Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.M1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.66 C 0.28 A 0.02 G 0.01 C Shift Assignments>> C :: 176.9460 CA :: 55.1730 CB :: 42.3980 CG :: 26.8970 CD1 :: 23.3920 CD2 :: 23.3920 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> HA :: 4.3880 HB2 :: 1.5890 HB3 :: 1.5890 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) 1.A3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.89 M 0.07 C 0.01 C Shift Assignments>> C :: 176.8630 CA :: 52.1770 CB :: 19.3960 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2150 HA :: 4.2760 HB1 :: 1.2670 HB2 :: 1.2670 HB3 :: 1.2670 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.3380 Ave N Shift Values>> N :: 123.23(3.54) 1.F4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.4 F 0.39 C 0.19 C Shift Assignments>> C :: 175.1730 CA :: 57.7160 CB :: 39.8560 CD1 :: 132.2310 CD2 :: 132.2310 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.9330 HA :: 4.5370 HB2 :: 2.9960 HB3 :: 2.9960 HD1 :: 7.1820 HD2 :: 7.1820 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 119.0800 Ave N Shift Values>> N :: 120.45(4.18) 1.F5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.41 F 0.39 C 0.19 C Shift Assignments>> C :: 174.9640 CA :: 57.3580 CB :: 39.7620 CD1 :: 132.3250 CD2 :: 132.3250 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.8970 HA :: 4.5720 HB2 :: 2.9650 HB3 :: 3.1320 HD1 :: 7.1970 HD2 :: 7.1970 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 121.4010 Ave N Shift Values>> N :: 120.45(4.18) 1.A6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.88 M 0.08 C 0.01 C Shift Assignments>> C :: 177.4110 CA :: 52.5360 CB :: 19.3940 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.9880 HA :: 4.3260 HB1 :: 1.4030 HB2 :: 1.4030 HB3 :: 1.4030 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.1550 Ave N Shift Values>> N :: 123.23(3.54) 1.T7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.91 C 0.08 C Shift Assignments>> C :: 174.1590 CA :: 61.8990 CB :: 69.7740 CG2 :: 21.1040 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.9080 HA :: 4.2900 HB :: 4.2440 HG21 :: 1.2410 HG22 :: 1.2410 HG23 :: 1.2410 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 113.0160 Ave N Shift Values>> N :: 115.42(4.75) 1.R8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.15 H 0.15 C 0.12 W 0.12 E 0.11 M 0.11 Q 0.1 K 0.08 HN Overlap>> 1.Q131 1.Q131 C Shift Assignments>> C :: 175.7150 CA :: 56.0660 CB :: 30.9390 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.2480 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 123.5800 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.V9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.65 C 0.34 C Shift Assignments>> C :: 175.9330 CA :: 62.1880 CB :: 32.5960 CG1 :: 20.7150 CG2 :: 20.7150 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> HA :: 4.1410 HB :: 2.0380 HG11 :: 0.9130 HG12 :: 0.9130 HG13 :: 0.9130 HG21 :: 0.9290 HG22 :: 0.9290 HG23 :: 0.9290 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) 1.I10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.65 C 0.34 C Shift Assignments>> C :: 175.9440 CA :: 60.5300 CB :: 38.5250 CG1 :: 26.8960 CG2 :: 17.2590 CD1 :: 12.6110 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.2250 HA :: 4.2250 HB :: 1.8730 HG12 :: 1.1920 HG13 :: 1.4710 HG21 :: 0.8930 HG22 :: 0.8930 HG23 :: 0.8930 HD11 :: 0.8660 HD12 :: 0.8660 HD13 :: 0.8660 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 125.6220 Ave N Shift Values>> N :: 121.46(4.28) 1.S11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 173.2990 CA :: 57.7670 CB :: 63.8460 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.2140 HA :: 4.4430 HB2 :: 3.7860 HB3 :: 3.7860 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 120.4680 Ave N Shift Values>> N :: 116.28(3.52) 1.A12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.92 M 0.06 C Shift Assignments>> C :: 174.6230 CA :: 50.3220 CB :: 18.4250 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1200 HA :: 4.5090 HB1 :: 1.2650 HB2 :: 1.2650 HB3 :: 1.2650 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 127.0990 Ave N Shift Values>> N :: 123.23(3.54) 1.P13 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Indeterminable PRTL>> P 0.65 C 0.34 C Shift Assignments>> C :: 175.9220 CA :: 62.3380 CB :: 30.7380 CG :: 27.1890 CD :: 50.4060 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.1550 HB2 :: 0.4480(S) HB3 :: 1.5650 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.K14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.5 C 0.41 R 0.07 C Shift Assignments>> C :: 177.1360 CA :: 56.3550 CB :: 33.8390 CG :: 24.7060 CD :: 28.8920 CE :: 41.9370 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.5490 HA :: 4.1680 HB2 :: 1.7740 HB3 :: 1.7740 HG2 :: 1.3090 HG3 :: 1.4680 HD2 :: 1.6880 HD3 :: 1.6880 HE2 :: 2.9850 HE3 :: 2.9850 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.0950 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.71 C 0.28 C Shift Assignments>> C :: 177.0930 CA :: 62.8910 CB :: 31.9430 CG1 :: 21.9810 CG2 :: 21.9810 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.5640 HA :: 4.3060 HB :: 2.1480 HG11 :: 1.1070 HG12 :: 1.1070 HG13 :: 1.1070 HG21 :: 1.0040 HG22 :: 1.0040 HG23 :: 1.0040 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 125.1250 Ave N Shift Values>> N :: 121.14(4.54) 1.T16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.85 C 0.14 C Shift Assignments>> C :: 174.7510 CA :: 61.6350 CB :: 68.9700 CG2 :: 22.3210 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 9.0840 HA :: 4.4390 HB :: 4.6880 HG21 :: 1.1220 HG22 :: 1.1220 HG23 :: 1.1220 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 118.1690 Ave N Shift Values>> N :: 115.42(4.75) 1.K17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.6 K 0.24 R 0.08 G 0.04 A 0.01 C Shift Assignments>> C :: 174.5730 CA :: 54.0990 CB :: 36.8670 CG :: 24.5120 CD :: 27.9190 CE :: 42.3750 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.5010 HA :: 4.8260 HB2 :: 1.7890 HB3 :: 1.7390 HG2 :: 1.4530 HG3 :: 1.5540 HD2 :: 1.7270 HD3 :: 1.7270 HE2 :: 3.0550 HE3 :: 3.0550 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 121.0560 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K18 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.53 R 0.24 K 0.21 C Shift Assignments>> C :: 175.7820 CA :: 55.1540 CB :: 36.9170 CG :: 25.3880 CD :: 29.7990 CE :: 41.8450 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.0510 HA :: 5.8370(S) HB2 :: 1.8040 HB3 :: 1.8040 HG2 :: 1.4540 HG3 :: 1.2980 HD2 :: 1.6160 HD3 :: 1.6140 HE2 :: 2.8820 HE3 :: 2.8820 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 121.9230 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.82 V 0.17 C Shift Assignments>> C :: 173.8090 CA :: 58.8720 CB :: 36.4150 CG1 :: 21.9100 CG2 :: 22.4120 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.7630 HA :: 5.3980 HB :: 2.8150 HG11 :: 1.0430 HG12 :: 1.0430 HG13 :: 1.0430 HG21 :: 1.0160 HG22 :: 1.0160 HG23 :: 1.0160 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 113.5630 Ave N Shift Values>> N :: 121.14(4.54) 1.F20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.32 L 0.3 D 0.08 F 0.06 G 0.05 C 0.05 K 0.05 Y 0.04 HN Overlap>> 1.S89 1.S89 C Shift Assignments>> C :: 172.9110 CA :: 55.9270 CB :: 43.4550 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.8610 HA :: 6.0490 HB2 :: 2.7470 HB3 :: 3.0840 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 116.3010 Ave N Shift Values>> N :: 120.45(4.18) 1.F21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.77 C 0.18 F 0.01 Y 0.01 C Shift Assignments>> C :: 175.7760 CA :: 52.9500 CB :: 43.6430 CD1 :: 129.2830 CD2 :: 129.2830 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 9.2480 HA :: 5.5370 HB2 :: 3.3480 HB3 :: 3.3480 HD1 :: 7.4060 HD2 :: 7.4060 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 115.2980 Ave N Shift Values>> N :: 120.45(4.18) 1.K22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.51 C 0.4 R 0.07 C Shift Assignments>> C :: 175.5920 CA :: 56.0770 CB :: 33.8460 CG :: 25.0170 CD :: 29.0320 CE :: 41.7030 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.1270 HA :: 5.1770 HB2 :: 1.7160 HB3 :: 2.0070 HG2 :: 1.5690 HG3 :: 1.5690 HD2 :: 1.7430 HD3 :: 1.7430 HE2 :: 2.8860 HE3 :: 2.8860 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.3390 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.61 I 0.29 A 0.08 C Shift Assignments>> C :: 175.6510 CA :: 57.2450 CB :: 37.9160 CG1 :: 26.4470 CG2 :: 17.5390 CD1 :: 10.7100 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.8980 HA :: 5.1220 HB :: 2.0440 HG12 :: 1.3070 HG13 :: 1.8410 HG21 :: 0.7760 HG22 :: 0.7760 HG23 :: 0.7760 HD11 :: 0.9510 HD12 :: 0.9510 HD13 :: 0.9510 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 125.1430 Ave N Shift Values>> N :: 121.46(4.28) 1.S24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 T 0.01 C Shift Assignments>> C :: 173.8760 CA :: 55.8890 CB :: 65.6860 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.1670 HA :: 5.4820 HB2 :: 3.5950 HB3 :: 3.5950 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 121.9760 Ave N Shift Values>> N :: 116.28(3.52) 1.I25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.63 C 0.36 HN Overlap>> 1.I177 1.I177 C Shift Assignments>> C :: 176.4450 CA :: 60.8250 CB :: 39.6110 CG1 :: 28.1620 CG2 :: 17.3080 CD1 :: 13.5300 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.9090 HA :: 4.7690 HB :: 1.7330 HG12 :: 1.4960 HG13 :: 1.7150 HG21 :: 0.6850 HG22 :: 0.6850 HG23 :: 0.6850 HD11 :: 0.7890 HD12 :: 0.7890 HD13 :: 0.7890 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 123.7570 Ave N Shift Values>> N :: 121.46(4.28) 1.N26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.34 C 0.2 E 0.14 Y 0.08 M 0.08 F 0.05 D 0.02 K 0.01 C Shift Assignments>> C :: 175.1040 CA :: 53.9980 CB :: 36.9170 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 9.7970 HA :: 4.5540 HB2 :: 3.0190 HB3 :: 3.2660 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 128.2330 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.G27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.85 L 0.08 C 0.02 C Shift Assignments>> C :: 173.5720 CA :: 45.4070 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.7670 HA2 :: 3.5560 HA3 :: 4.2550 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 102.5250 Ave N Shift Values>> N :: 109.67(3.87) 1.E28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.33 C 0.32 E 0.27 Q 0.05 C Shift Assignments>> C :: 176.0390 CA :: 54.4010 CB :: 31.6420 CG :: 35.8950 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.7260 HA :: 4.6270 HB2 :: 2.0510 HB3 :: 2.0510 HG2 :: 2.3140 HG3 :: 2.2060 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.6810 Ave N Shift Values>> N :: 120.67(3.48) 1.D29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.22 L 0.19 F 0.17 Y 0.14 K 0.09 C 0.08 N 0.05 I 0.01 C Shift Assignments>> C :: 176.3790 CA :: 55.9580 CB :: 40.7860 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.7260 HA :: 4.5230 HB2 :: 2.7210 HB3 :: 2.7210 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 124.9220 Ave N Shift Values>> N :: 120.65(3.86) 1.A30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.92 C 0.02 L 0.02 M 0.01 C Shift Assignments>> C :: 176.4750 CA :: 51.2230 CB :: 20.4890 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.1180 HA :: 4.6490 HB1 :: 1.2980 HB2 :: 1.2980 HB3 :: 1.2980 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 128.2350 Ave N Shift Values>> N :: 123.23(3.54) 1.G31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.4 L 0.27 R 0.18 C 0.04 F 0.03 D 0.03 Y 0.01 C Shift Assignments>> C :: 172.5050 CA :: 44.3020 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.8590 HA2 :: 3.8780 HA3 :: 4.6620 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 105.8550 Ave N Shift Values>> N :: 109.67(3.87) 1.T32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.76 C 0.23 C Shift Assignments>> C :: 173.4990 CA :: 61.5340 CB :: 71.2310 CG2 :: 22.7590 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.1150 HA :: 5.3890 HB :: 3.8410 HG21 :: 1.0410 HG22 :: 1.0410 HG23 :: 1.0410 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.0740 Ave N Shift Values>> N :: 115.42(4.75) 1.I33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.54 C 0.45 C Shift Assignments>> C :: 174.8040 CA :: 60.1280 CB :: 40.8860 CG1 :: 26.6050 CG2 :: 19.1090 CD1 :: 13.9490 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.1800 HA :: 4.3860 HB :: 1.3060 HG12 :: 1.6550 HG13 :: 0.9840 HG21 :: 0.1760 HG22 :: 0.1760 HG23 :: 0.1760 HD11 :: 0.7760 HD12 :: 0.7760 HD13 :: 0.7760 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 125.2230 Ave N Shift Values>> N :: 121.46(4.28) 1.K34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.87 K 0.12 HN Overlap>> 1.M120 1.M120 C Shift Assignments>> C :: 175.1130 CA :: 54.4510 CB :: 35.2590 CG :: 25.9290 CD :: 29.2150 CE :: 39.8380 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.4180 HA :: 5.1110 HB2 :: 1.5810 HB3 :: 1.5810 HG2 :: 1.2920 HG3 :: 1.2920 HD2 :: 1.7320 HD3 :: 1.7320 HE2 :: 3.1140 HE3 :: 3.1140 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.4390 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.F35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.49 Y 0.36 C 0.13 C Shift Assignments>> C :: 174.6560 CA :: 55.6070 CB :: 41.8410 CD1 :: 131.9100 CD2 :: 131.9100 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 9.4330 HA :: 5.4120 HB2 :: 2.4930 HB3 :: 2.4930 HD1 :: 6.4340 HD2 :: 6.4340 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 120.6490 Ave N Shift Values>> N :: 120.45(4.18) 1.G36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.78 L 0.12 C 0.03 R 0.02 F 0.01 C Shift Assignments>> C :: 171.3260 CA :: 45.1070 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.3700 HA2 :: 3.2960 HA3 :: 5.1120 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.3370 Ave N Shift Values>> N :: 109.67(3.87) 1.L37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.51 G 0.17 C 0.13 A 0.12 R 0.05 C Shift Assignments>> C :: 177.1490 CA :: 52.6920 CB :: 43.6490 CG :: 27.1040 CD1 :: 25.6430 CD2 :: 22.5410 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.9600 HA :: 4.7620 HB2 :: 1.4180 HB3 :: 1.8710 HG :: 1.6160 HD11 :: 1.0920 HD12 :: 1.0920 HD13 :: 1.0920 HD21 :: 0.5510 HD22 :: 0.5510 HD23 :: 0.5510 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.6720 Ave N Shift Values>> N :: 121.86(3.9) 1.F38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.94 W 0.02 Y 0.02 HN Overlap>> 1.L66 1.L66 C Shift Assignments>> C :: 178.0950 CA :: 52.7420 CB :: 35.8620 CD1 :: 129.1200 CD2 :: 129.1200 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.5430 HA :: 5.8830 HB2 :: 2.9680 HB3 :: 3.4810 HD1 :: 6.8150 HD2 :: 6.8150 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 125.2530 Ave N Shift Values>> N :: 120.45(4.18) 1.G39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.87 C 0.06 L 0.05 C Shift Assignments>> C :: 174.3670 CA :: 46.9650 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.9760 HA2 :: 3.6490 HA3 :: 3.8270 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 107.0730 Ave N Shift Values>> N :: 109.67(3.87) 1.D40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.24 F 0.18 Y 0.16 L 0.15 N 0.11 C 0.09 K 0.02 I 0.01 C Shift Assignments>> C :: 177.4540 CA :: 55.5560 CB :: 40.1320 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.5620 HA :: 4.8450 HB2 :: 2.6490 HB3 :: 2.8540 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.8940 Ave N Shift Values>> N :: 120.65(3.86) 1.D41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.36 L 0.26 R 0.18 C 0.07 F 0.05 Y 0.02 D 0.02 C Shift Assignments>> C :: 176.3930 CA :: 56.8500 CB :: 44.5660 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.1940 HA :: 4.7150 HB2 :: 2.5530 HB3 :: 2.6790 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.9570 Ave N Shift Values>> N :: 120.65(3.86) 1.V42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.2 K 0.15 M 0.11 R 0.11 W 0.1 H 0.09 E 0.07 V 0.07 Q 0.05 C Shift Assignments>> C :: 172.4430 CA :: 58.3880 CB :: 32.2240 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.8080 HA :: 3.5650 HB :: 2.0440 HG11 :: 0.9980 HG12 :: 0.9980 HG13 :: 0.9980 HG21 :: 0.9980 HG22 :: 0.9980 HG23 :: 0.9980 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 111.5870 Ave N Shift Values>> N :: 121.14(4.54) 1.P43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.83 C 0.15 C Shift Assignments>> C :: 181.1590 CA :: 65.9680 CB :: 31.9060 CG :: 26.9880 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.4540 HB2 :: 2.0060 HB3 :: 2.6870 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.K44 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.51 K 0.4 R 0.08 C Shift Assignments>> C :: 181.9280 CA :: 60.0530 CB :: 31.6050 CG :: 25.7160 CD :: 29.0110 CE :: 41.5900 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 10.7490(S) HA :: 4.0460 HB2 :: 1.4480 HB3 :: 1.7330 HG2 :: 1.1760 HG3 :: 1.3890 HD2 :: 1.4540 HD3 :: 1.4540 HE2 :: 2.5520 HE3 :: 2.5520 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 122.3150 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.T45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.96 C 0.03 C Shift Assignments>> C :: 177.5380 CA :: 67.2620 CB :: 68.5180 CG2 :: 22.4670 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 10.2630 HA :: 4.1960 HB :: 4.0110 HG21 :: 0.9080 HG22 :: 0.9080 HG23 :: 0.9080 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 124.0360 Ave N Shift Values>> N :: 115.42(4.75) 1.A46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.58 A 0.29 I 0.06 C 0.03 C Shift Assignments>> C :: 178.2540 CA :: 55.8570 CB :: 18.3280 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.1480 HA :: 4.1070 HB1 :: 1.5420 HB2 :: 1.5420 HB3 :: 1.5420 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.8750 Ave N Shift Values>> N :: 123.23(3.54) 1.E47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.29 Q 0.27 K 0.25 E 0.08 R 0.05 I 0.01 M 0.01 HN Overlap>> 1.F149 1.F149 C Shift Assignments>> C :: 177.3910 CA :: 57.9170 CB :: 28.4770 CG :: 34.0520 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.1060 HA :: 4.5480 HB2 :: 1.8090 HB3 :: 2.2250 HG2 :: 2.4970 HG3 :: 2.0560 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 117.5930 Ave N Shift Values>> N :: 120.67(3.48) 1.N48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.25 F 0.25 C 0.13 D 0.12 L 0.08 N 0.06 I 0.05 C Shift Assignments>> C :: 174.5220 CA :: 56.7120 CB :: 39.4790 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.1870 HA :: 4.0330 HB2 :: 2.3330 HB3 :: 2.9030 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 116.0160 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.F49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.48 Y 0.29 C 0.22 C Shift Assignments>> C :: 177.8510 CA :: 61.8360 CB :: 40.3840 CD1 :: 130.7400 CD2 :: 130.7400 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.0340 HA :: 4.1880 HB2 :: 2.9710 HB3 :: 3.1430 HD1 :: 6.7160 HD2 :: 6.7160 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 117.2910 Ave N Shift Values>> N :: 120.45(4.18) 1.R50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.67 K 0.3 C Shift Assignments>> C :: 178.4810 CA :: 60.5300 CB :: 30.0340 CG :: 23.8790 CD :: 41.5480 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.6960 HA :: 3.7440 HB2 :: 1.7920 HB3 :: 1.8910 HG2 :: 1.1360 HG3 :: 1.5910 HD2 :: 2.7430 HD3 :: 2.7430 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 118.7030 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.A51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.55 M 0.39 C 0.02 I 0.01 C Shift Assignments>> C :: 182.0070 CA :: 54.4010 CB :: 18.3280 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.6440 HA :: 4.1590 HB1 :: 1.3320 HB2 :: 1.3320 HB3 :: 1.3320 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 118.3730 Ave N Shift Values>> N :: 123.23(3.54) 1.L52 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.58 C 0.4 C Shift Assignments>> C :: 179.3740 CA :: 57.1140 CB :: 41.2880 CG :: 25.8990 CD1 :: 23.1610 CD2 :: 23.1610 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.0330 HA :: 3.9740 HB2 :: -0.2820(S) HB3 :: 1.5010 HG :: 0.6670 HD11 :: 0.3150 HD12 :: 0.3150 HD13 :: 0.3150 HD21 :: 0.3150 HD22 :: 0.3150 HD23 :: 0.3150 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.4020 Ave N Shift Values>> N :: 121.86(3.9) 1.C53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.52 I 0.36 C 0.09 W 0.01 C Shift Assignments>> C :: 176.8890 CA :: 63.7960 CB :: 26.9190 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.8730 HA :: 4.7690 HB2 :: 2.3190 HB3 :: 3.6240 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 118.9840 Ave N Shift Values>> N :: 120.17(4.64) 1.T54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.91 C 0.08 C Shift Assignments>> C :: 177.6190 CA :: 62.8700 CB :: 69.4890 CG2 :: 22.1260 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.8090 HA :: 4.5050 HB :: 3.9470 HG21 :: 1.3580 HG22 :: 1.3580 HG23 :: 1.3580 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 107.7360 Ave N Shift Values>> N :: 115.42(4.75) 1.G55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.77 L 0.13 C 0.03 R 0.02 F 0.01 HN Overlap>> 1.S169 1.S169 C Shift Assignments>> C :: 177.6310 CA :: 45.0740 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.0780 HA2 :: 2.8250 HA3 :: 3.9970 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.4770 Ave N Shift Values>> N :: 109.67(3.87) 1.E56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.3 E 0.29 Q 0.16 K 0.11 M 0.08 I 0.02 C Shift Assignments>> C :: 176.3570 CA :: 57.9910 CB :: 30.0950 CG :: 35.2430 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.0120 HA :: 4.1510 HB2 :: 2.0890 HB3 :: 2.2920 HG2 :: 2.3040 HG3 :: 2.3040 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 117.3640 Ave N Shift Values>> N :: 120.67(3.48) 1.K57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.44 K 0.36 R 0.17 C Shift Assignments>> C :: 177.1520 CA :: 54.4630 CB :: 30.4750 CG :: 24.9010 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.2810 HA :: 4.2790 HB2 :: 1.8670 HB3 :: 1.8670 HG2 :: 1.2360 HG3 :: 1.2360 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 119.4850 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.G58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.87 L 0.07 C 0.03 C Shift Assignments>> C :: 173.4240 CA :: 45.8340 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.4490 HA2 :: 3.6180 HA3 :: 4.0460 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 105.9110 Ave N Shift Values>> N :: 109.67(3.87) 1.M59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.49 C 0.28 Q 0.16 K 0.04 C Shift Assignments>> C :: 177.0440 CA :: 54.1920 CB :: 32.5920 CG :: 31.4720 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.5380 HA :: 4.4020 HB2 :: 1.8430 HB3 :: 2.0140 HG2 :: 2.6020 HG3 :: 2.6020 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 124.3250 Ave N Shift Values>> N :: 120.09(3.57) 1.G60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.29 L 0.29 R 0.24 C 0.04 F 0.04 D 0.04 Y 0.02 HN Overlap>> 1.D180 1.D180 C Shift Assignments>> C :: 175.5140 CA :: 44.0970 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.0620 HA2 :: 3.8400 HA3 :: 4.2270 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.9350 Ave N Shift Values>> N :: 109.67(3.87) 1.K61 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.38 K 0.36 R 0.24 C Shift Assignments>> C :: 179.4960 CA :: 58.0990 CB :: 31.8320 CG :: 24.9490 CD :: 28.2590 CE :: 42.2770 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 10.8770(S) HA :: 4.1260 HB2 :: 1.9060 HB3 :: 1.9060 HG2 :: 1.3710 HG3 :: 1.3710 HD2 :: 1.7210 HD3 :: 1.7210 HE2 :: 3.0460 HE3 :: 3.0460 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 124.8730 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.56 C 0.33 A 0.09 C Shift Assignments>> C :: 177.8710 CA :: 54.8430 CB :: 40.0820 CG :: 27.5420 CD1 :: 25.2050 CD2 :: 22.4310 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.8610 HA :: 4.4220 HB2 :: 1.7540 HB3 :: 1.8060 HG :: 1.5460 HD11 :: 0.9530 HD12 :: 0.9530 HD13 :: 0.9530 HD21 :: 0.8690 HD22 :: 0.8690 HD23 :: 0.8690 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.8520 Ave N Shift Values>> N :: 121.86(3.9) 1.G63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.88 L 0.06 C 0.03 C Shift Assignments>> C :: 173.3920 CA :: 45.9970 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.5200 HA2 :: 3.6470 HA3 :: 4.1810 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 105.0160 Ave N Shift Values>> N :: 109.67(3.87) 1.K64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.24 C 0.2 K 0.11 Q 0.1 H 0.09 P 0.08 R 0.08 W 0.04 E 0.01 C Shift Assignments>> C :: 174.9010 CA :: 52.3660 CB :: 32.8340 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.7200 HA :: 4.9690 HB2 :: 1.6560 HB3 :: 1.6560 HG2 :: 1.4560 HG3 :: 1.4560 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 118.4460 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.74 C 0.2 I 0.01 R 0.01 C Shift Assignments>> C :: 177.1510 CA :: 63.7970 CB :: 32.5380 CG :: 27.4810 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.3850 HB2 :: 1.9870 HB3 :: 2.4190 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.L66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 L 0.31 A 0.3 HN Overlap>> 1.F38 1.F38 C Shift Assignments>> C :: 174.8540 CA :: 52.3460 CB :: 38.6160 CG :: 25.5300 CD1 :: 26.4610 CD2 :: 22.8690 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.5610 HA :: 4.1170 HB2 :: 0.9140 HB3 :: 1.5170 HG :: 1.3640 HD11 :: 0.5480 HD12 :: 0.5480 HD13 :: 0.5480 HD21 :: 0.4470 HD22 :: 0.4470 HD23 :: 0.4470 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 125.2910 Ave N Shift Values>> N :: 121.86(3.9) 1.H67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.91 Y 0.05 H 0.01 C Shift Assignments>> C :: 175.6860 CA :: 51.6410 CB :: 36.1740 CD2 :: 115.7520 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 7.7450 HA :: 5.5160 HB2 :: 2.8030 HB3 :: 3.1560 HD2 :: 7.2070 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 123.3720 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.Y68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.29 F 0.24 C 0.19 I 0.16 E 0.03 D 0.01 L 0.01 C Shift Assignments>> C :: 176.2970 CA :: 58.5450 CB :: 38.4810 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.5900 HA :: 4.4320 HB2 :: 2.8550 HB3 :: 2.8550 HD1 :: 7.2510 HD2 :: 7.2510 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 121.8590 Ave N Shift Values>> N :: 120.52(4.2) 1.K69 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.53 K 0.46 C Shift Assignments>> C :: 175.7370 CA :: 58.3730 CB :: 32.2760 CG :: 24.5790 CD :: 28.0110 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 5.7820(S) HA :: 3.3370 HB2 :: 0.6710(S) HB3 :: 0.8420(S) HG2 :: 1.1570 HG3 :: 1.1570 HD2 :: 1.8790 HD3 :: 1.8790 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 122.3460 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.G70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.75 L 0.14 C 0.03 R 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 173.6970 CA :: 45.0150 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.5750 HA2 :: 3.4410 HA3 :: 4.3860 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 117.1210 Ave N Shift Values>> N :: 109.67(3.87) 1.S71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 172.4680 CA :: 56.6830 CB :: 64.2780 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.2100 HA :: 5.5350 HB2 :: 4.1880 HB3 :: 3.7660 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 116.5930 Ave N Shift Values>> N :: 116.28(3.52) 1.P72 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Indeterminable PRTL>> C 0.43 P 0.38 K 0.07 R 0.05 I 0.02 Q 0.01 V 0.01 C Shift Assignments>> C :: 179.6860 CA :: 61.8980 CB :: 32.8740 CG :: 26.2210 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 5.7250(S) HB2 :: 1.9390 HB3 :: 2.1930 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.F73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.37 Y 0.35 C 0.27 C Shift Assignments>> C :: 174.7730 CA :: 58.8750 CB :: 37.9310 CD1 :: 131.6100 CD2 :: 131.6100 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.4330 HA :: 4.8860 HB2 :: 2.5840 HB3 :: 2.7620 HD1 :: 6.9230 HD2 :: 6.9230 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 120.5100 Ave N Shift Values>> N :: 120.45(4.18) 1.H74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.4 H 0.34 W 0.24 C Shift Assignments>> C :: 174.7230 CA :: 56.5660 CB :: 32.4340 CD2 :: 119.1200 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 7.4580 HA :: 4.7970 HB2 :: 2.7040 HB3 :: 3.2960 HD2 :: 6.7130 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 119.2410 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.R75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.42 C 0.36 K 0.12 G 0.09 C Shift Assignments>> C :: 173.0290 CA :: 55.0820 CB :: 32.8190 CG :: 27.6080 CD :: 43.4520 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.0020 HA :: 5.0290 HB2 :: 1.1920 HB3 :: 1.3530 HG2 :: 1.5850 HG3 :: 1.5850 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 123.4290 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.V76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.58 V 0.4 I 0.01 C Shift Assignments>> C :: 173.2840 CA :: 62.0640 CB :: 35.4570 CG1 :: 20.2770 CG2 :: 23.2210 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.3080 HA :: 4.3470 HB :: 1.8010 HG11 :: 0.7960 HG12 :: 0.7960 HG13 :: 0.7960 HG21 :: 0.9570 HG22 :: 0.9570 HG23 :: 0.9570 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 128.4490 Ave N Shift Values>> N :: 121.14(4.54) 1.I77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.27 Y 0.24 C 0.11 L 0.11 D 0.09 I 0.06 K 0.06 N 0.01 C Shift Assignments>> C :: 172.9850 CA :: 57.6770 CB :: 40.4760 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.5780 HA :: 5.1250 HB :: 1.9380 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 127.0800 Ave N Shift Values>> N :: 121.46(4.28) 1.P78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.63 C 0.29 R 0.03 K 0.02 C Shift Assignments>> C :: 176.6320 CA :: 62.7780 CB :: 32.0490 CG :: 26.3730 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.2850 HB2 :: 1.7730 HB3 :: 2.3090 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.N79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.37 C 0.17 Y 0.12 F 0.09 E 0.08 D 0.06 M 0.04 L 0.01 I 0.01 C Shift Assignments>> C :: 172.7750 CA :: 54.3670 CB :: 37.6010 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 9.6740 HA :: 4.1110 HB2 :: 3.0450 HB3 :: 3.0450 HD21 :: 7.3910 HD22 :: 6.8050 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 117.6240 ND2 :: 113.4950 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.F80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.41 Y 0.32 C 0.26 C Shift Assignments>> C :: 173.1180 CA :: 57.6670 CB :: 38.9760 CD1 :: 130.8100 CD2 :: 130.8100 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.5890 HA :: 5.1520 HB2 :: 2.9740 HB3 :: 3.3120 HD1 :: 7.3040 HD2 :: 7.3040 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 114.0030 Ave N Shift Values>> N :: 120.45(4.18) 1.M81 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> Q 0.31 C 0.25 K 0.22 E 0.13 R 0.04 M 0.01 C Shift Assignments>> C :: 172.9530 CA :: 54.6420 CB :: 34.7430 CG :: 28.3390 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.1590 HA :: 5.2310 HB2 :: 1.4860 HB3 :: 2.1190 HG2 :: 0.9640(S) HG3 :: 0.9640(S) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 111.8670 Ave N Shift Values>> N :: 120.09(3.57) 1.I82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.51 I 0.47 C Shift Assignments>> C :: 173.2970 CA :: 59.9400 CB :: 40.6450 CG1 :: 27.1040 CG2 :: 18.4520 CD1 :: 15.8230 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.3150 HA :: 4.7690 HB :: 1.7160 HG12 :: 1.1430 HG21 :: 0.7750 HG22 :: 0.7750 HG23 :: 0.7750 HD11 :: 0.6520 HD12 :: 0.6520 HD13 :: 0.6520 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 113.4220 Ave N Shift Values>> N :: 121.46(4.28) 1.Q83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.45 C 0.26 Q 0.21 K 0.04 E 0.01 C Shift Assignments>> C :: 174.2010 CA :: 54.4160 CB :: 31.4920 CG :: 33.2010 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 9.2680 HA :: 5.2760 HB2 :: 1.7710 HB3 :: 2.0560 HG2 :: 2.5750 HG3 :: 2.5750 HE21 :: 7.0750 HE22 :: 6.8640 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 126.7870 NE2 :: 109.9220 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.G84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.8 L 0.11 C 0.03 R 0.01 F 0.01 C Shift Assignments>> C :: 173.3730 CA :: 45.1810 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.3120 HA2 :: 2.9080 HA3 :: 4.7960 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.2570 Ave N Shift Values>> N :: 109.67(3.87) 1.G85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.83 C 0.07 L 0.04 A 0.01 P 0.01 C Shift Assignments>> C :: 174.8490 CA :: 47.2830 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.7640 HA2 :: 3.7070 HA3 :: 4.5530 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 105.7840 Ave N Shift Values>> N :: 109.67(3.87) 1.D86 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> N 0.48 D 0.19 C 0.09 F 0.07 Y 0.07 L 0.05 C Shift Assignments>> C :: 177.4840 CA :: 53.3440 CB :: 38.9550 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 10.3290(S) HA :: 4.3980 HB2 :: 1.7610(S) HB3 :: 3.1040 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 124.4840 Ave N Shift Values>> N :: 120.65(3.86) 1.I87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.62 I 0.36 C Shift Assignments>> C :: 175.2950 CA :: 62.8670 CB :: 37.5530 CG1 :: 25.9350 CG2 :: 19.4740 CD1 :: 16.8820 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 6.5470 HA :: 4.2690 HB :: 2.4760 HG12 :: 1.4570 HG21 :: 1.0660 HG22 :: 1.0660 HG23 :: 1.0660 HD11 :: 0.9040 HD12 :: 0.9040 HD13 :: 0.9040 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 115.5940 Ave N Shift Values>> N :: 121.46(4.28) 1.T88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.71 C 0.28 HN Overlap>> 1.S167 1.S167 C Shift Assignments>> C :: 175.1810 CA :: 62.5580 CB :: 68.5510 CG2 :: 23.3920 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.0210 HA :: 4.7870 HB :: 4.3310 HG21 :: 1.1430 HG22 :: 1.1430 HG23 :: 1.1430 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 109.9010 Ave N Shift Values>> N :: 115.42(4.75) 1.S89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 1.F20 1.F20 C Shift Assignments>> C :: 175.6010 CA :: 58.2710 CB :: 64.7570 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.7900 HA :: 4.6690 HB2 :: 3.8240 HB3 :: 4.0530 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 116.3160 Ave N Shift Values>> N :: 116.28(3.52) 1.G90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.81 C 0.08 L 0.04 A 0.02 P 0.01 C Shift Assignments>> C :: 172.4690 CA :: 47.3860 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.2880 HA2 :: 3.8670 HA3 :: 4.0160 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.2210 Ave N Shift Values>> N :: 109.67(3.87) 1.N91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.58 D 0.18 C 0.07 F 0.04 Y 0.04 L 0.04 C Shift Assignments>> C :: 175.4730 CA :: 52.1680 CB :: 39.0310 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.5420 HA :: 4.6210 HB2 :: 2.7260 HB3 :: 3.1010 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 112.7750 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.G92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.58 L 0.21 R 0.09 C 0.04 F 0.02 D 0.02 Y 0.01 C Shift Assignments>> C :: 175.6000 CA :: 44.6380 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.4840 HA2 :: 4.2300 HA3 :: 4.2300 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.9680 Ave N Shift Values>> N :: 109.67(3.87) 1.Y93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.28 F 0.22 C 0.2 I 0.17 E 0.05 D 0.01 M 0.01 L 0.01 C Shift Assignments>> C :: 176.9240 CA :: 58.6010 CB :: 38.2060 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.9710 HA :: 4.6040 HB2 :: 2.8470 HB3 :: 3.2060 HD1 :: 7.0510 HD2 :: 7.0510 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 121.1490 Ave N Shift Values>> N :: 120.52(4.2) 1.G94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.82 L 0.1 C 0.02 R 0.01 F 0.01 HN Overlap>> 1.G155 1.G155 C Shift Assignments>> C :: 175.2190 CA :: 45.2430 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.9790 HA2 :: 3.9670 HA3 :: 4.6830 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.4640 Ave N Shift Values>> N :: 109.67(3.87) 1.G95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.3 R 0.29 G 0.22 D 0.04 F 0.04 C 0.04 Y 0.02 K 0.01 C Shift Assignments>> C :: 172.0240 CA :: 43.9230 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.4190 HA2 :: 3.5770 HA3 :: 5.0540 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.3590 Ave N Shift Values>> N :: 109.67(3.87) 1.E96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.45 M 0.28 E 0.22 Q 0.03 C Shift Assignments>> C :: 172.5330 CA :: 56.8960 CB :: 32.7640 CG :: 35.7670 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.0060 HA :: 4.3610 HB2 :: 1.6580 HB3 :: 2.0590 HG2 :: 2.1140 HG3 :: 2.1140 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.3830 Ave N Shift Values>> N :: 120.67(3.48) 1.S97 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.98 S 0.01 C Shift Assignments>> C :: 175.6890 CA :: 56.9510 CB :: 68.9900(S) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.9150 HA :: 4.9950 HB2 :: 4.2790 HB3 :: 4.2790 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 116.6390 Ave N Shift Values>> N :: 116.28(3.52) 1.I98 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.71 I 0.24 V 0.04 C Shift Assignments>> C :: 175.7530 CA :: 63.7680 CB :: 37.0520 CG1 :: 22.7080 CG2 :: 17.4240 CD1 :: 14.1440 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.4310 HA :: 3.9530 HB :: 1.7130 HG12 :: 0.7410 HG13 :: -0.4310(S) HG21 :: 0.7520 HG22 :: 0.7520 HG23 :: 0.7520 HD11 :: 0.4520 HD12 :: 0.4520 HD13 :: 0.4520 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 111.7620 Ave N Shift Values>> N :: 121.46(4.28) 1.Y99 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.5 C 0.27 F 0.21 C Shift Assignments>> C :: 175.5240 CA :: 56.2920 CB :: 38.5360 CD1 :: 133.0260 CD2 :: 133.0260 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.8110 HA :: 4.6890 HB2 :: 2.4050 HB3 :: 3.4670 HD1 :: 6.4430 HD2 :: 6.4430 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 119.6300 Ave N Shift Values>> N :: 120.52(4.2) 1.G100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.48 L 0.24 R 0.13 C 0.04 F 0.03 D 0.02 Y 0.01 C Shift Assignments>> C :: 174.6460 CA :: 44.4520 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.2180 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 107.1970 Ave N Shift Values>> N :: 109.67(3.87) 1.S101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> C :: 173.6620 CA :: 61.2760 CB :: 63.3620 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> HA :: 4.3210 HB2 :: 4.0290 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) 1.K102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.45 C 0.42 R 0.08 G 0.02 C Shift Assignments>> C :: 175.9860 CA :: 54.8780 CB :: 35.6240 CG :: 24.3710 CD :: 29.0990 CE :: 42.3830 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.7800 HA :: 5.3790 HB2 :: 1.6790 HB3 :: 1.6790 HG2 :: 1.2890 HG3 :: 1.3830 HD2 :: 1.5970 HD3 :: 1.5970 HE2 :: 2.9910 HE3 :: 2.9910 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 116.3650 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.F103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.5 C 0.45 G 0.03 C Shift Assignments>> C :: 174.5060 CA :: 55.8090 CB :: 42.0670 CD1 :: 134.6200 CD2 :: 134.6200 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.9000 HA :: 5.0860 HB2 :: 3.0080 HB3 :: 3.1130 HD1 :: 7.3540 HD2 :: 7.3540 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 116.7740 Ave N Shift Values>> N :: 120.45(4.18) 1.A104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.95 M 0.03 C 0.01 C Shift Assignments>> C :: 178.5790 CA :: 50.0930 CB :: 19.3080 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2110 HA :: 3.8720 HB1 :: 1.3370 HB2 :: 1.3370 HB3 :: 1.3370 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.0410 Ave N Shift Values>> N :: 123.23(3.54) 1.D105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.27 L 0.24 K 0.16 F 0.09 Y 0.06 N 0.05 C 0.05 R 0.03 C Shift Assignments>> C :: 176.4910 CA :: 54.7010 CB :: 41.5560 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.6700 HA :: 4.2240 HB2 :: 1.8920 HB3 :: 2.4270 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 119.0110 Ave N Shift Values>> N :: 120.65(3.86) 1.E106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.53 E 0.22 M 0.18 Q 0.03 C Shift Assignments>> C :: 175.8930 CA :: 59.2530 CB :: 32.3510 CG :: 35.5730 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.1730 HA :: 3.9410 HB2 :: 1.9390 HB3 :: 2.1730 HG2 :: 2.3590 HG3 :: 2.3590 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 129.9500 Ave N Shift Values>> N :: 120.67(3.48) 1.S107 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 173.4630 CA :: 57.3610 CB :: 64.5210 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 6.1710(S) HA :: 4.2230 HB2 :: 3.4280 HB3 :: 3.4280 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 106.3140 Ave N Shift Values>> N :: 116.28(3.52) 1.F108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.4 Y 0.38 C 0.21 C Shift Assignments>> C :: 176.4530 CA :: 56.5430 CB :: 38.7950 CD1 :: 131.8020 CD2 :: 131.8020 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.7890 HA :: 5.4730 HB2 :: 2.6790 HB3 :: 3.7160 HD1 :: 7.3040 HD2 :: 7.3040 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 124.6890 Ave N Shift Values>> N :: 120.45(4.18) 1.K109 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.99 C Shift Assignments>> C :: 176.4020 CA :: 59.3560 CB :: 33.0150 CG :: 24.9450 CD :: 29.0720 CE :: 37.0910(S) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.0050 HA :: 4.0080 HB2 :: 1.8290 HB3 :: 1.8290 HG2 :: 1.4410 HG3 :: 1.5230 HD2 :: 1.7420 HD3 :: 1.7420 HE2 :: 3.0510 HE3 :: 3.0510 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 118.6730 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I110 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.69 I 0.29 C Shift Assignments>> C :: 175.0790 CA :: 61.4530 CB :: 37.5670 CG1 :: 27.5090 CG2 :: 18.4620 CD1 :: 17.7310 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.4390 HA :: 4.1210 HB :: 1.8710 HG12 :: 0.8110 HG13 :: 1.5560 HG21 :: 0.8780 HG22 :: 0.8780 HG23 :: 0.8780 HD11 :: 0.2560 HD12 :: 0.2560 HD13 :: 0.2560 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.8430 Ave N Shift Values>> N :: 121.46(4.28) 1.T111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.84 C 0.15 C Shift Assignments>> C :: 175.7150 CA :: 60.8390 CB :: 69.9430 CG2 :: 22.0880 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.8520 HA :: 4.1510 HB :: 4.4450 HG21 :: 1.2320 HG22 :: 1.2320 HG23 :: 1.2320 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.7140 Ave N Shift Values>> N :: 115.42(4.75) 1.H112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.4 H 0.3 W 0.29 C Shift Assignments>> C :: 177.5120 CA :: 56.2360 CB :: 26.6220 CD2 :: 120.2100 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 9.3130 HA :: 4.4720 HB2 :: 2.8540 HB3 :: 3.2090 HD2 :: 7.0080 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 119.1980 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.D113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.24 L 0.2 F 0.15 Y 0.12 K 0.1 C 0.07 N 0.06 I 0.01 C Shift Assignments>> C :: 176.0460 CA :: 55.6220 CB :: 40.8920 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.4830 HA :: 4.4510 HB2 :: 2.7730 HB3 :: 2.7730 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.0280 Ave N Shift Values>> N :: 120.65(3.86) 1.G114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.83 L 0.09 C 0.02 R 0.01 C Shift Assignments>> C :: 169.3440 CA :: 45.2920 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.2180 HA2 :: 4.4790 HA3 :: 4.1270 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 104.5310 Ave N Shift Values>> N :: 109.67(3.87) 1.P115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.44 C 0.4 R 0.04 I 0.03 K 0.03 Q 0.02 C Shift Assignments>> C :: 176.2370 CA :: 62.1170 CB :: 33.1180 CG :: 26.6320 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 3.9620 HB2 :: 1.7840 HB3 :: 1.9740 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.G116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.88 L 0.06 C 0.04 C Shift Assignments>> C :: 173.0170 CA :: 46.3640 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.7620 HA2 :: 3.4130 HA3 :: 4.2080 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.1190 Ave N Shift Values>> N :: 109.67(3.87) 1.L117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.33 C 0.22 A 0.22 L 0.17 G 0.04 C Shift Assignments>> C :: 174.8880 CA :: 53.9340 CB :: 42.8350 CG :: 28.4290 CD1 :: 26.6440 CD2 :: 21.6150 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.6840 HA :: 4.7450 HB2 :: 1.2830 HB3 :: 1.8280 HG :: 1.5510 HD11 :: 1.2250 HD12 :: 1.2250 HD13 :: 1.2250 HD21 :: 0.9630 HD22 :: 0.9630 HD23 :: 0.9630 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.4510 Ave N Shift Values>> N :: 121.86(3.9) 1.L118 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.75 C 0.13 G 0.08 A 0.02 C Shift Assignments>> C :: 174.1240 CA :: 52.6560 CB :: 42.9880 CG :: 25.9870 CD1 :: 23.9470 CD2 :: 23.9470 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.5620 HA :: 4.5770 HB2 :: -0.1970(S) HB3 :: -0.1130(S) HG :: 0.3460(S) HD11 :: -0.4960(S) HD12 :: -0.4960(S) HD13 :: -0.4960(S) HD21 :: 0.4960 HD22 :: 0.4960 HD23 :: 0.4960 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.2530 Ave N Shift Values>> N :: 121.86(3.9) 1.S119 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.6840 CA :: 54.4460 CB :: 64.3170 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.3410 HA :: 5.3530 HB2 :: 2.2480(S) HB3 :: 2.9640 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 118.0220 Ave N Shift Values>> N :: 116.28(3.52) 1.M120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.47 C 0.31 Q 0.1 K 0.08 HN Overlap>> 1.K34 1.K34 C Shift Assignments>> C :: 178.0950 CA :: 53.9850 CB :: 31.0720 CG :: 31.8980 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.3610 HA :: 5.3910 HB2 :: 2.3350 HB3 :: 2.3350 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 123.4230 Ave N Shift Values>> N :: 120.09(3.57) 1.A121 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.92 M 0.04 C 0.01 L 0.01 C Shift Assignments>> C :: 175.6510 CA :: 51.6330 CB :: 19.8190 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.7610 HA :: 4.5760 HB1 :: 1.3320 HB2 :: 1.3320 HB3 :: 1.3320 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 126.4570 Ave N Shift Values>> N :: 123.23(3.54) 1.N122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.32 N 0.18 L 0.16 F 0.11 Y 0.09 C 0.07 K 0.03 C Shift Assignments>> C :: 174.4550 CA :: 54.3430 CB :: 40.3810 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.4320 HA :: 4.6940 HB2 :: 3.0180 HB3 :: 3.4640 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 114.3290 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.S123 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.1880 CA :: 56.0450 CB :: 63.3460 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.8560 HA :: 4.5080 HB2 :: 4.1490 HB3 :: 4.1490 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 113.9390 Ave N Shift Values>> N :: 116.28(3.52) 1.G124 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.82 L 0.1 C 0.02 R 0.01 F 0.01 HN Overlap>> 1.S169 1.S169 C Shift Assignments>> C :: 171.9150 CA :: 45.2410 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.0800 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.3120 Ave N Shift Values>> N :: 109.67(3.87) 1.P125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.71 C 0.27 C Shift Assignments>> C :: 176.2370 CA :: 63.8050 CB :: 31.9410 CG :: 27.5610 CD :: 48.8440 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.3810 HB2 :: 1.8690 HB3 :: 2.3910 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.N126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.31 C 0.21 E 0.15 Y 0.09 M 0.08 F 0.06 D 0.02 K 0.01 C Shift Assignments>> C :: 174.8630 CA :: 54.1890 CB :: 36.9030 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.9790 HA :: 4.0330 HB2 :: 2.6810 HB3 :: 3.1540 HD21 :: 7.3050 HD22 :: 7.8040 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.5280 ND2 :: 113.6610 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.T127 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.84 C 0.15 C Shift Assignments>> C :: 173.8950 CA :: 60.1220 CB :: 68.9710 CG2 :: 20.6060 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 10.1540 HA :: 4.4510 HB :: 4.9580 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 109.9860 Ave N Shift Values>> N :: 115.42(4.75) 1.N128 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> Y 0.21 F 0.21 D 0.16 N 0.14 C 0.13 L 0.08 I 0.03 C Shift Assignments>> C :: 174.0090 CA :: 55.8780 CB :: 39.2040 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.2590 HA :: 4.2510 HB2 :: 0.8850(S) HB3 :: 1.5580(S) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 120.4360 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.G129 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.87 L 0.07 C 0.03 C Shift Assignments>> C :: 170.8020 CA :: 45.7510 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.1520 HA2 :: 3.6540 HA3 :: 4.6040 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.6650 Ave N Shift Values>> N :: 109.67(3.87) 1.S130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.97 T 0.02 C Shift Assignments>> C :: 175.6920 CA :: 57.8720 CB :: 65.6970 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.4140 HA :: 4.7010 HB2 :: 4.7010 HB3 :: 4.7010 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 117.2590 Ave N Shift Values>> N :: 116.28(3.52) 1.Q131 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 M 0.26 E 0.2 Q 0.1 HN Overlap>> 1.R8 1.R8 C Shift Assignments>> C :: 175.3590 CA :: 58.1790 CB :: 31.9930 CG :: 34.9890 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.2350 HA :: 4.9290 HB2 :: 1.9050 HB3 :: 2.1380 HG2 :: 2.3070 HG3 :: 2.3070 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 123.4860 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.F132 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.37 F 0.35 C 0.15 G 0.11 C Shift Assignments>> C :: 171.7820 CA :: 55.4680 CB :: 43.1940 CD1 :: 132.4900 CD2 :: 132.4900 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.9230 HA :: 5.8390 HB2 :: 3.3150 HB3 :: 3.3150 HD1 :: 6.7880 HD2 :: 6.7880 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 117.8330 Ave N Shift Values>> N :: 120.45(4.18) 1.F133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.31 F 0.29 Y 0.25 C 0.13 C Shift Assignments>> C :: 173.1320 CA :: 55.0590 CB :: 43.8070 CD1 :: 132.3500 CD2 :: 132.3500 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 9.7940 HA :: 5.8210 HB2 :: 2.7570 HB3 :: 3.0090 HD1 :: 6.6600 HD2 :: 6.6640 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 116.5160 Ave N Shift Values>> N :: 120.45(4.18) 1.I134 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.5 I 0.48 C Shift Assignments>> C :: 177.8790 CA :: 58.6910 CB :: 40.6870 CG1 :: 27.9640 CG2 :: 17.2820 CD1 :: 14.6820 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.2000 HA :: 5.3980 HB :: 1.7590 HG12 :: 0.9720 HG13 :: 1.9340 HG21 :: 0.8710 HG22 :: 0.8710 HG23 :: 0.8710 HD11 :: 1.1960 HD12 :: 1.1960 HD13 :: 1.1960 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 118.6750 Ave N Shift Values>> N :: 121.46(4.28) 1.T135 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.78 T 0.21 C Shift Assignments>> C :: 177.1790 CA :: 61.9120 CB :: 70.3520 CG2 :: 24.5270 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 9.2420 HA :: 4.6210 HB :: 5.1270 HG21 :: 1.6220 HG22 :: 1.6220 HG23 :: 1.6220 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.8360 Ave N Shift Values>> N :: 115.42(4.75) 1.T136 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.75 C 0.22 S 0.01 C Shift Assignments>> C :: 173.6920 CA :: 61.4570 CB :: 67.9260 CG2 :: 22.5620 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.7020 HA :: 4.6380 HB :: 4.4190 HG21 :: 0.8320 HG22 :: 0.8320 HG23 :: 0.8320 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 110.5980 Ave N Shift Values>> N :: 115.42(4.75) 1.V137 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.3 E 0.14 K 0.11 Q 0.11 M 0.1 V 0.07 Y 0.03 I 0.03 R 0.01 W 0.01 H 0.01 F 0.01 C Shift Assignments>> C :: 172.7020 CA :: 58.9450 CB :: 34.8650 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.7210 HA :: 4.6770 HB :: 2.0030 HG11 :: 1.0310 HG12 :: 1.0310 HG13 :: 1.0310 HG21 :: 1.0310 HG22 :: 1.0310 HG23 :: 1.0310 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 115.8120 Ave N Shift Values>> N :: 121.14(4.54) 1.P138 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.68 C 0.26 R 0.02 K 0.01 C Shift Assignments>> C :: 176.1610 CA :: 63.4780 CB :: 31.5380 CG :: 28.3210 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.1440 HB2 :: 1.9630 HB3 :: 2.2320 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.C139 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.16 R 0.13 K 0.12 H 0.12 C 0.12 L 0.11 W 0.09 E 0.07 M 0.02 C Shift Assignments>> C :: 172.5170 CA :: 54.7050 CB :: 28.1650 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.7860 HA :: 4.7080 HB2 :: 3.2590 HB3 :: 2.8470 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 116.7100 Ave N Shift Values>> N :: 120.17(4.64) 1.P140 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.81 C 0.18 C Shift Assignments>> C :: 177.9420 CA :: 64.1360 CB :: 30.9830 CG :: 27.5690 CD :: 50.1870 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.2670 HB2 :: 2.1690 HB3 :: 2.4030 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.W141 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.59 W 0.29 H 0.1 C Shift Assignments>> C :: 176.3890 CA :: 59.8910 CB :: 26.7880 CD1 :: 127.8500 Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 6.8920 HA :: 4.6740 HB2 :: 3.3770 HB3 :: 3.3770 HD1 :: 6.4820 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 116.0060 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.L142 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.52 C 0.39 L 0.08 C Shift Assignments>> C :: 177.5490 CA :: 54.4320 CB :: 39.0180 CG :: 26.1530 CD1 :: 21.5540 CD2 :: 21.2310 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.2250 HA :: 4.3470 HB2 :: 0.5280 HB3 :: 1.2110 HG :: 1.1610 HD11 :: 0.5220 HD12 :: 0.5220 HD13 :: 0.5220 HD21 :: 0.5220 HD22 :: 0.5220 HD23 :: 0.5220 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.0860 Ave N Shift Values>> N :: 121.86(3.9) 1.N143 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.31 C 0.22 E 0.16 M 0.1 Y 0.07 F 0.04 K 0.02 D 0.02 Q 0.01 C Shift Assignments>> C :: 176.9880 CA :: 53.9270 CB :: 36.6430 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.5560 HA :: 5.0650 HB2 :: 3.1020 HB3 :: 3.1020 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 120.3370 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.G144 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.72 L 0.15 R 0.04 C 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 172.1390 CA :: 44.9310 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.5070 HA2 :: 2.8690 HA3 :: 3.9260 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.9620 Ave N Shift Values>> N :: 109.67(3.87) 1.K145 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.43 C 0.42 R 0.12 G 0.01 C Shift Assignments>> C :: 175.4480 CA :: 56.2520 CB :: 35.6320 CG :: 24.8980 CD :: 28.9860 CE :: 42.2110 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.5170 HA :: 4.1390 HB2 :: 1.7410 HB3 :: 1.7410 HG2 :: 1.2430 HG3 :: 1.2430 HD2 :: 1.6940 HD3 :: 1.6940 HE2 :: 3.0440 HE3 :: 3.0440 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 114.2770 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.H146 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.38 C 0.33 W 0.27 C Shift Assignments>> C :: 173.8690 CA :: 54.9370 CB :: 32.2950 CD2 :: 120.1800 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 7.3550 HD2 :: 6.9190 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 118.1060 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.V147 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.75 C 0.24 C Shift Assignments>> C :: 174.7230 CA :: 63.3770 CB :: 33.6110 CG1 :: 20.7040 CG2 :: 20.7040 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.2500 HA :: 4.2990 HB :: 2.0650 HG11 :: 1.2430 HG12 :: 1.2430 HG13 :: 1.2430 HG21 :: 1.2430 HG22 :: 1.2430 HG23 :: 1.2430 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 124.7480 Ave N Shift Values>> N :: 121.14(4.54) 1.V148 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 V 0.47 C Shift Assignments>> C :: 177.2810 CA :: 62.6190 CB :: 31.6390 CG1 :: 23.3660 CG2 :: 23.3660 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.7590 HA :: 4.4880 HB :: 1.8180 HG11 :: 1.0110 HG12 :: 1.0110 HG13 :: 1.0110 HG21 :: 1.0110 HG22 :: 1.0110 HG23 :: 1.0110 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 131.8770 Ave N Shift Values>> N :: 121.14(4.54) 1.F149 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.44 F 0.38 C 0.15 G 0.01 HN Overlap>> 1.E47 1.E47 C Shift Assignments>> C :: 172.8130 CA :: 55.8470 CB :: 42.2530 CD1 :: 132.5200 CD2 :: 132.5200 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.1600 HA :: 5.2980 HB2 :: 2.5110 HB3 :: 3.1710 HD1 :: 7.4390 HD2 :: 7.4390 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 117.6020 Ave N Shift Values>> N :: 120.45(4.18) 1.G150 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.87 L 0.07 C 0.03 C Shift Assignments>> C :: 170.2550 CA :: 45.8410 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.0440 HA2 :: 2.2290(S) HA3 :: 3.2140 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.2900 Ave N Shift Values>> N :: 109.67(3.87) 1.K151 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.65 A 0.25 K 0.08 C Shift Assignments>> C :: 174.9510 CA :: 54.1290 CB :: 35.8850 CG :: 22.4370 CD :: 29.0020 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.6420 HA :: 5.3270 HB2 :: 1.8750 HB3 :: 1.8110 HG2 :: 1.0130 HG3 :: 1.2510 HD2 :: 1.7220 HD3 :: 1.7220 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 113.6520 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V152 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.77 C 0.22 C Shift Assignments>> C :: 176.6690 CA :: 63.6310 CB :: 32.3970 CG1 :: 21.4470 CG2 :: 22.1280 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.2000 HA :: 3.9020 HB :: 2.0220 HG11 :: 0.6030 HG12 :: 0.6030 HG13 :: 0.6030 HG21 :: 0.9250 HG22 :: 0.9250 HG23 :: 0.9250 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.9370 Ave N Shift Values>> N :: 121.14(4.54) 1.I153 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.72 C 0.27 C Shift Assignments>> C :: 175.5930 CA :: 61.6590 CB :: 38.9170 CG1 :: 26.1450 CG2 :: 17.2120 CD1 :: 14.7760 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.9210 HA :: 4.6430 HB :: 2.0360 HG12 :: 0.7280 HG13 :: 1.2660 HG21 :: 0.9480 HG22 :: 0.9480 HG23 :: 0.9480 HD11 :: 1.2020 HD12 :: 1.2020 HD13 :: 1.2020 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 122.0480 Ave N Shift Values>> N :: 121.46(4.28) 1.E154 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.8 E 0.09 M 0.09 HN Overlap>> 1.K161 1.K161 C Shift Assignments>> C :: 174.8550 CA :: 57.3130 CB :: 34.0660 CG :: 36.9110 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.6160 HA :: 4.4690 HB2 :: 1.7890 HB3 :: 2.0070 HG2 :: 2.3390 HG3 :: 2.3390 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.3730 Ave N Shift Values>> N :: 120.67(3.48) 1.G155 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.88 L 0.07 C 0.03 HN Overlap>> 1.G94 1.G94 C Shift Assignments>> C :: 177.1280 CA :: 45.9930 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.0000 HA2 :: 4.0520 HA3 :: 4.6340 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.5240 Ave N Shift Values>> N :: 109.67(3.87) 1.M156 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.29 Q 0.25 K 0.24 M 0.17 R 0.02 E 0.01 C Shift Assignments>> C :: 178.0190 CA :: 56.9090 CB :: 30.1240 CG :: 32.8010 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.9040 HA :: 4.3630 HB2 :: 2.0910 HB3 :: 2.0910 HG2 :: 2.5080 HG3 :: 2.5080 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 122.9840 Ave N Shift Values>> N :: 120.09(3.57) 1.E157 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.39 I 0.26 E 0.21 K 0.06 Q 0.04 C Shift Assignments>> C :: 179.1140 CA :: 59.7380 CB :: 27.8990 CG :: 35.9010 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.8790 HA :: 4.0930 HB2 :: 2.0740 HB3 :: 2.0740 HG2 :: 2.3930 HG3 :: 2.3930 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.1720 Ave N Shift Values>> N :: 120.67(3.48) 1.I158 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.73 C 0.26 C Shift Assignments>> C :: 178.2230 CA :: 63.2760 CB :: 36.0870 CG1 :: 28.1750 CG2 :: 17.1510 CD1 :: 12.2520 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.6790 HA :: 3.7620 HB :: 2.1720 HG12 :: 1.3420 HG13 :: 1.5160 HG21 :: 0.7570 HG22 :: 0.7570 HG23 :: 0.7570 HD11 :: 0.8940 HD12 :: 0.8940 HD13 :: 0.8940 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 122.2480 Ave N Shift Values>> N :: 121.46(4.28) 1.V159 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.86 C 0.13 C Shift Assignments>> C :: 177.7640 CA :: 67.1170 CB :: 30.5780 CG1 :: 20.6940 CG2 :: 23.3020 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.2050 HA :: 3.3090 HB :: 2.7750 HG11 :: 0.7840 HG12 :: 0.7840 HG13 :: 0.7840 HG21 :: 1.0660 HG22 :: 1.0660 HG23 :: 1.0660 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 121.4910 Ave N Shift Values>> N :: 121.14(4.54) 1.K160 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.66 K 0.32 C Shift Assignments>> C :: 179.2590 CA :: 57.8460 CB :: 30.1240 CG :: 23.7450 CD :: 28.4210 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.1310 HA :: 4.2440 HB2 :: 1.9390 HB3 :: 1.9390 HG2 :: 1.6070 HG3 :: 1.7040 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 116.4690 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K161 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.47 K 0.44 R 0.07 HN Overlap>> 1.E154 1.E154 C Shift Assignments>> C :: 179.4450 CA :: 59.4160 CB :: 31.8290 CG :: 24.3850 CD :: 29.0610 CE :: 41.7400 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.6000 HA :: 4.1130 HB2 :: 2.0240 HB3 :: 2.0240 HG2 :: 1.3650 HG3 :: 1.4530 HD2 :: 1.6870 HD3 :: 1.6860 HE2 :: 2.9310 HE3 :: 2.9310 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 122.4120 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I162 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.93 C 0.06 HN Overlap>> 1.K175 1.K175 C Shift Assignments>> C :: 177.2940 CA :: 66.2080 CB :: 37.5530 CG1 :: 27.7720 CG2 :: 17.8410 CD1 :: 13.5020 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.1850 HA :: 3.3710 HB :: 1.8980 HG12 :: 0.5960 HG13 :: 1.8740 HG21 :: 0.6610 HG22 :: 0.6610 HG23 :: 0.6610 HD11 :: 0.3460 HD12 :: 0.3460 HD13 :: 0.3460 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 119.9760 Ave N Shift Values>> N :: 121.46(4.28) 1.E163 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.4 E 0.37 I 0.12 K 0.04 M 0.03 Q 0.02 C Shift Assignments>> C :: 177.5610 CA :: 59.2840 CB :: 30.1240 CG :: 36.4430 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.4270 HA :: 3.4450 HB2 :: 1.8990 HB3 :: 2.4790 HG2 :: 2.2580 HG3 :: 2.0970 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.1820 Ave N Shift Values>> N :: 120.67(3.48) 1.S164 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.9260 CA :: 60.5980 CB :: 63.3780 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.5990 HA :: 4.3320 HB2 :: 4.0720 HB3 :: 4.0720 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 111.6470 Ave N Shift Values>> N :: 116.28(3.52) 1.L165 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.59 C 0.26 A 0.13 C Shift Assignments>> C :: 176.0720 CA :: 54.1290 CB :: 41.5960 CG :: 26.7480 CD1 :: 22.5150 CD2 :: 22.5150 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.8590 HA :: 4.5750 HB2 :: 2.0910 HB3 :: 2.0910 HG :: 0.8450 HD11 :: 0.8390 HD12 :: 0.8390 HD13 :: 0.8390 HD21 :: 0.8390 HD22 :: 0.8390 HD23 :: 0.8390 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.8490 Ave N Shift Values>> N :: 121.86(3.9) 1.G166 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.5 L 0.24 R 0.13 C 0.04 F 0.03 D 0.02 Y 0.01 C Shift Assignments>> C :: 171.4260 CA :: 44.4760 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.6010 HA2 :: 3.5930 HA3 :: 4.3590 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 105.5470 Ave N Shift Values>> N :: 109.67(3.87) 1.S167 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.85 T 0.14 HN Overlap>> 1.T88 1.T88 C Shift Assignments>> C :: 175.0390 CA :: 57.6370 CB :: 66.4830 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.9120 HB2 :: 3.9260 HB3 :: 3.9260 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 109.9010 Ave N Shift Values>> N :: 116.28(3.52) 1.Q168 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 Q 0.22 K 0.21 R 0.06 E 0.05 I 0.04 M 0.01 C Shift Assignments>> C :: 177.1180 CA :: 59.4860 CB :: 28.2030 CG :: 33.9320 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> HA :: 4.9040 HB2 :: 2.2140 HB3 :: 2.2140 HE21 :: 6.8390 HE22 :: 7.4930 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> NE2 :: 112.1290 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.S169 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 1.G55 1.G55 1.G124 1.G124 C Shift Assignments>> C :: 175.6010 CA :: 59.1320 CB :: 64.2370 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.0970 HA :: 4.4410 HB2 :: 4.0320 HB3 :: 4.1970 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 110.4160 Ave N Shift Values>> N :: 116.28(3.52) 1.G170 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.6 L 0.2 R 0.08 C 0.04 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.9840 CA :: 44.6780 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.9960 HA2 :: 3.9510 HA3 :: 4.2850 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.7520 Ave N Shift Values>> N :: 109.67(3.87) 1.T171 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 173.4770 CA :: 61.6150 CB :: 69.7290 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.5990 HA :: 4.7020 HB :: 4.4820 HG21 :: 1.3630 HG22 :: 1.3630 HG23 :: 1.3630 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 119.1120 Ave N Shift Values>> N :: 115.42(4.75) 1.P172 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.52 C 0.34 R 0.05 K 0.03 I 0.02 Q 0.02 C Shift Assignments>> C :: 177.1920 CA :: 62.2150 CB :: 32.7510 CG :: 27.3870 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.9650 HB2 :: 2.1970 HB3 :: 2.4640 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.K173 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.5 C 0.4 R 0.08 C Shift Assignments>> C :: 174.8890 CA :: 56.1510 CB :: 32.5990 CG :: 25.1240 CD :: 29.3560 CE :: 41.7080 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.1310 HA :: 4.3990 HB2 :: 1.6930 HB3 :: 2.1590 HG2 :: 1.4650 HG3 :: 1.4650 HD2 :: 1.7870 HD3 :: 1.7870 HE2 :: 3.0860 HE3 :: 3.0860 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 119.3550 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A174 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.46 C 0.2 P 0.14 K 0.08 A 0.08 C Shift Assignments>> C :: 174.7230 CA :: 50.4120 CB :: 24.0290 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.4380 HA :: 4.6840 HB1 :: 1.3360 HB2 :: 1.3360 HB3 :: 1.3360 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 118.6280 Ave N Shift Values>> N :: 123.23(3.54) 1.K175 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.44 C 0.34 R 0.19 HN Overlap>> 1.I162 1.I162 C Shift Assignments>> C :: 175.4480 CA :: 55.8980 CB :: 31.9430 CG :: 24.4830 CD :: 28.7650 CE :: 42.0530 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.2310 HA :: 4.4910 HB2 :: 1.9030 HB3 :: 1.9030 HG2 :: 1.4430 HG3 :: 1.4430 HD2 :: 1.7640 HD3 :: 1.7640 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 119.9380 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I176 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.65 I 0.34 C Shift Assignments>> C :: 174.7610 CA :: 60.9510 CB :: 39.9280 CG1 :: 27.0920 CG2 :: 19.9070 CD1 :: 16.2740 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.2020 HA :: 5.0390 HB :: 2.0920 HG12 :: 0.9110 HG13 :: 1.6350 HG21 :: 0.8570 HG22 :: 0.8570 HG23 :: 0.8570 HD11 :: 1.0150 HD12 :: 1.0150 HD13 :: 1.0150 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 132.3430 Ave N Shift Values>> N :: 121.46(4.28) 1.I177 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.69 I 0.26 G 0.02 A 0.02 HN Overlap>> 1.I25 1.I25 C Shift Assignments>> C :: 175.2570 CA :: 58.1220 CB :: 42.2530 CG1 :: 26.9450 CG2 :: 16.7080 CD1 :: 11.6720 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.9350 HA :: 4.9450 HB :: 1.7180 HG12 :: 1.1030 HG13 :: 1.2750 HG21 :: 0.6330 HG22 :: 0.6330 HG23 :: 0.6330 HD11 :: 0.7250 HD12 :: 0.7250 HD13 :: 0.7250 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 123.7470 Ave N Shift Values>> N :: 121.46(4.28) 1.I178 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.63 C 0.36 C Shift Assignments>> C :: 173.7550 CA :: 61.5080 CB :: 36.1370 CG1 :: 28.1750 CG2 :: 17.5450 CD1 :: 13.2210 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.0900 HA :: 4.1850 HB :: 1.7990 HG12 :: 0.1360 HG13 :: 1.3990 HG21 :: 0.2520 HG22 :: 0.2520 HG23 :: 0.2520 HD11 :: -0.2430 HD12 :: -0.2430 HD13 :: -0.2430 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 123.5520 Ave N Shift Values>> N :: 121.46(4.28) 1.A179 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Suspicious PRTL>> A 0.76 M 0.17 C 0.03 L 0.01 C Shift Assignments>> C :: 177.8070 CA :: 53.9210 CB :: 19.4230 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.7590 HA :: 4.0870 HB1 :: 1.3360 HB2 :: 1.3360 HB3 :: 1.3360 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 135.4740(S) Ave N Shift Values>> N :: 123.23(3.54) 1.D180 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.35 L 0.29 R 0.15 D 0.11 C 0.04 F 0.01 Y 0.01 HN Overlap>> 1.G60 1.G60 C Shift Assignments>> C :: 173.2580 CA :: 52.6130 CB :: 43.9710 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.0830 HA :: 4.8370 HB2 :: 2.5450 HB3 :: 2.9360 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 111.0430 Ave N Shift Values>> N :: 120.65(3.86) 1.C181 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.15 H 0.15 C 0.12 M 0.12 W 0.11 E 0.1 Q 0.1 K 0.09 C Shift Assignments>> C :: 172.3170 CA :: 55.5440 CB :: 30.9830 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.9320 HA :: 4.7420 HB2 :: 3.3010 HB3 :: 3.3010 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 116.1330 Ave N Shift Values>> N :: 120.17(4.64) 1.G182 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.86 L 0.08 C 0.02 C Shift Assignments>> C :: 170.4840 CA :: 45.4870 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 6.8200 HA2 :: 3.6440 HA3 :: 4.0890 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 103.0040 Ave N Shift Values>> N :: 109.67(3.87) 1.E183 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.4 M 0.31 E 0.24 Q 0.02 C Shift Assignments>> C :: 175.6890 CA :: 55.3920 CB :: 32.4480 CG :: 36.1270 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.9210 HA :: 5.0730 HB2 :: 1.9850 HB3 :: 1.8790 HG2 :: 2.5030 HG3 :: 2.2210 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.1020 Ave N Shift Values>> N :: 120.67(3.48) 1.I184 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.63 C 0.36 C Shift Assignments>> C :: 175.6870 CA :: 60.5810 CB :: 38.0580 CG1 :: 27.6650 CG2 :: 16.8860 CD1 :: 13.1640 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.4460 HA :: 4.3970 HB :: 1.8320 HG12 :: 1.1970 HG13 :: 1.5350 HG21 :: 0.9050 HG22 :: 0.9050 HG23 :: 0.9050 HD11 :: 0.8520 HD12 :: 0.8520 HD13 :: 0.8520 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 124.8930 Ave N Shift Values>> N :: 121.46(4.28) 1.T185 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.91 C 0.08 C Shift Assignments>> C :: 174.3060 CA :: 61.7610 CB :: 69.8460 CG2 :: 21.0890 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.4320 HA :: 4.4920 HB :: 4.2490 HG21 :: 1.2240 HG22 :: 1.2240 HG23 :: 1.2240 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 121.6350 Ave N Shift Values>> N :: 115.42(4.75) 1.E186 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.4 C 0.33 M 0.13 Q 0.05 K 0.04 I 0.01 C Shift Assignments>> C :: 176.0380 CA :: 56.1010 CB :: 30.5270 CG :: 36.2350 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.4540 HA :: 4.4030 HB2 :: 1.9530 HB3 :: 2.0810 HG2 :: 2.2610 HG3 :: 2.1430 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 123.6500 Ave N Shift Values>> N :: 120.67(3.48) 1.L187 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.64 C 0.28 R 0.02 A 0.02 G 0.01 C Shift Assignments>> C :: 177.1760 CA :: 55.2910 CB :: 42.3030 CG :: 26.8670 CD1 :: 23.3540 CD2 :: 24.8080 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> HA :: 4.3120 HB2 :: 1.5310 HB3 :: 1.5810 HG :: 1.5920 HD11 :: 0.8440 HD12 :: 0.8440 HD13 :: 0.8440 HD21 :: 0.8980 HD22 :: 0.8980 HD23 :: 0.8980 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) 1.E188 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H189 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H190 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H191 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H192 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H193 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H194 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable ########################################################################### Overall Results: #Consistent: 176 #Clerical: 0 #Suspicious: 17 #Anomalous: 0 #Mistyped: 1 #Indeterminable: 0 Typing Results: #Consistent: 185 #Suspicious: 0 #Mistyped: 1 #Indeterminable: 8 Shift Relative Order (SRO) Results: #Consistent: 194 #Suspicious: 0 C Shift Results: #Consistent: 748 #Duplicate: 0 #Unknown: 0 #Suspicious: 2 #Anomalous: 0 H Shift Results: #Consistent:1090 #Duplicate: 0 #Unknown: 0 #Suspicious: 25 #Anomalous: 0 N Shift Results: #Consistent: 174 #Duplicate: 0 #Unknown: 0 #Suspicious: 1 #Anomalous: 0 Error Summary: 1.P13 HB2 = 0.4480(S), Expected = 2.08, Std = 0.3500, ChiSquare = 3.1185e-06 1.K18 HA = 5.8370(S), Expected = 4.27, Std = 0.4400, ChiSquare = 3.6893e-04 1.K44 H = 10.7490(S), Expected = 8.19, Std = 0.6000, ChiSquare = 1.9990e-05 1.L52 HB2 = -0.2820(S), Expected = 1.61, Std = 0.3400, ChiSquare = 2.6259e-08 1.K61 H = 10.8770(S), Expected = 8.19, Std = 0.6000, ChiSquare = 7.5228e-06 1.K69 H = 5.7820(S), Expected = 8.19, Std = 0.6000, ChiSquare = 5.9867e-05 1.K69 HB2 = 0.6710(S), Expected = 1.78, Std = 0.2500, ChiSquare = 9.1646e-06 1.K69 HB3 = 0.8420(S), Expected = 1.74, Std = 0.2700, ChiSquare = 8.8125e-04 1.P72 HA = 5.7250(S), Expected = 4.40, Std = 0.3300, ChiSquare = 5.9408e-05 1.M81 HG2 = 0.9640(S), Expected = 2.42, Std = 0.3500, ChiSquare = 3.1825e-05 1.M81 HG3 = 0.9640(S), Expected = 2.39, Std = 0.3800, ChiSquare = 1.7499e-04 1.D86 H = 10.3290(S), Expected = 8.31, Std = 0.5800, ChiSquare = 4.9948e-04 1.D86 HB2 = 1.7610(S), Expected = 2.72, Std = 0.2600, ChiSquare = 2.2561e-04 1.S97 CB = 68.9900(S), Expected = 63.80, Std = 1.4800, ChiSquare = 4.5360e-04 1.I98 HG13 = -0.4310(S), Expected = 1.19, Std = 0.4100, ChiSquare = 7.6965e-05 1.S107 H = 6.1710(S), Expected = 8.28, Std = 0.5900, ChiSquare = 3.5080e-04 1.K109 Typing: Mistyped 1.K109 CE = 37.0910(S), Expected = 41.89, Std = 0.8200, ChiSquare = 4.8442e-09 1.L118 HB2 = -0.1970(S), Expected = 1.61, Std = 0.3400, ChiSquare = 1.0683e-07 1.L118 HB3 = -0.1130(S), Expected = 1.52, Std = 0.3600, ChiSquare = 5.7301e-06 1.L118 HG = 0.3460(S), Expected = 1.51, Std = 0.3300, ChiSquare = 4.1986e-04 1.L118 HD11 = -0.4960(S), Expected = 0.75, Std = 0.2800, ChiSquare = 8.5870e-06 1.L118 HD12 = -0.4960(S), Expected = 0.75, Std = 0.2800, ChiSquare = 8.5870e-06 1.L118 HD13 = -0.4960(S), Expected = 0.75, Std = 0.2800, ChiSquare = 8.5870e-06 1.S119 HB2 = 2.2480(S), Expected = 3.88, Std = 0.2500, ChiSquare = 6.6654e-11 1.N128 HB2 = 0.8850(S), Expected = 2.81, Std = 0.3100, ChiSquare = 5.3093e-10 1.N128 HB3 = 1.5580(S), Expected = 2.75, Std = 0.3300, ChiSquare = 3.0370e-04 1.G150 HA2 = 2.2290(S), Expected = 3.97, Std = 0.3700, ChiSquare = 2.5336e-06 1.A179 N = 135.4740(S), Expected = 123.23, Std = 3.5400, ChiSquare = 5.4267e-04