G1 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.4 L 0.3 G 0.1 D 0.05 F 0.04 K 0.04 Y 0.02 I 0.01 C Shift Assignments>> C :: 169.183 CA :: 43.484 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.830 HA2 :: 3.818 HA3 :: 3.474 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.580 Ave N Shift Values>> N :: 109.91(4.29) P2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.99 C Shift Assignments>> C :: 177.500 CA :: 63.484 CB :: 32.602 CG :: 27.130 CD :: 49.830 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.310 HB2 :: 2.150 HB3 :: 1.810 HG3 :: 1.810 HD2 :: 3.350 HD3 :: 3.260 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 134.250 Ave N Shift Values>> N :: 127.4(10.05) L3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.56 A 0.22 G 0.18 R 0.02 C Shift Assignments>> C :: 178.400 CA :: 55.710 CB :: 42.300 CG :: 23.000 CD1 :: 25.110 CD2 :: 23.720 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.420 HA :: 4.327 HB2 :: 1.580 HG :: 1.552 HD1 :: 0.842 HD2 :: 0.800 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 122.420 Ave N Shift Values>> N :: 121.98(4.07) G4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.86 L 0.08 R 0.02 C Shift Assignments>> C :: 174.840 CA :: 45.520 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.286 HA2 :: 3.950 HA3 :: 3.860 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.892 Ave N Shift Values>> N :: 109.91(4.29) S5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.900 CA :: 58.240 CB :: 64.060 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.100 HA :: 4.440 HB2 :: 3.764 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 116.103 Ave N Shift Values>> N :: 116.3(3.95) V6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 175.400 CA :: 62.550 CB :: 33.290 CG1 :: 21.060 CG2 :: 21.060 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.094 HA :: 4.100 HB :: 2.010 HG1 :: 0.870 HG2 :: 0.870 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 122.671 Ave N Shift Values>> N :: 121.02(4.96) K7 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.46 G 0.33 A 0.14 K 0.06 C Shift Assignments>> C :: 175.587 CA :: 53.960 CB :: 33.720 CG :: 23.990 CD :: 33.650(S) CE :: 42.550 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.129 HA :: 4.684 HB2 :: 1.670 HB3 :: 1.570 HG2 :: 1.260 HD2 :: 1.670 HD3 :: 1.570 HE2 :: 3.010 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 124.992 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) P8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.99 C Shift Assignments>> C :: 176.500 CA :: 62.530 CB :: 31.237 CG :: 27.480 CD :: 50.860 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.550 HB2 :: 1.710 HG2 :: 1.360 HG3 :: 1.220 HD2 :: 3.820 HD3 :: 3.300 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 140.490 Ave N Shift Values>> N :: 127.4(10.05) D9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.33 N 0.25 L 0.13 F 0.11 Y 0.11 K 0.03 C Shift Assignments>> C :: 172.036 CA :: 54.150 CB :: 40.040 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.498 HA :: 4.874 HB2 :: 3.037 HB3 :: 2.240 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 121.680 Ave N Shift Values>> N :: 120.73(4.2) P10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.97 A 0.01 C Shift Assignments>> C :: 176.670 CA :: 62.885 CB :: 34.800 CG :: 25.060 CD :: 50.830 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.480 HB2 :: 2.335 HB3 :: 2.090 HG2 :: 1.880 HG3 :: 1.750 HD3 :: 3.524 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 134.480 Ave N Shift Values>> N :: 127.4(10.05) P11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.99 C Shift Assignments>> C :: 174.200 CA :: 63.640 CB :: 32.730 CG :: 28.950 CD :: 50.190 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.340 HB2 :: 2.210 HB3 :: 1.380 HG2 :: 1.640 HG3 :: 1.540 HD2 :: 3.940 HD3 :: 3.520 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 128.470 Ave N Shift Values>> N :: 127.4(10.05) E12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.96 I 0.02 C Shift Assignments>> C :: 175.700 CA :: 54.520 CB :: 34.520 CG :: 37.170 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.978 HA :: 4.651 HB2 :: 2.090 HB3 :: 1.719 HG2 :: 2.440 HG3 :: 2.360 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 118.400 Ave N Shift Values>> N :: 120.68(3.68) N13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.41 Y 0.17 E 0.15 F 0.1 D 0.08 I 0.01 K 0.01 L 0.01 C Shift Assignments>> C :: 173.900 CA :: 54.440 CB :: 37.430 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.995 HA :: 4.267 HB2 :: 2.960 HB3 :: 2.480 HD21 :: 7.250 HD22 :: 6.730 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 117.509 ND2 :: 111.630 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) V14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 177.200 CA :: 63.220 CB :: 31.080 CG1 :: 20.970 CG2 :: 21.960 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.165 HA :: 4.700 HB :: 2.080 HG1 :: 0.979 HG2 :: 0.792 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 118.699 Ave N Shift Values>> N :: 121.02(4.96) V15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.72 I 0.27 C Shift Assignments>> C :: 174.000 CA :: 61.920 CB :: 36.040 CG1 :: 21.550 CG2 :: 18.250 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.217 HA :: 4.242 HB :: 1.870 HG1 :: 0.890 HG2 :: 0.851 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 130.361 Ave N Shift Values>> N :: 121.02(4.96) A16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.42 L 0.35 A 0.07 K 0.06 G 0.05 R 0.02 C Shift Assignments>> C :: 175.900 CA :: 49.530 CB :: 24.060 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.679 HA :: 5.625 HB :: 1.012 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 127.774 Ave N Shift Values>> N :: 123.23(3.7) R17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.44 R 0.41 K 0.14 C Shift Assignments>> C :: 173.568 CA :: 52.800 CB :: 33.200 CG :: 27.570 CD :: 43.750 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.980 HA :: 5.039 HB2 :: 1.890 HB3 :: 1.680 HG2 :: 1.670 HG3 :: 1.630 HD3 :: 3.170 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 120.357 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) P18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.99 C Shift Assignments>> C :: 175.900 CA :: 62.070 CB :: 33.630 CG :: 27.060 CD :: 51.210 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.750 HB2 :: 2.760 HB3 :: 2.020 HG2 :: 2.280 HG3 :: 2.045 HD3 :: 3.780 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 132.630 Ave N Shift Values>> N :: 127.4(10.05) V19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 173.244 CA :: 59.450 CB :: 34.600 CG1 :: 20.950 CG2 :: 20.950 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.546 HA :: 4.360 HB :: 1.820 HG1 :: 0.770 HG2 :: 0.770 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 122.652 Ave N Shift Values>> N :: 121.02(4.96) P20 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> P 0.99 C Shift Assignments>> C :: 177.077 CA :: 63.883 CB :: 31.870 CG :: 27.750 CD :: 51.380 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 2.940(S) HB2 :: 1.900 HB3 :: 1.540 HG2 :: 1.990 HG3 :: 1.800 HD2 :: 3.690 HD3 :: 3.520 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 138.870 Ave N Shift Values>> N :: 127.4(10.05) S21 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 173.300 CA :: 61.680 CB :: 61.468 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 4.073(S) HA :: 3.710 HB2 :: 3.620 HB3 :: 2.100(S) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 110.200 Ave N Shift Values>> N :: 116.3(3.95) N22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.42 D 0.37 L 0.09 F 0.04 Y 0.03 K 0.02 C Shift Assignments>> C :: 173.810 CA :: 50.580 CB :: 40.540 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 7.660 HA :: 5.243 HB2 :: 2.630 HB3 :: 2.440 HD21 :: 7.220 HD22 :: 6.900 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 118.650 ND2 :: 113.680 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) P23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.97 S 0.02 C Shift Assignments>> C :: 176.500 CA :: 64.670 CB :: 34.020 CG :: 27.290 CD :: 51.870 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 5.280 HB2 :: 2.630 HB3 :: 2.240 HG2 :: 2.240 HG3 :: 2.030 HD2 :: 3.960 HD3 :: 3.750 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 135.170 Ave N Shift Values>> N :: 127.4(10.05) R24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.68 G 0.18 K 0.13 C Shift Assignments>> C :: 175.300 CA :: 55.470 CB :: 30.960 CG :: 27.380 CD :: 43.700 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.101 HA :: 4.630 HB2 :: 2.220 HG3 :: 1.630 HD2 :: 3.260 HD3 :: 3.210 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 114.529 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) R25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.87 K 0.06 R 0.05 C Shift Assignments>> C :: 176.900 CA :: 54.240 CB :: 35.310 CG :: 28.930 CD :: 44.380 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 6.820 HA :: 5.470 HB2 :: 1.580 HB3 :: 1.460 HG2 :: 1.580 HG3 :: 1.270 HD2 :: 2.920 HD3 :: 2.830 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 116.720 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) L26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.4 L 0.32 A 0.26 HN Overlap>> A103 C Shift Assignments>> C :: 175.400 CA :: 54.240 CB :: 48.100 CG :: 26.880 CD1 :: 23.620 CD2 :: 26.140 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.392 HA :: 4.644 HB2 :: 1.260 HB3 :: 0.680 HG :: 1.020 HD1 :: 0.480 HD2 :: 0.160 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 121.440 Ave N Shift Values>> N :: 121.98(4.07) E27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.64 Q 0.2 K 0.12 I 0.02 C Shift Assignments>> C :: 176.500 CA :: 55.490 CB :: 31.120 CG :: 35.590 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.924 HA :: 4.820 HB2 :: 1.890 HB3 :: 1.670 HG3 :: 2.020 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 122.652 Ave N Shift Values>> N :: 120.68(3.68) V28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 176.000 CA :: 61.030 CB :: 34.350 CG1 :: 22.530 CG2 :: 21.670 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.081 HA :: 5.300 HB :: 2.270 HG1 :: 1.070 HG2 :: 0.833 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 127.558 Ave N Shift Values>> N :: 121.02(4.96) T29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 173.600 CA :: 60.770 CB :: 73.010 CG2 :: 22.070 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 9.218 HA :: 4.890 HB :: 4.210 HG2 :: 1.060 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 118.633 Ave N Shift Values>> N :: 115.7(5.05) W30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.19 W 0.17 K 0.16 E 0.15 H 0.15 Q 0.1 V 0.03 I 0.01 C Shift Assignments>> C :: 173.700 CA :: 57.120 CB :: 31.440 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 7.455 HA :: 5.028 HB2 :: 3.490 HB3 :: 2.830 HD1 :: 6.130 HZ3 :: 6.950 HH2 :: 6.480 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 115.922 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) Q31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.52 Q 0.41 K 0.05 C Shift Assignments>> C :: 177.000 CA :: 53.800 CB :: 32.560 CG :: 34.810 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.834 HA :: 4.879 HB2 :: 2.170 HB3 :: 1.850 HG2 :: 2.460 HG3 :: 2.320 HE21 :: 7.690 HE22 :: 6.920 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 115.197 NE2 :: 112.940 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) T32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 172.033 CA :: 61.850 CB :: 69.350 CG2 :: 23.000 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.575 HA :: 4.280 HB :: 4.180 HG2 :: 1.510 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 118.922 Ave N Shift Values>> N :: 115.7(5.05) P33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.99 C Shift Assignments>> C :: 180.000 CA :: 63.180 CB :: 32.240 CG :: 27.920 CD :: 50.760 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.400 HB2 :: 2.270 HB3 :: 1.900 HG2 :: 1.940 HG3 :: 2.090 HD2 :: 3.570 HD3 :: 3.280 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 138.870 Ave N Shift Values>> N :: 127.4(10.05) S34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.600 CA :: 61.720 CB :: 63.069 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 9.210 HA :: 4.200 HB2 :: 4.070 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 121.540 Ave N Shift Values>> N :: 116.3(3.95) T35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.100 CA :: 61.100 CB :: 69.490 CG2 :: 22.810 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.397 HA :: 4.165 HB :: 4.520 HG2 :: 1.280 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 107.696 Ave N Shift Values>> N :: 115.7(5.05) W36 Overall: Anomalous Typing: Suspicious SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.99 C Shift Assignments>> C :: 175.021 CA :: 54.690 CB :: 30.340 CD1 :: 126.150 CE3 :: 121.000 CZ2 :: 121.940(M) CZ3 :: 115.610(M) CH2 :: 124.990 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 7.667 HA :: 5.011 HB2 :: 3.350 HB3 :: 3.220 HD1 :: 6.800 HE1 :: 11.030 HE3 :: 7.850 HZ2 :: 6.840 HZ3 :: 7.450 HH2 :: 7.140 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 127.213 NE1 :: 130.710 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) P37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.99 C Shift Assignments>> C :: 176.300 CA :: 64.270 CB :: 32.400 CG :: 27.280 CD :: 50.850 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.220 HB2 :: 2.050 HB3 :: 1.670 HG2 :: 1.530 HG3 :: 1.380 HD2 :: 3.580 HD3 :: 2.440 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 139.680 Ave N Shift Values>> N :: 127.4(10.05) D38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.36 L 0.22 N 0.15 K 0.1 F 0.05 R 0.04 Y 0.04 C Shift Assignments>> C :: 174.456 CA :: 52.650 CB :: 41.550 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 7.693 HA :: 4.863 HB2 :: 2.990 HB3 :: 2.550 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 114.017 Ave N Shift Values>> N :: 120.73(4.2) P39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.99 C Shift Assignments>> C :: 177.900 CA :: 64.370 CB :: 32.550 CG :: 27.660 CD :: 51.160 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.660 HB2 :: 2.410 HB3 :: 2.280 HG2 :: 2.220 HD2 :: 4.010 HD3 :: 3.870 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 136.790 Ave N Shift Values>> N :: 127.4(10.05) E40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.55 I 0.35 K 0.07 Q 0.01 HN Overlap>> F46 C Shift Assignments>> C :: 178.800 CA :: 58.930 CB :: 29.680 CG :: 36.980 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.200 HA :: 4.170 HB2 :: 2.050 HG2 :: 2.258 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 117.899 Ave N Shift Values>> N :: 120.68(3.68) S41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.000 CA :: 60.210 CB :: 63.630 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.635 HA :: 4.165 HB2 :: 3.395 HB3 :: 3.136 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 114.409 Ave N Shift Values>> N :: 116.3(3.95) F42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.22 D 0.22 F 0.2 N 0.19 L 0.08 I 0.03 E 0.02 K 0.01 C Shift Assignments>> C :: 172.194 CA :: 55.480 CB :: 39.230 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 7.781 HA :: 5.050 HB2 :: 3.281 HB3 :: 3.016 HD1 :: 7.280 HE1 :: 7.320 HZ :: 7.050 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 119.651 Ave N Shift Values>> N :: 120.69(4.18) P43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.99 C Shift Assignments>> C :: 178.000 CA :: 63.740 CB :: 32.780 CG :: 27.760 CD :: 50.720 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.660 HB2 :: 2.350 HB3 :: 1.830 HG2 :: 1.940 HD2 :: 3.570 HD3 :: 3.270 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 136.790 Ave N Shift Values>> N :: 127.4(10.05) L44 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.44 L 0.43 A 0.06 R 0.04 C Shift Assignments>> C :: 176.700 CA :: 53.550 CB :: 44.640 CG :: 26.830 CD1 :: 26.170 CD2 :: 22.890 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.061 HA :: 4.360 HB2 :: 1.050 HB3 :: 0.416 HG :: 0.890 HD1 :: 0.160 HD2 :: -0.570(S) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 122.119 Ave N Shift Values>> N :: 121.98(4.07) K45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.48 R 0.47 G 0.04 HN Overlap>> D56 C Shift Assignments>> C :: 175.600 CA :: 54.450 CB :: 35.390 CG :: 25.180 CD :: 29.870 CE :: 42.500 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.173 HA :: 4.423 HB2 :: 1.610 HB3 :: 1.480 HG2 :: 1.280 HG3 :: 1.190 HD2 :: 1.540 HE2 :: 2.880 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 119.478 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) F46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.35 L 0.24 K 0.12 F 0.09 Y 0.06 G 0.04 D 0.04 I 0.01 HN Overlap>> E40 C Shift Assignments>> C :: 174.200 CA :: 57.410 CB :: 43.210 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.311 HA :: 5.790 HB2 :: 2.900 HB3 :: 2.840 HD1 :: 7.490 HE1 :: 7.190 HZ :: 7.380 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 117.881 Ave N Shift Values>> N :: 120.69(4.18) F47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.28 K 0.19 R 0.17 D 0.17 F 0.07 Y 0.05 N 0.02 G 0.01 C Shift Assignments>> C :: 173.400 CA :: 55.180 CB :: 42.330 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.630 HA :: 4.977 HB2 :: 2.489 HB3 :: 2.013 HD1 :: 6.590 HE1 :: 6.890 HZ :: 6.470 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 122.281 Ave N Shift Values>> N :: 120.69(4.18) L48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.92 L 0.06 R 0.01 C Shift Assignments>> C :: 175.100 CA :: 54.130 CB :: 46.720 CG :: 27.760 CD1 :: 27.760 CD2 :: 27.390 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 9.000 HA :: 5.220 HB2 :: 1.470 HB3 :: 1.170 HG :: 1.560 HD1 :: 0.700 HD2 :: 0.650 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 127.390 Ave N Shift Values>> N :: 121.98(4.07) R49 Overall: Anomalous Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> K 0.64 G 0.19 R 0.13 A 0.02 C Shift Assignments>> C :: 174.100 CA :: 53.210 CB :: 33.770 CG :: 24.350 CD :: 43.000 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 9.181 HA :: 5.838(S) HB2 :: 0.810(S) HB3 :: 0.750(S) HG2 :: 0.640(S) HG3 :: -0.030(S) HD2 :: 0.580(M) HD3 :: -0.140(M) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 122.705 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) SRO Rule Breaks>> (HD2 > HB2 : 0.9950) (HD3 > HB2 : 0.9950) (HD2 > HB3 : 0.9951) (HD3 > HB3 : 0.9958) (HD2 > HG2 : 0.9976) (HD3 > HG2 : 0.9974) (HD3 > HG3 : 0.9982) Y50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.31 R 0.31 K 0.1 D 0.09 F 0.06 G 0.04 Y 0.04 C Shift Assignments>> C :: 174.700 CA :: 55.750 CB :: 43.230 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 8.898 HA :: 6.266 HB2 :: 3.110 HB3 :: 2.890 HD1 :: 6.810 HE1 :: 6.630 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 117.821 Ave N Shift Values>> N :: 120.79(4.69) R51 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Anomalous H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.99 C Shift Assignments>> C :: 171.952 CA :: 54.360 CB :: 29.750 CG :: 29.200 CD :: 50.040(M) Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.680 HA :: 4.854 HB2 :: 2.260 HB3 :: 1.660 HG2 :: 2.060 HG3 :: 1.870 HD2 :: 4.020(S) HD3 :: 3.540 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 116.350 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) P52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.99 C Shift Assignments>> C :: 178.400 CA :: 61.350 CB :: 30.990 CG :: 27.240 CD :: 50.200 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.110 HB2 :: 1.608 HB3 :: 1.430 HG2 :: 1.800 HG3 :: 1.730 HD2 :: 3.600 HD3 :: 3.480 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 135.870 Ave N Shift Values>> N :: 127.4(10.05) L53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.72 R 0.23 G 0.02 K 0.01 C Shift Assignments>> C :: 179.300 CA :: 57.890 CB :: 42.280 CG :: 27.710 CD1 :: 25.320 CD2 :: 24.340 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.465 HA :: 3.626 HB2 :: 1.460 HB3 :: 1.460 HG :: 1.439 HD1 :: 0.790 HD2 :: 0.729 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 125.070 Ave N Shift Values>> N :: 121.98(4.07) I54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 176.000 CA :: 62.570 CB :: 38.900 CG1 :: 26.280 CG2 :: 18.280 CD1 :: 14.620 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 7.376 HA :: 3.971 HB :: 1.995 HG2 :: 0.881 HG12 :: 1.108 HG13 :: 1.160 HD1 :: 0.740 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 107.382 Ave N Shift Values>> N :: 121.6(4.72) L55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.53 L 0.4 R 0.03 A 0.02 C Shift Assignments>> C :: 176.000 CA :: 53.670 CB :: 44.990 CG :: 27.720 CD1 :: 25.320 CD2 :: 23.560 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.569 HA :: 4.631 HB2 :: 1.500 HB3 :: 1.400 HG :: 1.330 HD1 :: 0.850 HD2 :: 0.821 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 122.570 Ave N Shift Values>> N :: 121.98(4.07) D56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.29 L 0.23 K 0.15 F 0.09 N 0.09 Y 0.07 R 0.04 HN Overlap>> K45 C Shift Assignments>> C :: 176.400 CA :: 54.420 CB :: 41.320 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.110 HA :: 4.188 HB2 :: 2.470 HB3 :: 2.420 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 119.470 Ave N Shift Values>> N :: 120.73(4.2) Q57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.47 K 0.28 E 0.2 R 0.03 C Shift Assignments>> C :: 175.100 CA :: 55.190 CB :: 30.560 CG :: 33.810 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 6.912 HA :: 4.250 HB2 :: 1.890 HB3 :: 1.820 HG2 :: 2.270 HE21 :: 7.580 HE22 :: 6.830 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 118.231 NE2 :: 113.290 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) W58 Overall: Anomalous Typing: Suspicious SRO: Suspicious C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.99 C Shift Assignments>> C :: 177.300 CA :: 57.480 CB :: 31.410 CD1 :: 129.440 CZ2 :: 124.950(M) CZ3 :: 122.640 CH2 :: 119.830 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 8.354 HA :: 4.190 HB2 :: 2.720 HB3 :: 2.460 HD1 :: 7.280 HE1 :: 10.130 HZ2 :: 6.760 HZ3 :: 6.760 HH2 :: 6.970 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 123.363 NE1 :: 131.060 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) SRO Rule Breaks>> (CH2 > CZ2 : 0.9900) Q59 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> E 0.42 Q 0.33 K 0.21 I 0.01 R 0.01 C Shift Assignments>> C :: 175.300 CA :: 55.250 CB :: 30.500 CG :: 34.980 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.630 HA :: 4.430 HB2 :: 1.468 HB3 :: 0.960(S) HG2 :: 2.241 HG3 :: 2.064 HE21 :: 7.280 HE22 :: 7.260 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 121.270 NE2 :: 113.180 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) H60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.32 K 0.29 E 0.08 W 0.08 R 0.07 H 0.07 V 0.03 Y 0.01 C Shift Assignments>> C :: 176.300 CA :: 56.230 CB :: 33.630 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 8.450 HA :: 5.492 HB2 :: 3.040 HB3 :: 2.880 HD2 :: 6.380 HE1 :: 6.520 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 119.920 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) V61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.98 I 0.01 C Shift Assignments>> C :: 174.300 CA :: 61.720 CB :: 36.000 CG1 :: 21.620 CG2 :: 21.340 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.240 HA :: 4.370 HB :: 1.900 HG1 :: 0.920 HG2 :: 0.740 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 122.040 Ave N Shift Values>> N :: 121.02(4.96) E62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.8 I 0.14 K 0.04 HN Overlap>> I71 C Shift Assignments>> C :: 176.000 CA :: 56.620 CB :: 31.000 CG :: 37.370 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.740 HA :: 4.520 HB2 :: 2.050 HB3 :: 1.970 HG3 :: 2.135 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 128.212 Ave N Shift Values>> N :: 120.68(3.68) L63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.45 R 0.32 G 0.19 K 0.02 C Shift Assignments>> C :: 176.900 CA :: 54.160 CB :: 43.560 CG :: 27.710 CD1 :: 27.630 CD2 :: 24.500 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.349 HA :: 4.850 HB2 :: 1.950 HB3 :: 1.830 HG :: 1.530 HD1 :: 0.880 HD2 :: 0.720 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 127.392 Ave N Shift Values>> N :: 121.98(4.07) S64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.600 CA :: 57.880 CB :: 63.580 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.755 HA :: 4.736 HB2 :: 4.023 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 117.600 Ave N Shift Values>> N :: 116.3(3.95) N65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.33 N 0.27 L 0.12 F 0.11 Y 0.11 K 0.02 C Shift Assignments>> C :: 175.800 CA :: 53.990 CB :: 39.950 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.500 HA :: 5.180 HB2 :: 3.030 HB3 :: 2.973 HD21 :: 7.650 HD22 :: 6.990 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 118.416 ND2 :: 112.870 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) G66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.86 L 0.08 R 0.02 C Shift Assignments>> C :: 173.500 CA :: 45.520 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.294 HA2 :: 4.134 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.426 Ave N Shift Values>> N :: 109.91(4.29) T67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.77 S 0.21 A 0.01 C Shift Assignments>> C :: 172.000 CA :: 59.190 CB :: 67.180 CG2 :: 21.250 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.666 HA :: 3.160 HB :: 3.860 HG2 :: 0.760 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 107.719 Ave N Shift Values>> N :: 115.7(5.05) A68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.61 A 0.24 K 0.09 P 0.02 R 0.01 C Shift Assignments>> C :: 177.100 CA :: 50.890 CB :: 23.240 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 6.498 HA :: 4.537 HB :: 1.079 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 119.832 Ave N Shift Values>> N :: 123.23(3.7) H69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.45 Y 0.14 K 0.12 Q 0.06 I 0.06 F 0.05 V 0.02 N 0.01 W 0.01 C Shift Assignments>> C :: 173.400 CA :: 57.360 CB :: 35.850 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 9.042 HA :: 4.756 HB2 :: 3.360 HB3 :: 2.550 HD2 :: 6.230 HE1 :: 7.850 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 119.809 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) T70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 173.800 CA :: 61.530 CB :: 69.900 CG2 :: 22.090 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.228 HA :: 4.686 HB :: 3.528 HG2 :: 0.801 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 124.070 Ave N Shift Values>> N :: 115.7(5.05) I71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 HN Overlap>> E62 C Shift Assignments>> C :: 177.100 CA :: 61.490 CB :: 39.840 CG1 :: 28.310 CG2 :: 16.950 CD1 :: 13.780 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.760 HA :: 3.880 HB :: 1.370 HG2 :: 0.520 HG12 :: 0.260 HG13 :: 1.310 HD1 :: -0.050 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 128.212 Ave N Shift Values>> N :: 121.6(4.72) T72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.900 CA :: 61.660 CB :: 69.720 CG2 :: 22.040 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.568 HA :: 4.480 HB :: 4.410 HG2 :: 0.924 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 114.987 Ave N Shift Values>> N :: 115.7(5.05) D73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.37 N 0.34 L 0.12 F 0.06 Y 0.05 K 0.03 C Shift Assignments>> C :: 177.000 CA :: 52.370 CB :: 40.400 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.053 HA :: 4.665 HB2 :: 2.870 HB3 :: 2.420 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 122.514 Ave N Shift Values>> N :: 120.73(4.2) A74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.99 C Shift Assignments>> C :: 177.700 CA :: 52.420 CB :: 18.140 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.294 HA :: 3.999 HB :: 0.600 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.833 Ave N Shift Values>> N :: 123.23(3.7) Y75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.36 F 0.29 I 0.16 E 0.08 D 0.04 L 0.02 N 0.02 C Shift Assignments>> C :: 176.000 CA :: 57.990 CB :: 38.580 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 9.042 HA :: 4.440 HB2 :: 3.110 HB3 :: 2.870 HD1 :: 7.220 HE1 :: 6.860 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 121.812 Ave N Shift Values>> N :: 120.79(4.69) A76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.97 C Shift Assignments>> C :: 180.900 CA :: 53.380 CB :: 19.000 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.151 HA :: 4.136 HB :: 1.368 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 125.343 Ave N Shift Values>> N :: 123.23(3.7) G77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.91 L 0.06 C Shift Assignments>> C :: 174.000 CA :: 46.330 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.704 HA2 :: 3.517 HA3 :: 3.990 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.105 Ave N Shift Values>> N :: 109.91(4.29) K78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.64 R 0.31 G 0.03 C Shift Assignments>> C :: 174.300 CA :: 54.190 CB :: 33.660 CG :: 25.485 CD :: 28.750 CE :: 42.460 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 7.429 HA :: 4.599 HB2 :: 1.970 HB3 :: 1.830 HG2 :: 1.360 HG3 :: 1.290 HD2 :: 1.480 HD3 :: 1.540 HE2 :: 2.920 HE3 :: 2.830 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 119.523 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) E79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.19 W 0.18 E 0.17 H 0.16 Q 0.12 K 0.1 V 0.02 I 0.02 C Shift Assignments>> C :: 177.200 CA :: 57.230 CB :: 30.780 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.942 HA :: 4.610 HB2 :: 1.940 HB3 :: 1.780 HG2 :: 2.250 HG3 :: 2.160 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 121.474 Ave N Shift Values>> N :: 120.68(3.68) Y80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.36 L 0.18 K 0.12 F 0.12 Y 0.08 G 0.05 D 0.02 I 0.01 C Shift Assignments>> C :: 175.200 CA :: 58.350 CB :: 43.170 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 9.620 HA :: 4.875 HB2 :: 3.045 HB3 :: 2.410 HD1 :: 7.273 HE1 :: 7.050 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 128.303 Ave N Shift Values>> N :: 120.79(4.69) I81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.98 G 0.01 C Shift Assignments>> C :: 175.300 CA :: 59.640 CB :: 41.600 CG1 :: 29.040 CG2 :: 16.650 CD1 :: 13.950 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.599 HA :: 4.905 HB :: 1.350 HG2 :: 0.684 HG12 :: 1.220 HG13 :: 0.713 HD1 :: 0.720 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 116.952 Ave N Shift Values>> N :: 121.6(4.72) I82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.81 I 0.09 V 0.09 C Shift Assignments>> C :: 176.300 CA :: 60.880 CB :: 43.720 CG1 :: 30.050 CG2 :: 20.030 CD1 :: 16.370 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.660 HA :: 5.200 HB :: 1.510 HG2 :: 0.820 HG12 :: 1.580 HG13 :: 0.975 HD1 :: 0.630 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 125.950 Ave N Shift Values>> N :: 121.6(4.72) Q83 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.91 I 0.06 K 0.01 C Shift Assignments>> C :: 173.000 CA :: 55.040 CB :: 37.440(S) CG :: 37.410(S) Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 9.130 HA :: 4.532 HB2 :: 1.850 HB3 :: 1.260 HG2 :: 2.250 HE21 :: 8.010 HE22 :: 7.310 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 123.160 NE2 :: 115.530 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) V84 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> V 0.98 I 0.01 C Shift Assignments>> C :: 174.200 CA :: 60.550 CB :: 35.590 CG1 :: 21.710 CG2 :: 20.850 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.523 HA :: 5.200 HB :: 1.030 HG1 :: 0.130 HG2 :: -0.143(S) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 119.392 Ave N Shift Values>> N :: 121.02(4.96) A85 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.78 L 0.2 C Shift Assignments>> C :: 175.400 CA :: 50.780 CB :: 21.800 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 9.345 HA :: 4.380 HB :: 0.240(S) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 130.167 Ave N Shift Values>> N :: 123.23(3.7) A86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.58 L 0.27 K 0.07 R 0.02 A 0.01 C Shift Assignments>> C :: 175.500 CA :: 50.180 CB :: 24.610 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.890 HA :: 5.412 HB :: 1.066 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.100 Ave N Shift Values>> N :: 123.23(3.7) K87 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> K 0.68 R 0.22 A 0.05 G 0.03 C Shift Assignments>> C :: 174.800 CA :: 54.710 CB :: 36.140 CG :: 23.620 CD :: 29.480 CE :: 42.040 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.582 HA :: 4.250 HB2 :: 0.520(S) HB3 :: 0.270(S) HG2 :: 0.442(S) HG3 :: 0.205(S) HD2 :: 0.450(S) HD3 :: 0.210(M) HE2 :: 2.280 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 119.685 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) D88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.3 D 0.21 R 0.17 K 0.14 F 0.05 Y 0.04 N 0.03 G 0.01 C Shift Assignments>> C :: 176.900 CA :: 54.250 CB :: 42.490 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.432 HA :: 4.340 HB2 :: 2.770 HB3 :: 2.530 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 124.181 Ave N Shift Values>> N :: 120.73(4.2) N89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.25 F 0.18 Y 0.17 L 0.16 N 0.1 K 0.08 I 0.02 C Shift Assignments>> C :: 176.702 CA :: 55.600 CB :: 40.280 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.310 HA :: 4.190 HB2 :: 2.690 HB3 :: 2.540 HD21 :: 7.630 HD22 :: 6.750 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 122.211 ND2 :: 114.020 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) E90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.73 I 0.21 K 0.03 Q 0.01 C Shift Assignments>> C :: 177.800 CA :: 58.330 CB :: 31.120 CG :: 36.980 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.680 HA :: 4.220 HB2 :: 2.060 HB3 :: 2.060 HG2 :: 2.240 HG3 :: 2.240 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 118.840 Ave N Shift Values>> N :: 120.68(3.68) I91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 177.700 CA :: 61.080 CB :: 39.520 CG1 :: 27.660 CG2 :: 18.250 CD1 :: 12.960 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.121 HA :: 4.280 HB :: 1.910 HG2 :: 0.840 HG12 :: 1.180 HG13 :: 1.370 HD1 :: 0.790 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 117.264 Ave N Shift Values>> N :: 121.6(4.72) G92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.9 L 0.07 R 0.01 C Shift Assignments>> C :: 174.400 CA :: 45.950 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.152 HA2 :: 3.690 HA3 :: 4.040 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.162 Ave N Shift Values>> N :: 109.91(4.29) T93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.100 CA :: 60.750 CB :: 70.620 CG2 :: 22.110 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.686 HA :: 4.270 HB :: 3.970 HG2 :: 1.170 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 113.740 Ave N Shift Values>> N :: 115.7(5.05) W94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.18 W 0.18 E 0.17 H 0.15 K 0.11 Q 0.11 V 0.03 I 0.02 C Shift Assignments>> C :: 178.000 CA :: 57.627 CB :: 30.970 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 8.010 HA :: 4.495 HB2 :: 3.040 HB3 :: 2.660 HD1 :: 7.120 HE1 :: 9.620 HE3 :: 6.510 HZ2 :: 6.610 HZ3 :: 6.930 HH2 :: 6.430 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 123.280 NE1 :: 128.780 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) S95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.6 S 0.39 C Shift Assignments>> C :: 174.400 CA :: 58.120 CB :: 67.290 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 9.387 HA :: 4.280 HB2 :: 3.920 HB3 :: 3.550 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 116.487 Ave N Shift Values>> N :: 116.3(3.95) D96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.28 L 0.21 K 0.15 F 0.11 Y 0.09 N 0.08 R 0.03 C Shift Assignments>> C :: 177.500 CA :: 54.850 CB :: 41.110 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.981 HA :: 4.428 HB2 :: 2.830 HB3 :: 2.460 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 118.787 Ave N Shift Values>> N :: 120.73(4.2) W97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.19 R 0.17 E 0.17 H 0.13 K 0.11 Q 0.09 V 0.06 I 0.03 C Shift Assignments>> C :: 178.100 CA :: 58.470 CB :: 31.140 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 8.299 HA :: 4.185 HB2 :: 3.030 HB3 :: 2.800 HD1 :: 7.160 HE1 :: 9.770 HE3 :: 6.890 HZ2 :: 6.750 HZ3 :: 6.970 HH2 :: 6.260 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 121.814 NE1 :: 129.280 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) S98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.65 T 0.34 C Shift Assignments>> C :: 174.400 CA :: 58.850 CB :: 66.650 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.889 HA :: 4.250 HB2 :: 4.110 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 115.640 Ave N Shift Values>> N :: 116.3(3.95) V99 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 179.200 CA :: 65.098 CB :: 32.240 CG1 :: 21.760 CG2 :: 21.760 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.347 HA :: 3.953 HB :: 2.065 HG1 :: 1.170 HG2 :: 1.190 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 121.221 Ave N Shift Values>> N :: 121.02(4.96) A100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.95 L 0.03 C Shift Assignments>> C :: 177.700 CA :: 53.120 CB :: 19.850 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.942 HA :: 4.460 HB :: 1.330 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 132.186 Ave N Shift Values>> N :: 123.23(3.7) A101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.83 L 0.15 C Shift Assignments>> C :: 176.700 CA :: 50.740 CB :: 21.600 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.949 HA :: 4.869 HB :: 1.360 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 125.400 Ave N Shift Values>> N :: 123.23(3.7) H102 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.25 H 0.19 R 0.18 W 0.14 Q 0.11 E 0.09 V 0.01 C Shift Assignments>> C :: 176.100 CA :: 54.470 CB :: 32.230 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 8.700 HA :: 5.937 HB2 :: 3.230 HB3 :: 3.030 HD2 :: 6.880 HE1 :: 6.030(S) Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 118.690 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) A103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.56 K 0.26 R 0.08 Q 0.02 H 0.02 W 0.01 HN Overlap>> L26 C Shift Assignments>> C :: 175.500 CA :: 52.940 CB :: 24.690 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.473 HA :: 4.644 HB :: 1.210 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 121.453 Ave N Shift Values>> N :: 123.23(3.7) T104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.97 A 0.02 C Shift Assignments>> C :: 172.598 CA :: 59.520 CB :: 71.820 CG2 :: 19.970 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.460 HA :: 5.238 HB :: 3.813 HG2 :: 1.163 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 118.840 Ave N Shift Values>> N :: 115.7(5.05) P105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.87 S 0.12 C Shift Assignments>> C :: 175.100 CA :: 63.150 CB :: 32.430 CG :: 28.100 CD :: 52.780 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.220 HB2 :: 2.150 HB3 :: 2.010 HG2 :: 1.460 HG3 :: 2.111 HD2 :: 4.060 HD3 :: 3.900 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) N Shift Assignments>> N :: 141.020 Ave N Shift Values>> N :: 127.4(10.05) W106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.2 E 0.16 R 0.13 I 0.11 H 0.11 Q 0.09 K 0.08 V 0.06 C Shift Assignments>> C :: 176.000 CA :: 59.499 CB :: 30.028 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 9.075 HA :: 4.150 HB2 :: 3.020 HB3 :: 2.940 HD1 :: 7.390 HE1 :: 10.480 HE3 :: 7.080 HZ2 :: 7.000 HZ3 :: 7.560 HH2 :: 7.260 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 122.249 NE1 :: 131.790 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) T107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 172.700 CA :: 60.130 CB :: 71.570 CG2 :: 21.420 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.059 HA :: 4.025 HB :: 3.856 HG2 :: 1.020 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 118.286 Ave N Shift Values>> N :: 115.7(5.05) E108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.75 I 0.11 K 0.09 Q 0.04 C Shift Assignments>> C :: 176.000 CA :: 56.870 CB :: 30.640 CG :: 36.640 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.822 HA :: 3.628 HB2 :: 1.850 HB3 :: 1.750 HG3 :: 2.160 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 122.478 Ave N Shift Values>> N :: 120.68(3.68) E109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.77 I 0.18 K 0.02 Q 0.01 C Shift Assignments>> C :: 171.548 CA :: 58.230 CB :: 31.510 CG :: 36.940 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.814 HA :: 3.990 HB2 :: 1.950 HB3 :: 1.810 HG2 :: 2.130 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 127.723 Ave N Shift Values>> N :: 120.68(3.68) ########################################################################### Overall Results: #Consistent: 95 #Clerical: 0 #Suspicious: 9 #Anomalous: 4 #Mistyped: 1 #Indeterminable: 0 Typing Results: #Consistent: 106 #Suspicious: 2 #Mistyped: 1 #Indeterminable: 0 Shift Relative Order (SRO) Results: #Consistent: 107 #Suspicious: 2 C Shift Results: #Consistent: 444 #Duplicate: 0 #Unknown: 0 #Suspicious: 3 #Anomalous: 4 H Shift Results: #Consistent: 592 #Duplicate: 0 #Unknown: 0 #Suspicious: 19 #Anomalous: 3 N Shift Results: #Consistent: 122 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: K7 CD = 33.650(S), Expected = 28.78, Std = 1.3900, ChiSquare = 4.5902e-04 P20 HA = 2.940(S), Expected = 4.41, Std = 0.3600, ChiSquare = 4.4394e-05 S21 H = 4.073(S), Expected = 8.29, Std = 0.6200, ChiSquare = 1.0345e-11 S21 HB3 = 2.100(S), Expected = 3.87, Std = 0.3100, ChiSquare = 1.1319e-08 W36 Typing: Suspicious W36 CZ2 = 121.940(M), Expected = 114.19, Std = 1.0900, ChiSquare = 1.1597e-12 W36 CZ3 = 115.610(M), Expected = 121.57, Std = 1.7600, ChiSquare = 7.0825e-04 L44 HD2 = -0.570(S), Expected = 0.76, Std = 0.2800, ChiSquare = 2.0342e-06 R49 HA = 5.838(S), Expected = 4.27, Std = 0.4400, ChiSquare = 3.6575e-04 R49 HB2 = 0.810(S), Expected = 1.79, Std = 0.2800, ChiSquare = 4.6526e-04 R49 HB3 = 0.750(S), Expected = 1.78, Std = 0.2800, ChiSquare = 2.3454e-04 R49 HG2 = 0.640(S), Expected = 1.58, Std = 0.2700, ChiSquare = 4.9865e-04 R49 HG3 = -0.030(S), Expected = 1.58, Std = 0.2700, ChiSquare = 2.4770e-09 R49 HD2 = 0.580(M), Expected = 3.13, Std = 0.2300, ChiSquare = 1.4514e-28 R49 HD3 = -0.140(M), Expected = 3.13, Std = 0.2200, ChiSquare = 5.6759e-50 R49 SRO Rule Break>> HD2 > HB2 : 0.994969040247678 R49 SRO Rule Break>> HD3 > HB2 : 0.994991652754591 R49 SRO Rule Break>> HD2 > HB3 : 0.995112016293279 R49 SRO Rule Break>> HD3 > HB3 : 0.995794785534062 R49 SRO Rule Break>> HD2 > HG2 : 0.997606701236538 R49 SRO Rule Break>> HD3 > HG2 : 0.997402597402597 R49 SRO Rule Break>> HD3 > HG3 : 0.998244844229925 R51 Typing: Mistyped R51 CD = 50.040(M), Expected = 43.10, Std = 1.1000, ChiSquare = 2.8068e-10 R51 HD2 = 4.020(S), Expected = 3.13, Std = 0.2300, ChiSquare = 1.0903e-04 W58 Typing: Suspicious W58 CZ2 = 124.950(M), Expected = 114.19, Std = 1.0900, ChiSquare = 5.5298e-23 W58 SRO Rule Break>> CH2 > CZ2 : 0.990049751243781 Q59 HB3 = 0.960(S), Expected = 2.04, Std = 0.2900, ChiSquare = 1.9598e-04 Q83 CB = 37.440(S), Expected = 29.10, Std = 1.9700, ChiSquare = 2.3008e-05 Q83 CG = 37.410(S), Expected = 33.72, Std = 1.1000, ChiSquare = 7.9495e-04 V84 HG2 = -0.143(S), Expected = 0.83, Std = 0.2900, ChiSquare = 7.9316e-04 A85 HB = 0.240(S), Expected = 1.38, Std = 0.2500, ChiSquare = 5.1154e-06 K87 HB2 = 0.520(S), Expected = 1.79, Std = 0.2500, ChiSquare = 3.7743e-07 K87 HB3 = 0.270(S), Expected = 1.78, Std = 0.2600, ChiSquare = 6.3340e-09 K87 HG2 = 0.442(S), Expected = 1.38, Std = 0.2700, ChiSquare = 5.1262e-04 K87 HG3 = 0.205(S), Expected = 1.37, Std = 0.2900, ChiSquare = 5.8883e-05 K87 HD2 = 0.450(S), Expected = 1.61, Std = 0.2500, ChiSquare = 3.4841e-06 K87 HD3 = 0.210(M), Expected = 1.61, Std = 0.2500, ChiSquare = 2.1435e-08 H102 HE1 = 6.030(S), Expected = 8.08, Std = 0.5700, ChiSquare = 3.2254e-04