084	 	HG2 :: 2.438	 	HG3 :: 2.262	
	Ave H Shift Values>> 	H :: 8.22(0.62) 	HA :: 4.28(0.44) 	HB2 :: 2.05(0.28) 	HB3 :: 2.04(0.29) 	HG2 :: 2.32(0.29) 	HG3 :: 2.32(0.29)
			 	HE21 :: 7.17(0.46) 	HE22 :: 7.07(0.49)

	N Shift Assignments>> 	N :: 119.752	
	Ave N Shift Values>> 	N :: 119.92(4.01) 	NE2 :: 111.81(2.2)



2.L19	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.43   A 0.42   L 0.13   

	C Shift Assignments>> 	C :: 176.150	 	CA :: 54.386	 	CB :: 39.047	 	CG :: 25.563	 	CD1 :: 24.762	 	CD2 :: 20.787	
	Ave C Shift Values>> 	C :: 176.97(2.09) 	CA :: 55.65(2.21) 	CB :: 42.37(1.86) 	CG :: 26.77(1.25) 	CD1 :: 24.73(1.71) 	CD2 :: 24.1(1.78)

	H Shift Assignments>> 	H :: 8.151	 	HA :: 4.013	 	HB2 :: 1.871	 	HB3 :: 1.371	 	HG :: 1.78	 	HD11 :: 0.733	
			 	HD12 :: 0.733	 	HD13 :: 0.733	 	HD21 :: 0.718	 	HD22 :: 0.718	 	HD23 :: 0.718	
	Ave H Shift Values>> 	H :: 8.22(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.63(0.34) 	HB3 :: 1.57(0.36) 	HG :: 1.54(0.33) 	HD1 :: 0.77(0.27)
			 	HD2 :: 0.76(0.28)

	N Shift Assignments>> 	N :: 120.063	
	Ave N Shift Values>> 	N :: 121.98(4.07)



2.Q20	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.33   K 0.32   R 0.27   M 0.04   Q 0.01   

	HN Overlap>>	 2.K5 2.K5

	C Shift Assignments>> 	C :: 175.284	 	CA :: 55.365	 	CB :: 25.474	 	CG :: 31.233	
	Ave C Shift Values>> 	C :: 176.39(1.96) 	CA :: 56.62(2.19) 	CB :: 29.1(1.97) 	CG :: 33.72(1.1) 	CD :: 179.68(1.17)

	H Shift Assignments>> 	H :: 7.911	 	HA :: 3.98	 	HB2 :: 2.33	 	HB3 :: 2.078	 	HG2 :: 2.412	 	HG3 :: 2.337	
	Ave H Shift Values>> 	H :: 8.22(0.62) 	HA :: 4.28(0.44) 	HB2 :: 2.05(0.28) 	HB3 :: 2.04(0.29) 	HG2 :: 2.32(0.29) 	HG3 :: 2.32(0.29)
			 	HE21 :: 7.17(0.46) 	HE22 :: 7.07(0.49)

	N Shift Assignments>> 	N :: 118.054	
	Ave N Shift Values>> 	N :: 119.92(4.01) 	NE2 :: 111.81(2.2)



2.E21	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.37   Q 0.25   K 0.19   R 0.09   E 0.05   M 0.01   I 0.01   

	C Shift Assignments>> 	C :: 174.854	 	CA :: 55.49	 	CB :: 26.666	 	CG :: 34.168	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 7.975	 	HA :: 4.016	 	HB2 :: 2.012	 	HG2 :: 2.31	 	HG3 :: 2.184	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 119.803	
	Ave N Shift Values>> 	N :: 120.68(3.68)



2.A22	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.69   M 0.28   C 0.01   

	C Shift Assignments>> 	C :: 175.491	 	CA :: 50.517	 	CB :: 15.961	
	Ave C Shift Values>> 	C :: 177.8(2.18) 	CA :: 53.16(2.06) 	CB :: 18.9(1.85)

	H Shift Assignments>> 	H :: 7.726	 	HA :: 4.19	 	HB1 :: 1.385	 	HB2 :: 1.385	 	HB3 :: 1.385	
	Ave H Shift Values>> 	H :: 8.2(0.6) 	HA :: 4.26(0.42) 	HB :: 1.38(0.25)

	N Shift Assignments>> 	N :: 121.648	
	Ave N Shift Values>> 	N :: 123.23(3.7)



2.R23	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.49   K 0.26   C 0.21   

	HN Overlap>>	 2.W33 2.M17 2.W33 2.M17

	C Shift Assignments>> 	C :: 174.086	 	CA :: 53.836	 	CB :: 27.401	 	CG :: 24.527	 	CD :: 40.823	
	Ave C Shift Values>> 	C :: 176.49(2.16) 	CA :: 56.95(2.41) 	CB :: 30.66(1.77) 	CG :: 27.31(1.65) 	CD :: 43.1(1.1) 	CZ :: 159.01(0.87)

	H Shift Assignments>> 	H :: 7.645	 	HA :: 4.211	 	HB2 :: 1.834	 	HG2 :: 1.678	 	HG3 :: 1.617	 	HD2 :: 3.135	
	Ave H Shift Values>> 	H :: 8.24(0.6) 	HA :: 4.27(0.44) 	HB2 :: 1.79(0.28) 	HB3 :: 1.78(0.28) 	HG2 :: 1.58(0.27) 	HG3 :: 1.58(0.27)
			 	HD2 :: 3.13(0.23) 	HD3 :: 3.13(0.22) 	HE :: 7.32(0.52) 	HH11 :: 6.74(0.31) 	HH12 :: 6.75(0.32) 	HH21 :: 6.72(0.32)
			 	HH22 :: 6.72(0.33)

	N Shift Assignments>> 	N :: 117.484	
	Ave N Shift Values>> 	N :: 120.61(3.9) 	NE :: 89.8(12.83) 	NH1 :: 74.78(11.38) 	NH2 :: 75.84(11.44)



2.G24	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	L 0.31   R 0.18   K 0.16   D 0.09   C 0.07   F 0.07   Y 0.04   I 0.02   G 0.01   N 0.01   

	C Shift Assignments>> 	C :: 171.195	 	CA :: 42.457	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 7.961	 	HA2 :: 3.909	 	HA3 :: 3.909	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 107.622	
	Ave N Shift Values>> 	N :: 109.91(4.29)



2.E25	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.32   Q 0.25   K 0.21   R 0.14   M 0.02   E 0.02   

	HN Overlap>>	 1.D78 1.D78

	C Shift Assignments>> 	C :: 174.077	 	CA :: 53.78	 	CB :: 27.272	 	CG :: 33.333	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.163	 	HA :: 4.269	 	HB2 :: 2.049	 	HB3 :: 1.889	 	HG2 :: 2.202	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 120.497	
	Ave N Shift Values>> 	N :: 120.68(3.68)



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

	PRTL>>	L 0.31   R 0.19   K 0.15   D 0.09   C 0.07   F 0.07   Y 0.04   I 0.02   G 0.01   N 0.01   

	C Shift Assignments>> 	C :: 171.213	 	CA :: 42.485	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 8.35	 	HA2 :: 3.902	 	HA3 :: 3.902	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 108.85	
	Ave N Shift Values>> 	N :: 109.91(4.29)



2.E27	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.33   Q 0.24   K 0.2   R 0.16   M 0.02   E 0.02   

	HN Overlap>>	 1.D78 1.D78

	C Shift Assignments>> 	C :: 174.078	 	CA :: 54.039	 	CB :: 27.066	 	CG :: 33.267	
	Ave C Shift Values>> 	C :: 176.93(2.11) 	CA :: 57.42(2.19) 	CB :: 30.07(1.84) 	CG :: 36.01(1.51) 	CD :: 181.94(1.85)

	H Shift Assignments>> 	H :: 8.142	 	HA :: 4.132	 	HB2 :: 2.027	 	HB3 :: 1.911	 	HG2 :: 2.201	
	Ave H Shift Values>> 	H :: 8.34(0.61) 	HA :: 4.26(0.43) 	HB2 :: 2.04(0.22) 	HB3 :: 2.04(0.23) 	HG2 :: 2.31(0.21) 	HG3 :: 2.31(0.21)

	N Shift Assignments>> 	N :: 120.369	
	Ave N Shift Values>> 	N :: 120.68(3.68)



2.M28	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.63   M 0.29   A 0.07   

	C Shift Assignments>> 	C :: 173.796	 	CA :: 53.324	 	CB :: 29.849	 	CG :: 33.966	 	CE :: 14.43	
	Ave C Shift Values>> 	C :: 176.3(2.13) 	CA :: 56.16(2.34) 	CB :: 32.9(2.23) 	CG :: 32.07(1.45) 	CE :: 17.21(3.42)

	H Shift Assignments>> 	H :: 8.348	 	HA :: 4.175	 	HB2 :: 2.022	 	HB3 :: 1.948	 	HG3 :: 2.176	 	HE1 :: 2.052	
			 	HE2 :: 2.052	 	HE3 :: 2.052	
	Ave H Shift Values>> 	H :: 8.26(0.6) 	HA :: 4.39(0.46) 	HB2 :: 2.03(0.38) 	HB3 :: 2.01(0.36) 	HG2 :: 2.44(0.36) 	HG3 :: 2.41(0.4)
			 	HE :: 1.86(0.47)

	N Shift Assignments>> 	N :: 120.436	
	Ave N Shift Values>> 	N :: 120.1(3.88)



2.S29	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.94   C 0.05   

	C Shift Assignments>> 	C :: 171.585	 	CA :: 56.067	 	CB :: 60.603	
	Ave C Shift Values>> 	C :: 174.53(1.73) 	CA :: 58.57(2.12) 	CB :: 63.8(1.57)

	H Shift Assignments>> 	H :: 8.125	 	HA :: 4.338	 	HB2 :: 4.12	 	HB3 :: 3.842	
	Ave H Shift Values>> 	H :: 8.29(0.62) 	HA :: 4.51(0.43) 	HB2 :: 3.88(0.29) 	HB3 :: 3.87(0.31) 	HG :: 5.33(1.16)

	N Shift Assignments>> 	N :: 115.589	
	Ave N Shift Values>> 	N :: 116.3(3.95)



2.K30	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.64   A 0.25   L 0.04   R 0.02   M 0.01   K 0.01   

	C Shift Assignments>> 	C :: 173.803	 	CA :: 53.958	 	CB :: 30.005	 	CG :: 22.144	 	CD :: 26.823	 	CE :: 39.61	
	Ave C Shift Values>> 	C :: 176.46(2.05) 	CA :: 56.84(2.25) 	CB :: 32.83(1.88) 	CG :: 24.91(1.31) 	CD :: 28.78(1.39) 	CE :: 41.78(0.98)

	H Shift Assignments>> 	H :: 7.986	 	HA :: 4.22	 	HB2 :: 1.706	 	HB3 :: 1.596	 	HG2 :: 1.275	 	HE2 :: 2.837	
	Ave H Shift Values>> 	H :: 8.22(0.64) 	HA :: 4.28(0.45) 	HB2 :: 1.79(0.25) 	HB3 :: 1.78(0.26) 	HG2 :: 1.38(0.27) 	HG3 :: 1.37(0.29)
			 	HD2 :: 1.61(0.25) 	HD3 :: 1.61(0.25) 	HE2 :: 2.93(0.2) 	HE3 :: 2.93(0.2) 	HZ :: 7.52(0.36)

	N Shift Assignments>> 	N :: 122.255	
	Ave N Shift Values>> 	N :: 121.16(4.11) 	NZ :: 71.86(52.41)



2.S31	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	S 0.96   C 0.03   

	C Shift Assignments>> 	C :: 171.460	 	CA :: 55.826	 	CB :: 61.064	
	Ave C Shift Values>> 	C :: 174.53(1.73) 	CA :: 58.57(2.12) 	CB :: 63.8(1.57)

	H Shift Assignments>> 	H :: 7.972	 	HA :: 3.676	 	HB2 :: 3.806	 	HB3 :: 3.744	
	Ave H Shift Values>> 	H :: 8.29(0.62) 	HA :: 4.51(0.43) 	HB2 :: 3.88(0.29) 	HB3 :: 3.87(0.31) 	HG :: 5.33(1.16)

	N Shift Assignments>> 	N :: 114.856	
	Ave N Shift Values>> 	N :: 116.3(3.95)



2.L32	Overall: Mistyped 	Typing: Mistyped 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.73   C 0.26   

	C Shift Assignments>> 	C :: 174.074	 	CA :: 53.057	 	CB :: 39.082	 	CD1 :: 20.626	 	CD2 :: 18.346	
	Ave C Shift Values>> 	C :: 176.97(2.09) 	CA :: 55.65(2.21) 	CB :: 42.37(1.86) 	CG :: 26.77(1.25) 	CD1 :: 24.73(1.71) 	CD2 :: 24.1(1.78)

	H Shift Assignments>> 	H :: 8.017	 	HA :: 4.3	 	HB2 :: 1.427	 	HB3 :: 1.272	 	HG :: 1.426	 	HD11 :: 0.733	
			 	HD12 :: 0.733	 	HD13 :: 0.733	 	HD21 :: 0.689	 	HD22 :: 0.689	 	HD23 :: 0.689	
	Ave H Shift Values>> 	H :: 8.22(0.65) 	HA :: 4.32(0.47) 	HB2 :: 1.63(0.34) 	HB3 :: 1.57(0.36) 	HG :: 1.54(0.33) 	HD1 :: 0.77(0.27)
			 	HD2 :: 0.76(0.28)

	N Shift Assignments>> 	N :: 123.172	
	Ave N Shift Values>> 	N :: 121.98(4.07)



2.W33	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.5   H 0.42   W 0.06   

	HN Overlap>>	 2.R23 2.R23 2.M17 2.M17

	C Shift Assignments>> 	C :: 172.511	 	CA :: 53.958	 	CB :: 26.283	 	CD1 :: 129.291	
	Ave C Shift Values>> 	C :: 176.1(1.89) 	CA :: 57.71(2.65) 	CB :: 30.16(2.19) 	CG :: 110.37(1.55) 	CD1 :: 126.16(1.76) 	CD2 :: 127.4(1.33)
			 	CE2 :: 137.38(2.86) 	CE3 :: 120.38(1.5) 	CZ2 :: 114.19(1.09) 	CZ3 :: 121.57(1.76) 	CH2 :: 123.75(1.34)

	H Shift Assignments>> 	H :: 7.636	 	HA :: 4.124	 	HB2 :: 2.964	 	HB3 :: 2.925	 	HD1 :: 7.073	 	HE1 :: 9.797	
			 	HZ2 :: 7.204	 	HH2 :: 7.075	
	Ave H Shift Values>> 	H :: 8.35(0.84) 	HA :: 4.74(0.55) 	HB2 :: 3.22(0.36) 	HB3 :: 3.18(0.36) 	HD1 :: 7.16(0.34) 	HE1 :: 10.13(0.53)
			 	HE3 :: 7.17(1.03) 	HZ2 :: 7.14(0.89) 	HZ3 :: 6.68(1.02) 	HH2 :: 6.82(0.94)

	N Shift Assignments>> 	N :: 117.409	 	NE1 :: 130.113	
	Ave N Shift Values>> 	N :: 121.87(4.58) 	NE1 :: 129.48(2.56)



2.F34	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	C 0.51   Y 0.29   F 0.17   H 0.01   

	C Shift Assignments>> 	C :: 172.418	 	CA :: 55.014	 	CB :: 36.68	 	CE1 :: 129.98	 	CE2 :: 129.98	
	Ave C Shift Values>> 	C :: 175.49(2.13) 	CA :: 58.25(2.73) 	CB :: 39.95(2.04) 	CG :: 138.35(1.12) 	CD1 :: 131.38(1.38) 	CD2 :: 131.33(1.48)
			 	CE1 :: 130.48(1.29) 	CE2 :: 130.6(0.97) 	CZ :: 129.11(1.68)

	H Shift Assignments>> 	H :: 7.377	 	HA :: 4.325	 	HB2 :: 2.844	 	HD1 :: 7.05	 	HD2 :: 7.05	 	HE1 :: 6.986	
			 	HE2 :: 6.986	 	HZ :: 7.242	
	Ave H Shift Values>> 	H :: 8.42(0.74) 	HA :: 4.62(0.58) 	HB2 :: 2.99(0.37) 	HB3 :: 2.97(0.38) 	HD1 :: 6.91(0.82) 	HD2 :: 6.89(0.86)
			 	HE1 :: 6.95(0.82) 	HE2 :: 6.94(0.86) 	HZ :: 6.92(0.8)

	N Shift Assignments>> 	N :: 119.308	
	Ave N Shift Values>> 	N :: 120.69(4.18)



2.K35	Overall: Mistyped 	Typing: Mistyped 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	A 0.53   C 0.43   M 0.01   L 0.01   R 0.01   

	C Shift Assignments>> 	C :: 172.483	 	CA :: 53.521	 	CB :: 30.222	 	CG :: 20.917	 	CD :: 26.208	 	CE :: 39.534	
	Ave C Shift Values>> 	C :: 176.46(2.05) 	CA :: 56.84(2.25) 	CB :: 32.83(1.88) 	CG :: 24.91(1.31) 	CD :: 28.78(1.39) 	CE :: 41.78(0.98)

	H Shift Assignments>> 	H :: 7.864	 	HA :: 4.195	 	HB2 :: 1.759	 	HB3 :: 1.595	 	HG2 :: 1.297	 	HD2 :: 1.611	
			 	HE2 :: 2.902	
	Ave H Shift Values>> 	H :: 8.22(0.64) 	HA :: 4.28(0.45) 	HB2 :: 1.79(0.25) 	HB3 :: 1.78(0.26) 	HG2 :: 1.38(0.27) 	HG3 :: 1.37(0.29)
			 	HD2 :: 1.61(0.25) 	HD3 :: 1.61(0.25) 	HE2 :: 2.93(0.2) 	HE3 :: 2.93(0.2) 	HZ :: 7.52(0.36)

	N Shift Assignments>> 	N :: 123.484	
	Ave N Shift Values>> 	N :: 121.16(4.11) 	NZ :: 71.86(52.41)



2.G36	Overall: Consistent 	Typing: Consistent 	SRO: Consistent 	C Shifts: Consistent 	H Shifts: Consistent 	N Shifts: Consistent

	PRTL>>	R 0.37   L 0.27   G 0.08   C 0.08   D 0.04   K 0.04   F 0.04   Y 0.02   

	C Shift Assignments>> 	C :: 175.656	 	CA :: 43.436	
	Ave C Shift Values>> 	C :: 174.04(1.94) 	CA :: 45.33(1.42)

	H Shift Assignments>> 	H :: 7.381	 	HA2 :: 3.647	 	HA3 :: 3.647	
	Ave H Shift Values>> 	H :: 8.34(0.74) 	HA2 :: 3.95(0.4) 	HA3 :: 3.93(0.4)

	N Shift Assignments>> 	N :: 115.197	
	Ave N Shift Values>> 	N :: 109.91(4.29)



3.CA1 Overall Status: Residue type CA not supported.





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

Overall Results:

	      #Consistent: 180      #Clerical:   0      #Suspicious:   1      #Anomalous:   0      #Mistyped:   3      #Indeterminable:   0


Typing Results:

	      #Consistent: 172      #Suspicious:   0      #Mistyped:   3      #Indeterminable:   9


Shift Relative Order (SRO) Results:

	      #Consistent: 184      #Suspicious:   0


C Shift Results:

	      #Consistent: 665      #Duplicate:   0      #Unknown:   0      #Suspicious:   1      #Anomalous:   0


H Shift Results:

	      #Consistent:1105      #Duplicate:   0      #Unknown:   0      #Suspicious:   0      #Anomalous:   0


N Shift Results:

	      #Consistent: 191      #Duplicate:   0      #Unknown:   0      #Suspicious:   0      #Anomalous:   0



Error Summary:

1.F89	CE2 = 126.947(S),	 Expected = 130.60, Std = 0.9700, ChiSquare = 1.6590e-04
2.R16	Typing: Mistyped
2.L32	Typing: Mistyped
2.K35	Typing: Mistyped