Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.K2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> K 0.48 C 0.42 R 0.09 C Shift Assignments>> CA :: 56.6000 CB :: 32.9500 CG :: 24.6500 CD :: 29.0600 CE :: 41.8400 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>> HA :: 4.3320 HB2 :: 1.8100 HB3 :: 1.8680 HG2 :: 1.4350 HG3 :: 1.4780 HD3 :: 1.7170 HE3 :: 3.0130 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) 1.L3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.59 C 0.28 R 0.07 G 0.04 C Shift Assignments>> CA :: 55.6200 CB :: 42.9600 CG :: 27.0000 CD1 :: 25.1400 CD2 :: 23.9700 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 :: 8.3470 HA :: 4.3970 HB2 :: 1.6070 HB3 :: 1.7120 HG :: 1.7500 HD11 :: 0.9620 HD12 :: 0.9620 HD13 :: 0.9620 HD21 :: 0.9480 HD22 :: 0.9480 HD23 :: 0.9480 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 123.1000 Ave N Shift Values>> N :: 121.86(3.9) 1.S4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 58.4000 CB :: 63.9500 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.0150 HA :: 4.3990 HB2 :: 4.1220 HB3 :: 4.3220 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 :: 116.7700 Ave N Shift Values>> N :: 116.28(3.52) 1.E5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.36 E 0.31 I 0.2 K 0.06 Q 0.03 C Shift Assignments>> CA :: 59.5500 CB :: 29.1000 CG :: 36.3000 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>> HA :: 4.0400 HB3 :: 2.1100 HG3 :: 2.4160 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) 1.Q6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 I 0.17 E 0.15 K 0.12 Q 0.1 R 0.01 C Shift Assignments>> CA :: 60.3900 CB :: 28.3600 CG :: 35.0300 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 :: 8.5550 HA :: 4.0500 HB3 :: 2.2490 HG2 :: 2.4900 HG3 :: 2.6800 HE21 :: 7.8030 HE22 :: 6.9200 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 :: 118.2400 NE2 :: 112.6000 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.59 L 0.31 R 0.08 C Shift Assignments>> CA :: 58.2800 CB :: 41.4600 CG :: 28.3400 CD1 :: 25.6600 CD2 :: 22.5100 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 :: 8.0960 HA :: 3.9890 HB2 :: 1.4050 HB3 :: 2.0070 HG :: 1.5720 HD11 :: 0.8910 HD12 :: 0.8910 HD13 :: 0.8910 HD21 :: 0.6610 HD22 :: 0.6610 HD23 :: 0.6610 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 :: 121.2900 Ave N Shift Values>> N :: 121.86(3.9) 1.K8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.5 K 0.4 R 0.08 C Shift Assignments>> CA :: 60.2700 CB :: 31.9500 CG :: 25.6300 CD :: 29.5100 CE :: 41.8000 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 :: 8.6690 HA :: 4.0090 HB3 :: 1.9520 HG2 :: 1.3970 HG3 :: 1.6050 HD3 :: 1.7060 HE3 :: 2.9800 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 :: 122.7100 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.H9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.47 W 0.27 H 0.25 C Shift Assignments>> CA :: 60.1000 CB :: 30.9030 CD2 :: 117.6680 CE1 :: 139.1500 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 :: 7.9520 HA :: 4.3280 HB2 :: 3.2050 HB3 :: 3.5190 HD2 :: 6.7600 HE1 :: 7.6900 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 121.1000 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.C10 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> I 0.41 P 0.38 C 0.15 V 0.03 C Shift Assignments>> CA :: 64.6600 CB :: 25.4500 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.0020 HA :: 3.7220 HB2 :: 0.6060(S) HB3 :: 2.7990 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 :: 118.2200 Ave N Shift Values>> N :: 120.17(4.64) 1.N11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.25 F 0.21 C 0.17 N 0.1 D 0.08 I 0.05 E 0.04 L 0.04 M 0.01 C Shift Assignments>> CA :: 56.4000 CB :: 38.4900 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 :: 8.4770 HA :: 4.3950 HB2 :: 2.8070 HB3 :: 2.9460 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 :: 120.4100 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.G12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.85 C 0.07 L 0.04 A 0.01 C Shift Assignments>> CA :: 47.1500 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.9010 HA2 :: 3.8440 HA3 :: 4.0780 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.7400 Ave N Shift Values>> N :: 109.67(3.87) 1.I13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.92 C 0.07 HN Overlap>> 1.L77 1.L77 C Shift Assignments>> CA :: 65.8000 CB :: 37.8700 CG1 :: 28.0400 CG2 :: 17.4700 CD1 :: 14.0100 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 :: 7.8690 HA :: 3.7990 HB :: 2.3760 HG12 :: 0.8060 HG13 :: 1.8730 HG21 :: 1.2650 HG22 :: 1.2650 HG23 :: 1.2650 HD11 :: 1.0050 HD12 :: 1.0050 HD13 :: 1.0050 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 :: 123.6300 Ave N Shift Values>> N :: 121.46(4.28) 1.L14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.47 C 0.41 R 0.09 G 0.01 C Shift Assignments>> CA :: 58.5000 CB :: 42.1400 CG :: 26.9500 CD1 :: 26.1700 CD2 :: 23.7200 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 :: 8.4160 HA :: 4.0810 HB2 :: 1.6950 HB3 :: 2.3730 HG :: 1.8130 HD11 :: 1.1280 HD12 :: 1.1280 HD13 :: 1.1280 HD21 :: 1.1010 HD22 :: 1.1010 HD23 :: 1.1010 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 :: 121.2900 Ave N Shift Values>> N :: 121.86(3.9) 1.K15 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.N62 1.N62 C Shift Assignments>> CA :: 59.8300 CB :: 32.1700 CG :: 25.4100 CD :: 29.2400 CE :: 41.8300 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 :: 8.2160 HA :: 3.9000 HB3 :: 1.9500 HG2 :: 1.4300 HG3 :: 1.6400 HD3 :: 1.7000 HE3 :: 2.9700 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 :: 116.2400 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 E 0.27 I 0.24 K 0.07 Q 0.03 C Shift Assignments>> CA :: 59.6600 CB :: 28.5500 CG :: 36.1200 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 :: 7.8550 HA :: 4.2470 HB2 :: 2.3110 HB3 :: 2.4020 HG2 :: 2.3270 HG3 :: 2.4670 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 :: 119.4880 Ave N Shift Values>> N :: 120.67(3.48) 1.L17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.54 L 0.42 R 0.01 C Shift Assignments>> CA :: 58.5000 CB :: 41.1800 CG :: 26.3300 CD1 :: 25.7400 CD2 :: 21.7200 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.0080 HA :: 4.1000 HB2 :: 1.5600 HB3 :: 2.3100 HG :: 2.4400 HD11 :: 0.9510 HD12 :: 0.9510 HD13 :: 0.9510 HD21 :: 0.8540 HD22 :: 0.8540 HD23 :: 0.8540 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 :: 120.8700 Ave N Shift Values>> N :: 121.86(3.9) 1.L18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.6 C 0.25 R 0.1 G 0.02 A 0.01 C Shift Assignments>> CA :: 55.0600 CB :: 42.6600 CG :: 27.0500 CD1 :: 25.7600 CD2 :: 23.9000 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 :: 7.5040 HA :: 4.3800 HB2 :: 1.6320 HB3 :: 1.7600 HG :: 1.7740 HD11 :: 0.8300 HD12 :: 0.8300 HD13 :: 0.8300 HD21 :: 0.8030 HD22 :: 0.8030 HD23 :: 0.8030 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 :: 115.1800 Ave N Shift Values>> N :: 121.86(3.9) 1.S19 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>> CA :: 58.9500 CB :: 65.3500 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.7970 HA :: 4.5820 HB2 :: 4.3440 HB3 :: 4.4370 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 :: 116.2300 Ave N Shift Values>> N :: 116.28(3.52) 1.K20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.43 K 0.42 R 0.13 C Shift Assignments>> CA :: 59.0650 CB :: 31.9500 CG :: 24.9500 CD :: 28.9400 CE :: 42.1200 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 :: 9.0100 HA :: 4.1420 HB2 :: 1.9020 HB3 :: 1.9440 HG3 :: 1.5770 HD3 :: 1.7440 HE3 :: 3.0300 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) 1.K21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 K 0.43 R 0.06 C Shift Assignments>> CA :: 58.7500 CB :: 32.6700 CG :: 23.7200 CD :: 29.0700 CE :: 41.6900 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 :: 7.8040 HA :: 3.9500 HB2 :: 1.2330 HB3 :: 1.6530 HG2 :: 0.8390 HG3 :: 0.8890 HD2 :: 1.5500 HD3 :: 1.6290 HE3 :: 2.9560 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 :: 118.4200 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.H22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.41 W 0.32 C 0.25 C Shift Assignments>> CA :: 54.2300 CB :: 31.5200 CD2 :: 119.2300 CE1 :: 139.1500 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 :: 6.6200 HA :: 4.6580 HB2 :: 2.7800 HB3 :: 3.3500 HD2 :: 7.5700 HE1 :: 8.0560 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 113.5200 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.A23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.48 M 0.32 C 0.08 V 0.03 L 0.03 I 0.03 HN Overlap>> 1.V93 1.V93 C Shift Assignments>> CA :: 55.6700 CB :: 19.5400 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.3600 HA :: 4.2350 HB1 :: 1.6100 HB2 :: 1.6100 HB3 :: 1.6100 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.3700 Ave N Shift Values>> N :: 123.23(3.54) 1.A24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.54 M 0.39 C 0.03 I 0.02 C Shift Assignments>> CA :: 54.8000 CB :: 18.6900 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.5250 HA :: 4.3790 HB1 :: 1.6120 HB2 :: 1.6120 HB3 :: 1.6120 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 117.1100 Ave N Shift Values>> N :: 123.23(3.54) 1.Y25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.89 Y 0.1 C Shift Assignments>> CA :: 54.6200 CB :: 38.5400 CD1 :: 134.4700 CD2 :: 134.4700 CE1 :: 120.7900 CE2 :: 120.7900 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 :: 6.9120 HA :: 5.2300 HB2 :: 3.1500 HB3 :: 3.6600 HD1 :: 7.0500 HD2 :: 7.0500 HE1 :: 6.9910 HE2 :: 6.9910 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 :: 110.5700 Ave N Shift Values>> N :: 120.52(4.2) 1.A26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.55 L 0.32 C 0.09 C Shift Assignments>> CA :: 52.3300 CB :: 21.9800 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.9020 HA :: 4.7850 HB1 :: 1.5470 HB2 :: 1.5470 HB3 :: 1.5470 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.1400 Ave N Shift Values>> N :: 123.23(3.54) 1.W27 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> W 0.53 C 0.46 C Shift Assignments>> CA :: 58.9700 CB :: 27.5000 CD1 :: 127.8200 CE3 :: 120.7900 CZ3 :: 121.5700 CH2 :: 124.0000 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 :: 6.8200 HA :: 2.7100(S) HB2 :: 2.9900 HB3 :: 3.3600 HD1 :: 7.7670 HE1 :: 9.6520 HE3 :: 7.1700 HZ2 :: 7.2470 HZ3 :: 6.8410 HH2 :: 7.0350 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 :: 115.1300 NE1 :: 129.7400 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) SRO Rule Breaks>> (HA > HB2 : 0.9942) (HA > HB3 : 0.9964) 1.P28 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Indeterminable PRTL>> P 0.78 C 0.21 C Shift Assignments>> CA :: 64.7800 CB :: 30.0500 CG :: 27.3300 CD :: 50.2000 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 :: 3.6800 HB2 :: -0.3060(A) HB3 :: 1.3600 HG2 :: -0.7800(A) HG3 :: 0.9800 HD2 :: 1.5000(S) HD3 :: 2.3900 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.F29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.61 C 0.38 C Shift Assignments>> CA :: 57.0700 CB :: 38.1000 CD1 :: 132.1200 CD2 :: 132.1200 CE1 :: 130.5600 CE2 :: 130.5600 CZ :: 129.9700 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 :: 7.7290 HA :: 4.6870 HB2 :: 2.7400 HB3 :: 4.0500 HD1 :: 7.2970 HD2 :: 7.2970 HE1 :: 7.2940 HE2 :: 7.2940 HZ :: 7.5570 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 :: 113.0300 Ave N Shift Values>> N :: 120.45(4.18) 1.Y30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.53 Y 0.46 C Shift Assignments>> CA :: 57.3700 CB :: 38.0200 CD1 :: 131.1470 CD2 :: 131.1470 CE1 :: 117.4700 CE2 :: 117.4700 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 :: 7.3920 HA :: 4.5470 HB3 :: 3.3300 HD1 :: 7.0770 HD2 :: 7.0770 HE1 :: 6.8760 HE2 :: 6.8760 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 117.8800 Ave N Shift Values>> N :: 120.52(4.2) 1.K31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.62 C 0.28 R 0.05 G 0.01 HN Overlap>> 1.R106 1.R106 C Shift Assignments>> CA :: 53.0700 CB :: 33.7900 CG :: 24.6200 CD :: 29.0200 CE :: 42.1200 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 :: 7.6830 HA :: 4.9700 HB2 :: 1.6300 HB3 :: 1.8700 HG3 :: 1.4930 HD2 :: 1.7600 HD3 :: 1.8300 HE3 :: 3.0600 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 :: 115.1700 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.71 C 0.28 C Shift Assignments>> CA :: 62.7700 CB :: 31.9100 CG :: 27.3500 CD :: 50.5900 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 :: 4.1300 HB2 :: 1.6280 HB3 :: 2.3000 HG2 :: 1.9800 HG3 :: 2.0400 HD2 :: 3.4910 HD3 :: 3.6780 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.V33 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> V 0.8 C 0.19 C Shift Assignments>> CA :: 64.4000 CB :: 32.2000 CG1 :: 22.2000 CG2 :: 19.7000 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 :: 8.4870 HA :: 3.3100 HB :: 1.2900 HG11 :: 0.7700 HG12 :: 0.7700 HG13 :: 0.7700 HG21 :: -0.2300(S) HG22 :: -0.2300(S) HG23 :: -0.2300(S) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 125.2900 Ave N Shift Values>> N :: 121.14(4.54) 1.D34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.53 D 0.24 C 0.06 L 0.06 F 0.04 Y 0.03 C Shift Assignments>> CA :: 51.6000 CB :: 39.6000 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 :: 8.3650 HA :: 4.6800 HB2 :: 2.4400 HB3 :: 3.0200 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 :: 129.7200 Ave N Shift Values>> N :: 120.65(3.86) 1.A35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.53 M 0.39 C 0.03 I 0.02 C Shift Assignments>> CA :: 54.9700 CB :: 18.8200 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.3870 HA :: 3.6670 HB1 :: 1.4940 HB2 :: 1.4940 HB3 :: 1.4940 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.8000 Ave N Shift Values>> N :: 123.23(3.54) 1.S36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 60.7000 CB :: 62.7000 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.4000 HA :: 4.2830 HB2 :: 3.9700 HB3 :: 4.0040 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 112.6700 Ave N Shift Values>> N :: 116.28(3.52) 1.A37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.67 M 0.28 C 0.02 C Shift Assignments>> CA :: 53.9700 CB :: 18.6700 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.7100 HA :: 4.1400 HB1 :: 1.4100 HB2 :: 1.4100 HB3 :: 1.4100 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.4000 Ave N Shift Values>> N :: 123.23(3.54) 1.L38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.56 C 0.24 R 0.11 G 0.05 A 0.03 C Shift Assignments>> CA :: 55.0700 CB :: 43.0800 CG :: 27.0500 CD1 :: 25.7000 CD2 :: 23.0600 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 :: 7.7500 HA :: 4.3070 HB3 :: 1.6030 HG :: 1.8050 HD11 :: 0.8570 HD12 :: 0.8570 HD13 :: 0.8570 HD21 :: 0.9440 HD22 :: 0.9440 HD23 :: 0.9440 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 :: 115.9000 Ave N Shift Values>> N :: 121.86(3.9) 1.G39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> G 0.88 L 0.06 C 0.03 C Shift Assignments>> CA :: 46.0800 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 3.7400 HA3 :: 4.0400 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 1.L40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.56 L 0.27 C 0.15 C Shift Assignments>> CA :: 52.0400 CB :: 40.0050 CG :: 25.9500 CD1 :: 26.0100 CD2 :: 21.5000 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 :: 8.1840 HA :: 4.7110 HB2 :: 1.6530 HB3 :: 1.7140 HG :: 1.4800 HD11 :: 0.6420 HD12 :: 0.6420 HD13 :: 0.6420 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 :: 120.0300 Ave N Shift Values>> N :: 121.86(3.9) 1.H41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> W 0.34 C 0.34 H 0.3 C Shift Assignments>> CA :: 58.6500 CB :: 30.5700 CD2 :: 119.4600 CE1 :: 138.9600 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> HA :: 4.4650 HB2 :: 3.0970 HB3 :: 3.2350 HD2 :: 7.0490 HE1 :: 7.8190 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) 1.D42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.37 N 0.24 L 0.17 F 0.06 C 0.05 Y 0.04 K 0.04 C Shift Assignments>> CA :: 52.6400 CB :: 40.8600 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 :: 8.3800 HA :: 4.7810 HB2 :: 2.5390 HB3 :: 3.1550 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 116.6200 Ave N Shift Values>> N :: 120.65(3.86) 1.Y43 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> Y 0.69 C 0.3 C Shift Assignments>> CA :: 63.6700 CB :: 39.4900 CD1 :: 132.3100 CD2 :: 132.3100 CE1 :: 116.8800 CE2 :: 116.8800 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 :: 7.6540 HA :: 3.5700 HB2 :: 2.2900 HB3 :: 2.7200 HD1 :: 5.2300(S) HD2 :: 5.2300(S) HE1 :: 6.0800 HE2 :: 6.0800 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 123.0300 Ave N Shift Values>> N :: 120.52(4.2) 1.H44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.35 H 0.34 C 0.29 C Shift Assignments>> CA :: 57.6000 CB :: 29.1100 CD2 :: 120.5900 CE1 :: 138.1700 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 :: 8.1600 HA :: 4.4970 HB2 :: 2.9300 HB3 :: 3.3050 HD2 :: 7.0890 HE1 :: 7.8800 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 113.0100 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.D45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.23 L 0.2 F 0.15 Y 0.12 K 0.12 C 0.07 N 0.05 I 0.01 R 0.01 C Shift Assignments>> CA :: 55.7700 CB :: 40.9800 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 :: 7.3500 HA :: 4.5070 HB2 :: 2.6950 HB3 :: 2.7770 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 :: 118.0010 Ave N Shift Values>> N :: 120.65(3.86) 1.I46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.69 C 0.3 C Shift Assignments>> CA :: 61.9700 CB :: 39.5500 CG1 :: 28.1600 CG2 :: 17.2700 CD1 :: 11.9200 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 :: 7.1100 HA :: 3.8950 HB :: 1.7320 HG12 :: 1.3710 HG13 :: 1.5890 HG21 :: 0.9390 HG22 :: 0.9390 HG23 :: 0.9390 HD11 :: 0.8630 HD12 :: 0.8630 HD13 :: 0.8630 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 :: 119.0900 Ave N Shift Values>> N :: 121.46(4.28) 1.I47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.93 A 0.05 C Shift Assignments>> CA :: 56.6400 CB :: 33.6100 CG1 :: 24.9000 CG2 :: 15.9870 CD1 :: 9.9040 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 :: 8.5010 HA :: 3.8680 HB :: 1.2920 HG12 :: 0.5230 HG13 :: 1.4200 HG21 :: 0.4540 HG22 :: 0.4540 HG23 :: 0.4540 HD11 :: 0.6860 HD12 :: 0.6860 HD13 :: 0.6860 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 :: 122.1300 Ave N Shift Values>> N :: 121.46(4.28) 1.K48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.42 C 0.36 R 0.2 C Shift Assignments>> CA :: 56.2900 CB :: 32.3990 CG :: 24.7000 CD :: 27.9900 CE :: 41.8500 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 :: 7.7690 HA :: 4.0660 HB3 :: 1.4840 HG2 :: 1.2200 HG3 :: 1.3500 HD3 :: 1.5550 HE3 :: 2.9530 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 :: 123.9900 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.H49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.45 W 0.3 C 0.24 C Shift Assignments>> CA :: 52.5700 CB :: 30.5300 CD2 :: 121.1800 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 :: 8.2580 HA :: 5.0500 HB3 :: 3.0880 HD2 :: 6.9400 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 :: 116.9900 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.P50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.71 C 0.28 C Shift Assignments>> CA :: 62.9900 CB :: 32.4300 CG :: 27.9000 CD :: 50.4700 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 :: 4.0650 HB2 :: 2.0360 HB3 :: 2.4100 HG2 :: 1.9600 HG3 :: 2.2300 HD2 :: 3.5870 HD3 :: 3.6450 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.M51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.64 M 0.3 A 0.04 C Shift Assignments>> CA :: 53.8600 CB :: 31.6500 CG :: 30.5000 CE :: 14.2100 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 :: 8.1860 HA :: 5.0600 HB2 :: 1.1800 HB3 :: 2.1100 HG2 :: 1.8150 HG3 :: 2.9900 HE1 :: 2.0200 HE2 :: 2.0200 HE3 :: 2.0200 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 :: 119.0600 Ave N Shift Values>> N :: 120.09(3.57) 1.D52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.34 R 0.21 G 0.19 D 0.13 C 0.04 F 0.02 Y 0.01 K 0.01 C Shift Assignments>> CA :: 53.3400 CB :: 43.7700 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 :: 7.3830 HA :: 4.7900 HB2 :: 2.3440 HB3 :: 2.5200 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 :: 120.1600 Ave N Shift Values>> N :: 120.65(3.86) 1.L53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.43 C 0.43 R 0.11 G 0.01 C Shift Assignments>> CA :: 58.2800 CB :: 42.4000 CG :: 26.9500 CD1 :: 25.9500 CD2 :: 22.2700 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.0700 HA :: 3.9890 HB2 :: 1.4600 HB3 :: 2.2200 HG :: 1.7520 HD11 :: 0.9620 HD12 :: 0.9620 HD13 :: 0.9620 HD21 :: 0.6630 HD22 :: 0.6630 HD23 :: 0.6630 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 :: 119.3200 Ave N Shift Values>> N :: 121.86(3.9) 1.S54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 62.4600 CB :: 61.6600 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.6690 HA :: 4.3370 HB2 :: 4.0670 HB3 :: 4.4720 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 :: 118.6000 Ave N Shift Values>> N :: 116.28(3.52) 1.T55 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>> CA :: 67.0700 CB :: 67.8000 CG2 :: 21.8000 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 :: 7.4180 HA :: 4.0030 HB :: 4.4260 HG21 :: 1.2070 HG22 :: 1.2070 HG23 :: 1.2070 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 :: 125.4200 Ave N Shift Values>> N :: 115.42(4.75) 1.V56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.85 C 0.14 C Shift Assignments>> CA :: 65.6000 CB :: 31.9000 CG1 :: 23.0800 CG2 :: 22.2500 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 :: 7.4920 HA :: 4.2810 HB :: 2.1030 HG11 :: 1.1490 HG12 :: 1.1490 HG13 :: 1.1490 HG21 :: 0.8800 HG22 :: 0.8800 HG23 :: 0.8800 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 :: 122.7800 Ave N Shift Values>> N :: 121.14(4.54) 1.K57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 K 0.43 R 0.03 C Shift Assignments>> CA :: 60.0500 CB :: 32.9000 CG :: 24.6300 CD :: 29.9010 CE :: 41.8500 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 :: 8.4330 HA :: 4.0100 HB2 :: 1.8400 HB3 :: 2.0990 HG2 :: 1.4400 HG3 :: 1.4910 HD3 :: 1.6490 HE3 :: 2.9740 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 :: 118.8400 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.R58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.46 R 0.42 G 0.07 K 0.03 HN Overlap>> 1.D101 1.D101 C Shift Assignments>> CA :: 59.5500 CB :: 29.7700 CG :: 27.1400 CD :: 43.3200 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 :: 7.8650 HA :: 4.1070 HB2 :: 2.0000 HB3 :: 2.0400 HG2 :: 1.6580 HG3 :: 1.7780 HD3 :: 3.2550 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 :: 120.2000 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.K59 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.56 K 0.33 R 0.1 C Shift Assignments>> CA :: 59.8000 CB :: 31.7700 CG :: 26.3800 CD :: 28.7700 CE :: 41.4000 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 :: 8.4360 HA :: 4.1020 HB2 :: 0.8480(S) HB3 :: 1.9180 HG2 :: 1.2520 HG3 :: 1.8770 HD2 :: 1.4800 HD3 :: 1.6310 HE2 :: 2.4000 HE3 :: 2.5300 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 :: 119.5350 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.M60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 M 0.44 A 0.02 C Shift Assignments>> CA :: 57.7400 CB :: 31.5000 CG :: 32.6700 CE :: 17.8100 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 :: 8.8000 HA :: 4.6670 HB2 :: 2.3940 HB3 :: 2.5250 HG2 :: 2.5430 HG3 :: 2.9460 HE1 :: 1.7380 HE2 :: 1.7380 HE3 :: 1.7380 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 :: 119.8500 Ave N Shift Values>> N :: 120.09(3.57) 1.E61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.38 E 0.32 I 0.22 K 0.04 Q 0.01 C Shift Assignments>> CA :: 59.1200 CB :: 29.2160 CG :: 36.8500 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 :: 8.8370 HA :: 4.0170 HB2 :: 2.0540 HB3 :: 2.2180 HG2 :: 2.3570 HG3 :: 2.5640 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 121.4000 Ave N Shift Values>> N :: 120.67(3.48) 1.N62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.58 D 0.13 C 0.09 Y 0.06 F 0.05 L 0.03 M 0.01 HN Overlap>> 1.K15 1.K15 C Shift Assignments>> CA :: 52.8000 CB :: 38.4800 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 :: 8.1220 HA :: 4.6400 HB2 :: 2.7030 HB3 :: 2.8840 HD21 :: 8.0700 HD22 :: 6.7600 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 :: 116.2200 ND2 :: 113.6900 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.R63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.43 C 0.29 K 0.16 G 0.05 R 0.04 C Shift Assignments>> CA :: 56.3400 CB :: 25.6000 CG :: 27.5900 CD :: 43.2100 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 :: 7.8380 HA :: 4.3390 HB2 :: 2.0170 HB3 :: 2.2080 HG2 :: 1.5930 HG3 :: 1.6350 HD2 :: 3.1910 HD3 :: 3.3010 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 :: 114.1100 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.D64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.23 K 0.21 D 0.18 F 0.12 Y 0.08 R 0.06 C 0.05 N 0.02 C Shift Assignments>> CA :: 55.8800 CB :: 41.7600 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 :: 8.6270 HA :: 4.5150 HB2 :: 2.0470 HB3 :: 2.4260 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 116.2600 Ave N Shift Values>> N :: 120.65(3.86) 1.Y65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.4 Y 0.34 C 0.25 C Shift Assignments>> CA :: 57.6100 CB :: 38.4880 CD1 :: 131.7300 CD2 :: 131.7300 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 :: 7.1410 HA :: 4.9070 HB2 :: 2.8910 HB3 :: 3.1240 HD1 :: 7.1830 HD2 :: 7.1830 HE1 :: 7.1400 HE2 :: 7.1400 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 :: 115.4900 Ave N Shift Values>> N :: 120.52(4.2) 1.R66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.42 C 0.39 K 0.13 G 0.04 C Shift Assignments>> CA :: 57.2000 CB :: 30.9500 CG :: 27.6500 CD :: 43.1000 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 9.6270 HA :: 4.2630 HB3 :: 1.9150 HG2 :: 1.7780 HG3 :: 1.8560 HD3 :: 3.2970 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 :: 123.4500 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.D67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.32 D 0.24 R 0.17 G 0.06 K 0.05 C 0.04 F 0.03 N 0.03 Y 0.01 C Shift Assignments>> CA :: 52.6000 CB :: 42.9600 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 :: 7.6180 HA :: 4.5530 HB2 :: 2.9810 HB3 :: 3.1540 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 :: 112.8500 Ave N Shift Values>> N :: 120.65(3.86) 1.A68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.68 L 0.1 M 0.09 C 0.08 V 0.02 C Shift Assignments>> CA :: 54.5000 CB :: 20.4100 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.9800 HA :: 4.2560 HB1 :: 1.4940 HB2 :: 1.4940 HB3 :: 1.4940 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.7300 Ave N Shift Values>> N :: 123.23(3.54) 1.Q69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.44 Q 0.16 K 0.11 I 0.11 E 0.1 R 0.05 C Shift Assignments>> CA :: 59.5060 CB :: 27.5200 CG :: 34.7000 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 :: 8.5100 HA :: 4.2270 HB2 :: 2.1310 HB3 :: 2.3630 HG3 :: 2.5380 HE21 :: 7.6340 HE22 :: 6.9120 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 :: 118.0100 NE2 :: 112.3000 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 E 0.31 I 0.09 M 0.05 C Shift Assignments>> CA :: 59.4900 CB :: 31.0300 CG :: 37.1000 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 :: 8.4100 HA :: 4.1040 HB2 :: 2.4000 HB3 :: 2.4400 HG2 :: 2.4070 HG3 :: 2.8160 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 :: 122.0400 Ave N Shift Values>> N :: 120.67(3.48) 1.F71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 F 0.47 C Shift Assignments>> CA :: 60.3300 CB :: 38.0300 CD1 :: 133.1000 CD2 :: 133.1000 CE1 :: 129.9700 CE2 :: 129.9700 CZ :: 128.9900 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 :: 6.8130 HA :: 3.3390 HB2 :: 2.1370 HB3 :: 3.2360 HD1 :: 7.1210 HD2 :: 7.1210 HE1 :: 7.1420 HE2 :: 7.1420 HZ :: 7.0380 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 :: 120.9400 Ave N Shift Values>> N :: 120.45(4.18) 1.A72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.59 A 0.35 I 0.02 C 0.01 C Shift Assignments>> CA :: 54.7000 CB :: 17.3300 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.5320 HA :: 3.3760 HB1 :: 1.1560 HB2 :: 1.1560 HB3 :: 1.1560 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.6100 Ave N Shift Values>> N :: 123.23(3.54) 1.A73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.58 A 0.35 I 0.03 C 0.02 C Shift Assignments>> CA :: 54.9500 CB :: 17.6300 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.0270 HA :: 4.0100 HB1 :: 1.5030 HB2 :: 1.5030 HB3 :: 1.5030 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 117.9900 Ave N Shift Values>> N :: 123.23(3.54) 1.D74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.26 Y 0.26 C 0.13 D 0.12 L 0.09 I 0.05 N 0.04 C Shift Assignments>> CA :: 56.9200 CB :: 39.6900 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 :: 7.1640 HA :: 4.5240 HB2 :: 2.6410 HB3 :: 2.8000 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 :: 119.8500 Ave N Shift Values>> N :: 120.65(3.86) 1.V75 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> V 0.93 C 0.06 C Shift Assignments>> CA :: 67.0500 CB :: 31.0300 CG1 :: 21.7850 CG2 :: 20.8300 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 :: 7.2560 HA :: 2.6700 HB :: 0.7730(S) HG11 :: -0.1540(S) HG12 :: -0.1540(S) HG13 :: -0.1540(S) HG21 :: -0.4560(S) HG22 :: -0.4560(S) HG23 :: -0.4560(S) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 120.0600 Ave N Shift Values>> N :: 121.14(4.54) 1.R76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.63 R 0.17 G 0.11 K 0.07 C Shift Assignments>> CA :: 60.7500 CB :: 30.2580 CG :: 29.2900 CD :: 43.3000 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 :: 8.3720 HA :: 3.8660 HB2 :: 1.5800 HB3 :: 1.7950 HG2 :: 1.6190 HG3 :: 1.9030 HD3 :: 3.0250 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 :: 115.3700 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.L77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.46 C 0.39 R 0.12 G 0.01 HN Overlap>> 1.I13 1.I13 C Shift Assignments>> CA :: 57.6500 CB :: 42.1800 CG :: 27.4400 CD1 :: 25.9000 CD2 :: 23.0200 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 :: 7.7940 HA :: 4.1020 HB2 :: 1.6440 HB3 :: 2.1310 HG :: 1.4050 HD11 :: 0.8690 HD12 :: 0.8690 HD13 :: 0.8690 HD21 :: 1.0090 HD22 :: 1.0090 HD23 :: 1.0090 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 123.6300 Ave N Shift Values>> N :: 121.86(3.9) 1.M78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.61 M 0.35 I 0.02 C Shift Assignments>> CA :: 59.5700 CB :: 33.7630 CG :: 31.0300 CE :: 16.7800 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 :: 7.2670 HA :: 3.5930 HB2 :: 1.2410 HB3 :: 2.1450 HG2 :: 1.4600 HG3 :: 2.5350 HE1 :: 0.8650 HE2 :: 0.8650 HE3 :: 0.8650 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 :: 117.7000 Ave N Shift Values>> N :: 120.09(3.57) 1.F79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.55 F 0.44 C Shift Assignments>> CA :: 60.5100 CB :: 37.2000 CD1 :: 130.9500 CD2 :: 130.9500 CE1 :: 130.7500 CE2 :: 130.7500 CZ :: 127.0400 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 :: 7.0140 HA :: 3.8840 HB2 :: 2.7600 HB3 :: 2.9500 HD1 :: 6.6800 HD2 :: 6.6800 HE1 :: 6.5260 HE2 :: 6.5260 HZ :: 6.3650 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 :: 117.7000 Ave N Shift Values>> N :: 120.45(4.18) 1.S80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.24 T 0.22 I 0.18 P 0.14 S 0.09 C 0.05 F 0.02 Y 0.01 W 0.01 C Shift Assignments>> CB :: 62.5000 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.0200 HA :: 4.0400 HB2 :: 4.0590 HB3 :: 4.1570 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 115.7250 Ave N Shift Values>> N :: 116.28(3.52) 1.N81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.3 C 0.16 Y 0.15 F 0.12 D 0.08 E 0.06 M 0.03 L 0.02 I 0.01 C Shift Assignments>> CA :: 54.9000 CB :: 38.0040 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 :: 8.9100 HA :: 4.3450 HB2 :: 2.5910 HB3 :: 2.9490 HD21 :: 7.6260 HD22 :: 6.5670 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 :: 119.4300 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.C82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.4 P 0.27 C 0.21 K 0.03 R 0.02 W 0.01 V 0.01 C Shift Assignments>> CA :: 62.2400 CB :: 25.8000 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.0380 HA :: 4.2110 HB2 :: 3.0790 HB3 :: 3.2200 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 120.0300 Ave N Shift Values>> N :: 120.17(4.64) 1.Y83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.55 C 0.44 C Shift Assignments>> CA :: 57.1200 CB :: 37.0400 CD1 :: 132.1300 CD2 :: 132.1300 CE1 :: 118.0500 CE2 :: 118.0500 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 :: 7.9770 HA :: 4.7710 HB3 :: 3.0450 HD1 :: 7.0800 HD2 :: 7.0800 HE1 :: 6.9970 HE2 :: 6.9970 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 117.8800 Ave N Shift Values>> N :: 120.52(4.2) 1.K84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> K 0.91 R 0.07 C Shift Assignments>> CB :: 32.9700 CD :: 29.2400 CE :: 41.8000 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>> HB2 :: 1.8900 HB3 :: 2.0200 HD3 :: 1.7060 HE2 :: 2.9980 HE3 :: 3.0400 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) 1.Y85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.76 C 0.23 C Shift Assignments>> CA :: 62.0700 CB :: 40.5040 CD1 :: 132.7100 CD2 :: 132.7100 CE1 :: 118.2500 CE2 :: 118.2500 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 :: 8.2710 HA :: 4.0270 HB2 :: 2.9100 HB3 :: 2.9400 HD1 :: 6.8360 HD2 :: 6.8360 HE1 :: 6.6820 HE2 :: 6.6820 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 :: 116.4700 Ave N Shift Values>> N :: 120.52(4.2) 1.N86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.36 N 0.29 L 0.15 C 0.05 F 0.05 Y 0.03 K 0.02 C Shift Assignments>> CA :: 52.1800 CB :: 40.7100 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 :: 7.4390 HA :: 4.7420 HB2 :: 2.1800 HB3 :: 2.6410 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 113.7500 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.P87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.53 C 0.46 C Shift Assignments>> CA :: 61.6300 CB :: 31.2200 CG :: 28.0700 CD :: 50.4500 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 :: 4.7930 HB3 :: 2.1700 HG2 :: 2.2100 HG3 :: 2.2700 HD2 :: 3.5850 HD3 :: 4.0590 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.P88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.85 C 0.14 C Shift Assignments>> CA :: 64.8700 CB :: 31.1600 CG :: 27.4000 CD :: 50.4200 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 :: 4.3330 HB2 :: 2.1800 HB3 :: 2.5200 HG2 :: 2.0590 HG3 :: 2.1050 HD3 :: 3.8270 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.D89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.43 D 0.27 L 0.08 C 0.06 F 0.06 Y 0.05 C Shift Assignments>> CA :: 52.8200 CB :: 39.6990 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 :: 8.2440 HA :: 4.6390 HB2 :: 2.6330 HB3 :: 2.9040 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 :: 114.1100 Ave N Shift Values>> N :: 120.65(3.86) 1.H90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 H 0.28 W 0.21 C Shift Assignments>> CA :: 58.6500 CB :: 32.7700 CD2 :: 118.0500 CE1 :: 137.5000 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 :: 7.9190 HA :: 4.3170 HB2 :: 3.0200 HB3 :: 3.2650 HD2 :: 7.1610 HE1 :: 7.4900 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 :: 122.5150 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.D91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.28 Y 0.24 C 0.11 L 0.1 K 0.08 I 0.07 D 0.07 C Shift Assignments>> CA :: 58.1000 CB :: 40.6600 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 :: 8.9170 HA :: 4.5240 HB2 :: 2.6250 HB3 :: 2.7980 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 :: 130.9990 Ave N Shift Values>> N :: 120.65(3.86) 1.V92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.84 C 0.15 C Shift Assignments>> CA :: 65.3500 CB :: 31.6500 CG1 :: 23.1100 CG2 :: 21.7300 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 :: 7.2990 HA :: 4.1950 HB :: 2.2000 HG11 :: 0.9490 HG12 :: 0.9490 HG13 :: 0.9490 HG21 :: 0.7750 HG22 :: 0.7750 HG23 :: 0.7750 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.V93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.66 V 0.33 HN Overlap>> 1.A23 1.A23 C Shift Assignments>> CA :: 66.5600 CB :: 31.5500 CG1 :: 25.5200 CG2 :: 21.7700 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 :: 7.3520 HA :: 3.9520 HB :: 2.4670 HG11 :: 1.2810 HG12 :: 1.2810 HG13 :: 1.2810 HG21 :: 1.1860 HG22 :: 1.1860 HG23 :: 1.1860 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 :: 122.4300 Ave N Shift Values>> N :: 121.14(4.54) 1.A94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.56 A 0.37 I 0.03 C 0.02 C Shift Assignments>> CA :: 54.9400 CB :: 17.7800 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.1700 HA :: 4.2030 HB1 :: 1.6160 HB2 :: 1.6160 HB3 :: 1.6160 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.3700 Ave N Shift Values>> N :: 123.23(3.54) 1.M95 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.89 M 0.1 C Shift Assignments>> CA :: 60.5400 CB :: 32.3800 CG :: 33.9400 CE :: 19.0500 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 :: 8.0330 HA :: 4.0940 HB2 :: 2.3200 HB3 :: 3.1950(S) HG2 :: 2.7120 HG3 :: 3.0350 HE1 :: 2.1830 HE2 :: 2.1830 HE3 :: 2.1830 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 :: 118.9000 Ave N Shift Values>> N :: 120.09(3.57) 1.A96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.54 M 0.2 C 0.1 L 0.07 V 0.04 I 0.01 T 0.01 C Shift Assignments>> CA :: 55.4500 CB :: 20.0200 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.6100 HA :: 3.8890 HB1 :: 1.9130 HB2 :: 1.9130 HB3 :: 1.9130 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.2900 Ave N Shift Values>> N :: 123.23(3.54) 1.R97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.44 R 0.43 K 0.08 G 0.03 C Shift Assignments>> CA :: 58.8300 CB :: 29.7700 CG :: 27.6200 CD :: 42.8400 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 :: 8.4220 HA :: 3.9250 HB3 :: 1.8400 HG2 :: 1.7660 HG3 :: 1.8910 HD3 :: 3.0300 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 :: 115.9700 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.K98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.47 K 0.46 R 0.06 C Shift Assignments>> CA :: 59.0600 CB :: 32.2800 CG :: 25.0700 CD :: 29.0400 CE :: 41.6400 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 :: 7.4300 HA :: 3.8990 HB2 :: 1.1040 HB3 :: 1.5730 HG2 :: 0.8560 HG3 :: 1.2720 HD2 :: 1.1080 HD3 :: 1.2830 HE3 :: 2.6550 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 :: 118.9500 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L99 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.55 C 0.34 R 0.08 G 0.01 C Shift Assignments>> CA :: 56.9300 CB :: 42.1800 CG :: 26.9200 CD1 :: 25.8500 CD2 :: 24.8500 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 :: 8.3200 HA :: 4.1690 HB2 :: 1.6640 HB3 :: 2.1240 HG :: 1.9400 HD11 :: 1.1020 HD12 :: 1.1020 HD13 :: 1.1020 HD21 :: 1.2090 HD22 :: 1.2090 HD23 :: 1.2090 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 :: 120.9300 Ave N Shift Values>> N :: 121.86(3.9) 1.Q100 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.57 K 0.27 I 0.06 Q 0.03 V 0.02 R 0.01 C Shift Assignments>> CA :: 59.7900 CB :: 25.1700 CG :: 34.7300 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 :: 9.2200 HA :: 3.3810 HB2 :: 0.0660(S) HB3 :: 1.5970 HG2 :: 2.0730 HG3 :: 2.5380 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 :: 121.6200 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.D101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.25 D 0.19 Y 0.18 I 0.11 N 0.09 L 0.07 C 0.05 K 0.01 HN Overlap>> 1.R58 1.R58 C Shift Assignments>> CB :: 40.2650 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 :: 7.8800 HB3 :: 2.7870 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 :: 120.2000 Ave N Shift Values>> N :: 120.65(3.86) 1.V102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.99 C Shift Assignments>> CB :: 31.6200 CG1 :: 21.8900 CG2 :: 20.4400 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 :: 7.0020 HA :: 3.6400 HB :: 2.2700 HG11 :: 1.0580 HG12 :: 1.0580 HG13 :: 1.0580 HG21 :: 0.6510 HG22 :: 0.6510 HG23 :: 0.6510 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.F103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.76 C 0.23 C Shift Assignments>> CA :: 62.4700 CB :: 39.4500 CD1 :: 132.1200 CD2 :: 132.1200 CE1 :: 130.9500 CE2 :: 130.9500 CZ :: 129.1900 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 :: 8.2860 HA :: 3.9830 HB2 :: 3.2180 HB3 :: 3.3540 HD1 :: 7.2220 HD2 :: 7.2220 HE1 :: 7.1480 HE2 :: 7.1480 HZ :: 6.4700 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 :: 118.0600 Ave N Shift Values>> N :: 120.45(4.18) 1.E104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 E 0.3 K 0.12 I 0.11 Q 0.09 C Shift Assignments>> CA :: 58.3700 CB :: 28.5000 CG :: 35.8000 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 :: 9.5660 HA :: 3.7900 HB2 :: 2.1600 HB3 :: 2.2100 HG2 :: 2.5500 HG3 :: 2.8500 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 :: 117.3400 Ave N Shift Values>> N :: 120.67(3.48) 1.F105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> H 0.39 Y 0.29 W 0.17 F 0.12 C Shift Assignments>> CE1 :: 132.1200 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 :: 7.9000 HD1 :: 7.2810 HD2 :: 7.2810 HE1 :: 7.0700 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) 1.R106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.46 R 0.28 K 0.23 HN Overlap>> 1.K31 1.K31 C Shift Assignments>> CA :: 57.2600 CB :: 30.2800 CG :: 27.5900 CD :: 41.6600 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 :: 7.7500 HA :: 4.0030 HB2 :: 1.8320 HB3 :: 1.9330 HG2 :: 1.7400 HG3 :: 2.0500 HD2 :: 3.2100 HD3 :: 3.3100 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 :: 115.1600 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.Y107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.64 C 0.35 C Shift Assignments>> CA :: 62.0000 CB :: 38.2400 CD1 :: 132.5100 CD2 :: 132.5100 CE1 :: 119.0300 CE2 :: 119.0300 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 9.3500 HA :: 3.8690 HB2 :: 2.1830 HB3 :: 2.4370 HD1 :: 6.9620 HD2 :: 6.9620 HE1 :: 6.8460 HE2 :: 6.8460 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 123.9500 Ave N Shift Values>> N :: 120.52(4.2) 1.A108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.21 A 0.17 D 0.14 L 0.08 M 0.06 H 0.05 R 0.04 Q 0.04 C 0.03 K 0.03 W 0.02 F 0.02 E 0.02 Y 0.01 C Shift Assignments>> CA :: 53.7400 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.5410 HA :: 4.0480 HB1 :: 1.5720 HB2 :: 1.5720 HB3 :: 1.5720 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 118.7800 Ave N Shift Values>> N :: 123.23(3.54) 1.K109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.43 C 0.27 R 0.27 C Shift Assignments>> CA :: 54.4000 CB :: 31.4500 CG :: 24.4000 CD :: 28.3200 CE :: 42.1200 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 :: 6.8470 HA :: 4.2320 HB2 :: 1.7050 HB3 :: 2.0280 HG3 :: 1.3710 HD3 :: 1.4900 HE2 :: 2.7490 HE3 :: 2.8800 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 :: 114.8200 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.M110 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.38 M 0.31 A 0.29 C Shift Assignments>> CA :: 53.7500 CB :: 33.6500 CG :: 29.7700 CE :: 16.2100 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 :: 6.9140 HA :: 3.2670 HB2 :: 1.6890 HB3 :: 1.7420 HG2 :: 2.1600 HG3 :: 2.4880 HE1 :: 1.7560 HE2 :: 1.7560 HE3 :: 1.7560 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 :: 122.2200 Ave N Shift Values>> N :: 120.09(3.57) 1.P111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.74 C 0.25 C Shift Assignments>> CA :: 63.2000 CB :: 32.0400 CG :: 27.3300 CD :: 50.8200 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 :: 4.3100 HB2 :: 1.8910 HB3 :: 2.2490 HG2 :: 1.8150 HG3 :: 1.9050 HD2 :: 3.0920 HD3 :: 3.3030 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.D112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.25 K 0.2 R 0.14 D 0.14 F 0.09 Y 0.06 C 0.05 N 0.01 C Shift Assignments>> CA :: 55.9100 CB :: 42.3000 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 :: 7.8950 HA :: 4.2570 HB2 :: 2.4960 HB3 :: 2.6070 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 :: 126.2000 Ave N Shift Values>> N :: 120.65(3.86) 2.H1 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.44 H 0.29 W 0.25 C Shift Assignments>> CA :: 56.7180 CB :: 33.5300 CD2 :: 119.8600 CE1 :: 138.8230 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> HA :: 3.8810 HB3 :: 2.9700 HD2 :: 6.9680 HE1 :: 7.7380 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) 2.N2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> N 0.51 D 0.18 C 0.09 F 0.07 Y 0.07 L 0.05 C Shift Assignments>> CA :: 53.1300 CB :: 38.8700 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>> HA :: 4.6800 HB2 :: 2.6940 HB3 :: 2.7930 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) 2.L3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.97 G 0.02 C Shift Assignments>> CB :: 42.3900 CG :: 26.9000 CD1 :: 24.8700 CD2 :: 23.4600 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 :: 4.3900 HB3 :: 1.5600 HG :: 1.5300 HD11 :: 0.9020 HD12 :: 0.9020 HD13 :: 0.9020 HD21 :: 0.8450 HD22 :: 0.8450 HD23 :: 0.8450 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) 2.L4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.49 R 0.32 K 0.08 I 0.07 G 0.01 C Shift Assignments>> CB :: 42.3900 CG :: 26.9000 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 :: 4.3300 HB3 :: 1.6600 HG :: 1.6200 HD11 :: 0.9020 HD12 :: 0.9020 HD13 :: 0.9020 HD21 :: 0.8450 HD22 :: 0.8450 HD23 :: 0.8450 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) 2.R5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> R 0.49 C 0.38 G 0.06 K 0.05 C Shift Assignments>> CA :: 56.2600 CB :: 30.6400 CG :: 27.1000 CD :: 43.3500 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> HA :: 4.3400 HB2 :: 1.7440 HB3 :: 1.8300 HG2 :: 1.5650 HG3 :: 1.6240 HD3 :: 3.2030 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) 2.I6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> I 0.68 C 0.31 C Shift Assignments>> CA :: 61.2900 CB :: 38.6580 CG1 :: 27.3660 CG2 :: 17.5070 CD1 :: 12.8100 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>> HA :: 4.2460 HB :: 1.8700 HG12 :: 1.2200 HG13 :: 1.4800 HG21 :: 0.9400 HG22 :: 0.9400 HG23 :: 0.9400 HD11 :: 0.8900 HD12 :: 0.8900 HD13 :: 0.8900 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) 2.ALY7 Overall Status: Residue type ALY not supported. 2.Q8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> Q 0.47 K 0.35 M 0.06 E 0.06 R 0.01 I 0.01 P 0.01 C Shift Assignments>> CB :: 29.5600 CG :: 33.7280 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 :: 4.3300 HB2 :: 1.8830 HB3 :: 1.9140 HG3 :: 2.2140 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) 2.F9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> F 0.65 C 0.34 C Shift Assignments>> CA :: 57.6000 CB :: 39.4100 CD1 :: 131.5500 CD2 :: 131.5500 CE1 :: 131.8900 CE2 :: 131.8900 CZ :: 129.9040 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 :: 8.1580 HA :: 4.7300 HB2 :: 3.0700 HB3 :: 3.2400 HD1 :: 7.3380 HD2 :: 7.3380 HE1 :: 7.2410 HE2 :: 7.2410 HZ :: 7.2670 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) 2.L10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.97 G 0.02 C Shift Assignments>> CB :: 42.3900 CG :: 26.9000 CD1 :: 24.8700 CD2 :: 23.4600 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 :: 4.3000 HB3 :: 1.5600 HG :: 2.5300 HD11 :: 0.8800 HD12 :: 0.8800 HD13 :: 0.8800 HD21 :: 0.8350 HD22 :: 0.8350 HD23 :: 0.8350 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) 2.Q11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> Q 0.31 K 0.24 C 0.23 M 0.09 E 0.08 R 0.01 C Shift Assignments>> CA :: 55.8300 CB :: 29.7200 CG :: 33.9060 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 :: 4.3480 HB2 :: 1.9700 HB3 :: 2.1300 HG3 :: 2.3600 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) 2.S12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.84 T 0.15 C Shift Assignments>> CA :: 59.9590 CB :: 66.0150 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.9980 HA :: 4.2390 HB2 :: 3.6490 HB3 :: 3.8320 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) ########################################################################### Overall Results: #Consistent: 114 #Clerical: 0 #Suspicious: 8 #Anomalous: 1 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 122 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 1 Shift Relative Order (SRO) Results: #Consistent: 122 #Suspicious: 1 C Shift Results: #Consistent: 443 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 806 #Duplicate: 0 #Unknown: 0 #Suspicious: 18 #Anomalous: 2 N Shift Results: #Consistent: 100 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.C10 HB2 = 0.6060(S), Expected = 2.96, Std = 0.4400, ChiSquare = 8.7954e-08 1.W27 HA = 2.7100(S), Expected = 4.68, Std = 0.5300, ChiSquare = 2.0162e-04 1.W27 SRO Rule Break>> HA > HB2 : 0.994219653179191 1.W27 SRO Rule Break>> HA > HB3 : 0.996420047732697 1.P28 HB2 = -0.3060(A), Expected = 2.08, Std = 0.3500, ChiSquare = 9.2869e-12 1.P28 HG2 = -0.7800(A), Expected = 1.93, Std = 0.3100, ChiSquare = 2.2915e-18 1.P28 HD2 = 1.5000(S), Expected = 3.65, Std = 0.3500, ChiSquare = 8.1050e-10 1.V33 HG21 = -0.2300(S), Expected = 0.80, Std = 0.2800, ChiSquare = 2.3454e-04 1.V33 HG22 = -0.2300(S), Expected = 0.80, Std = 0.2800, ChiSquare = 2.3454e-04 1.V33 HG23 = -0.2300(S), Expected = 0.80, Std = 0.2800, ChiSquare = 2.3454e-04 1.Y43 HD1 = 5.2300(S), Expected = 6.93, Std = 0.3000, ChiSquare = 1.4560e-08 1.Y43 HD2 = 5.2300(S), Expected = 6.93, Std = 0.3000, ChiSquare = 1.4560e-08 1.K59 HB2 = 0.8480(S), Expected = 1.78, Std = 0.2500, ChiSquare = 1.9301e-04 1.V75 HB = 0.7730(S), Expected = 1.98, Std = 0.3200, ChiSquare = 1.6203e-04 1.V75 HG11 = -0.1540(S), Expected = 0.83, Std = 0.2600, ChiSquare = 1.5395e-04 1.V75 HG12 = -0.1540(S), Expected = 0.83, Std = 0.2600, ChiSquare = 1.5395e-04 1.V75 HG13 = -0.1540(S), Expected = 0.83, Std = 0.2600, ChiSquare = 1.5395e-04 1.V75 HG21 = -0.4560(S), Expected = 0.80, Std = 0.2800, ChiSquare = 7.2670e-06 1.V75 HG22 = -0.4560(S), Expected = 0.80, Std = 0.2800, ChiSquare = 7.2670e-06 1.V75 HG23 = -0.4560(S), Expected = 0.80, Std = 0.2800, ChiSquare = 7.2670e-06 1.M95 HB3 = 3.1950(S), Expected = 1.99, Std = 0.3400, ChiSquare = 3.9393e-04 1.Q100 HB2 = 0.0660(S), Expected = 2.05, Std = 0.2500, ChiSquare = 2.0881e-15