Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.M1 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> K 0.31 C 0.29 R 0.14 Q 0.14 P 0.05 M 0.04 C Shift Assignments>> CA :: 52.626 CB :: 32.017 CG :: 28.950 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>> HA :: 4.460 HB2 :: 1.984 HB3 :: 2.138 HG2 :: 2.690 HG3 :: 2.545 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) 1.L2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.42 L 0.3 C 0.26 C Shift Assignments>> C :: 171.175 CA :: 51.936 CB :: 40.888 CG :: 24.151 CD1 :: 23.769 CD2 :: 22.786 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 :: 9.067 HA :: 4.872 HB2 :: 1.659 HB3 :: 1.533 HG :: 1.383 HD11 :: 0.320 HD12 :: 0.320 HD13 :: 0.320 HD21 :: 0.360 HD22 :: 0.360 HD23 :: 0.360 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 :: 121.190 Ave N Shift Values>> N :: 121.86(3.9) 1.T3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.46 C 0.39 A 0.11 S 0.01 C Shift Assignments>> C :: 172.982 CA :: 58.402 CB :: 68.621 CG2 :: 19.533 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.542 HA :: 4.942 HB :: 4.686 HG21 :: 1.358 HG22 :: 1.358 HG23 :: 1.358 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 :: 112.138 Ave N Shift Values>> N :: 115.42(4.75) 1.L4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.72 A 0.25 L 0.01 C Shift Assignments>> C :: 175.540 CA :: 55.906 CB :: 37.757 CG :: 24.565 CD1 :: 21.164 CD2 :: 22.840 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 :: 7.674 HA :: 3.981 HB2 :: 2.405 HB3 :: 1.659 HG :: 1.365 HD11 :: 1.143 HD12 :: 1.143 HD13 :: 1.143 HD21 :: 0.775 HD22 :: 0.775 HD23 :: 0.775 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 :: 121.822 Ave N Shift Values>> N :: 121.86(3.9) 1.I5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.91 I 0.08 C Shift Assignments>> C :: 175.606 CA :: 61.459 CB :: 35.073 CG1 :: 26.562 CG2 :: 14.919 CD1 :: 10.284 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 :: 7.698 HA :: 3.699 HB :: 1.778 HG12 :: 1.550 HG13 :: 1.285 HG21 :: 0.912 HG22 :: 0.912 HG23 :: 0.912 HD11 :: 0.891 HD12 :: 0.891 HD13 :: 0.891 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 :: 114.871 Ave N Shift Values>> N :: 121.46(4.28) 1.Q6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.4 C 0.35 K 0.19 Q 0.02 M 0.01 C Shift Assignments>> C :: 175.895 CA :: 56.026 CB :: 26.426 CG :: 31.240 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 :: 7.724 HA :: 4.026 HB2 :: 2.249 HB3 :: 1.793 HG2 :: 2.378 HG3 :: 2.378 HE21 :: 6.876 HE22 :: 7.209 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 :: 121.263 NE2 :: 110.629 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.G7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.61 L 0.2 R 0.07 C 0.04 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 172.052 CA :: 44.696 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.613 HA2 :: 3.323 HA3 :: 3.226 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.718 Ave N Shift Values>> N :: 109.67(3.87) 1.K8 Overall: Anomalous Typing: Suspicious SRO: Consistent C Shifts: Anomalous H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.93 L 0.05 HN Overlap>> 1.L105 1.L105 C Shift Assignments>> C :: 176.772 CA :: 57.835 CB :: 29.780 CG :: 24.356 CD :: 40.584(A) 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 :: 8.402 HA :: 3.764 HB2 :: 1.870 HB3 :: 1.778 HG2 :: 1.622 HG3 :: 1.622 HD2 :: 3.140(S) HD3 :: 3.140(S) 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 :: 120.263 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.95 L 0.02 C Shift Assignments>> C :: 177.064 CA :: 57.266 CB :: 29.788 CG :: 23.137 CD :: 27.061 CE :: 39.463 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 :: 7.853 HA :: 4.004 HB2 :: 2.026 HB3 :: 1.950 HG2 :: 1.503 HG3 :: 1.735 HD2 :: 1.768 HD3 :: 1.810 HE2 :: 2.984 HE3 :: 2.984 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 :: 120.310 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I10 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.98 I 0.01 C Shift Assignments>> C :: 175.080 CA :: 62.706 CB :: 34.328 CG1 :: 25.544 CG2 :: 13.880 CD1 :: 10.757 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 :: 7.932 HA :: 2.761 HB :: 1.423 HG12 :: 0.597 HG13 :: -0.865(S) HG21 :: 0.323 HG22 :: 0.323 HG23 :: 0.323 HD11 :: -0.218 HD12 :: -0.218 HD13 :: -0.218 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 :: 121.456 Ave N Shift Values>> N :: 121.46(4.28) 1.V11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.84 V 0.15 C Shift Assignments>> C :: 174.412 CA :: 65.427 CB :: 28.364 CG1 :: 18.712 CG2 :: 22.978 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 :: 8.082 HA :: 3.172 HB :: 1.972 HG11 :: 0.809 HG12 :: 0.809 HG13 :: 0.809 HG21 :: 0.885 HG22 :: 0.885 HG23 :: 0.885 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 119.577 Ave N Shift Values>> N :: 121.14(4.54) 1.N12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.25 M 0.2 E 0.16 N 0.14 Q 0.07 K 0.06 Y 0.03 F 0.02 H 0.01 C Shift Assignments>> CA :: 53.756 CB :: 35.670 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 :: 7.879 HA :: 4.289 HB2 :: 2.822 HB3 :: 2.822 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 :: 115.867 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.H13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.4 C 0.38 W 0.21 HN Overlap>> 1.D49 1.D49 C Shift Assignments>> C :: 175.080 CA :: 56.816 CB :: 29.333 CD2 :: 117.603 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 :: 7.838 HA :: 4.228 HB2 :: 3.127 HB3 :: 3.127 HD2 :: 7.027 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 119.426 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.L14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.65 C 0.33 L 0.01 C Shift Assignments>> C :: 176.396 CA :: 54.433 CB :: 39.472 CG :: 23.586 CD1 :: 24.922 CD2 :: 20.756 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 :: 8.381 HA :: 3.794 HB2 :: 1.728 HB3 :: 1.158 HG :: 1.870 HD11 :: 0.587 HD12 :: 0.587 HD13 :: 0.587 HD21 :: 0.664 HD22 :: 0.664 HD23 :: 0.664 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 :: 115.777 Ave N Shift Values>> N :: 121.86(3.9) 1.R15 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.69 L 0.26 A 0.02 I 0.01 C Shift Assignments>> C :: 173.493 CA :: 57.495 CB :: 27.320 CG :: 21.947(S) CD :: 39.168(S) 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 :: 7.946 HA :: 3.842 HB2 :: 1.935 HB3 :: 1.804 HG2 :: 1.486 HG3 :: 1.431 HD2 :: 2.951 HD3 :: 2.951 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 :: 115.213 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.S16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 C 0.01 C Shift Assignments>> C :: 173.431 CA :: 54.776 CB :: 61.538 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.020 HA :: 4.808 HB2 :: 4.064 HB3 :: 3.753 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 :: 108.680 Ave N Shift Values>> N :: 116.28(3.52) 1.R17 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Suspicious PRTL>> R 0.47 C 0.33 K 0.17 HN Overlap>> 1.I126 1.I126 C Shift Assignments>> C :: 175.623 CA :: 54.094 CB :: 30.153 CG :: 26.329 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 :: 7.806 HA :: 4.490 HB2 :: 2.339 HB3 :: 2.339 HG2 :: 2.054 HG3 :: 2.054 HD2 :: 4.299(S) HD3 :: 4.299(S) HE :: 7.679 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 122.175 NE :: 78.476(S) 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.L18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.57 C 0.22 L 0.17 G 0.02 C Shift Assignments>> C :: 173.577 CA :: 52.393 CB :: 41.783 CG :: 24.130 CD1 :: 23.013 CD2 :: 22.212 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 :: 8.806 HA :: 4.951 HB2 :: 1.870 HB3 :: 1.239 HG :: 1.790 HD11 :: 0.644 HD12 :: 0.644 HD13 :: 0.644 HD21 :: 0.700 HD22 :: 0.700 HD23 :: 0.700 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 :: 121.998 Ave N Shift Values>> N :: 121.86(3.9) 1.A19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.61 G 0.31 C 0.04 L 0.01 C Shift Assignments>> C :: 171.092 CA :: 48.551 CB :: 21.215 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.684 HA :: 5.036 HB1 :: 1.167 HB2 :: 1.167 HB3 :: 1.167 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.776 Ave N Shift Values>> N :: 123.23(3.54) 1.F20 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.98 F 0.01 C Shift Assignments>> C :: 169.797 CA :: 53.416 CB :: 39.770 CD2 :: 127.909(S) CE2 :: 128.990 CZ :: 126.806 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 :: 8.827 HA :: 5.479 HB2 :: 3.115 HB3 :: 2.954 HD1 :: 6.971 HD2 :: 6.971 HE1 :: 7.064 HE2 :: 7.064 HZ :: 6.858 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 :: 113.856 Ave N Shift Values>> N :: 120.45(4.18) 1.E21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.34 K 0.26 C 0.24 M 0.05 R 0.04 E 0.02 P 0.01 C Shift Assignments>> C :: 172.052 CA :: 52.621 CB :: 28.960 CG :: 33.703 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 :: 7.853 HA :: 4.908 HB2 :: 2.015 HB3 :: 1.731 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 :: 122.295 Ave N Shift Values>> N :: 120.67(3.48) 1.Y22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.95 Y 0.04 C Shift Assignments>> C :: 172.070 CA :: 53.301 CB :: 38.353 CD1 :: 130.025 CE1 :: 115.511 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 :: 8.847 HA :: 4.738 HB2 :: 2.890 HB3 :: 2.565 HD1 :: 6.612 HD2 :: 6.612 HE1 :: 6.312 HE2 :: 6.312 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 :: 125.594 Ave N Shift Values>> N :: 120.52(4.2) 1.N23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.42 C 0.22 M 0.14 Q 0.06 K 0.04 N 0.02 H 0.02 R 0.01 C Shift Assignments>> C :: 172.679 CA :: 50.694 CB :: 34.179 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 :: 8.991 HA :: 4.039 HB2 :: 2.706 HB3 :: 1.777 HD21 :: 6.371 HD22 :: 6.816 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 :: 127.898 ND2 :: 110.597 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.G24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.33 R 0.21 K 0.13 D 0.1 F 0.07 Y 0.04 C 0.03 I 0.01 G 0.01 C Shift Assignments>> C :: 170.925 CA :: 42.653 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.586 HA2 :: 4.026 HA3 :: 3.571 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 103.320 Ave N Shift Values>> N :: 109.67(3.87) 1.Q25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.62 C 0.17 R 0.08 K 0.06 M 0.04 HN Overlap>> 1.K109 1.K109 C Shift Assignments>> C :: 170.942 CA :: 50.922 CB :: 28.886 CG :: 30.708 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 :: 7.625 HA :: 4.505 HB2 :: 1.966 HB3 :: 1.908 HG2 :: 2.205 HG3 :: 2.205 HE21 :: 6.475 HE22 :: 8.025 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 :: 119.296 NE2 :: 117.408 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.75 C 0.21 L 0.02 C Shift Assignments>> C :: 173.159 CA :: 51.717 CB :: 39.248 CG :: 24.456 CD1 :: 21.705 CD2 :: 22.128 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 :: 8.450 HA :: 4.391 HB2 :: 1.410 HB3 :: 1.410 HG :: 1.243 HD11 :: 0.683 HD12 :: 0.683 HD13 :: 0.683 HD21 :: 0.694 HD22 :: 0.694 HD23 :: 0.694 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 :: 124.194 Ave N Shift Values>> N :: 121.86(3.9) 1.I27 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.98 A 0.01 HN Overlap>> 1.V149 1.V149 C Shift Assignments>> C :: 172.407 CA :: 57.041 CB :: 33.955 CG1 :: 24.486 CG2 :: 14.860 CD1 :: 9.473 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 :: 8.914 HA :: 3.932 HB :: 0.616(S) HG12 :: 1.052 HG13 :: 0.898 HG21 :: 0.642 HG22 :: 0.642 HG23 :: 0.642 HD11 :: 0.600 HD12 :: 0.600 HD13 :: 0.600 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 :: 130.251 Ave N Shift Values>> N :: 121.46(4.28) 1.K28 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.75 A 0.18 L 0.05 C Shift Assignments>> C :: 173.952 CA :: 54.553 CB :: 30.004 CG :: 22.555 CD :: 24.286(S) CE :: 39.463 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 :: 8.231 HA :: 4.057 HB2 :: 1.724 HB3 :: 1.636 HG2 :: 1.281 HG3 :: 1.281 HD2 :: 1.469 HD3 :: 1.469 HE2 :: 2.927 HE3 :: 2.927 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 125.650 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.94 I 0.04 C Shift Assignments>> C :: 173.075 CA :: 57.949 CB :: 35.222 CG1 :: 26.564 CG2 :: 14.827 CD1 :: 10.904 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 :: 8.082 HA :: 4.176 HB :: 1.530 HG12 :: 1.685 HG13 :: 1.119 HG21 :: 0.920 HG22 :: 0.920 HG23 :: 0.920 HD11 :: 0.745 HD12 :: 0.745 HD13 :: 0.745 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 125.802 Ave N Shift Values>> N :: 121.46(4.28) 1.L30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.89 C 0.1 C Shift Assignments>> CA :: 52.280 CB :: 39.323 CG :: 24.376 CD1 :: 22.826 CD2 :: 19.665 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 :: 8.980 HA :: 4.259 HB2 :: 1.687 HB3 :: 1.687 HG :: 1.780 HD11 :: 0.930 HD12 :: 0.930 HD13 :: 0.930 HD21 :: 0.860 HD22 :: 0.860 HD23 :: 0.860 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 :: 128.750 Ave N Shift Values>> N :: 121.86(3.9) 1.S31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 58.966 CB :: 60.122 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.651 HA :: 4.139 HB2 :: 3.912 HB3 :: 3.912 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 117.327 Ave N Shift Values>> N :: 116.28(3.52) 1.K32 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.59 L 0.21 A 0.19 HN Overlap>> 1.K45 1.K45 C Shift Assignments>> C :: 173.389 CA :: 55.003 CB :: 28.513 CG :: 22.081 CD :: 26.522 CE :: 39.355 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 :: 8.055 HA :: 4.219 HB2 :: 1.871 HB3 :: 1.756 HG2 :: 1.113 HG3 :: 1.353 HD2 :: 1.626 HD3 :: 1.626 HE2 :: 2.933 HE3 :: 2.933 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 :: 115.443 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.N33 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> N 0.46 C 0.35 M 0.07 E 0.01 G 0.01 P 0.01 Y 0.01 F 0.01 C Shift Assignments>> C :: 173.322 CA :: 49.679 CB :: 36.117 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 :: 7.952 HA :: 4.907 HB2 :: 3.918(S) HB3 :: 2.800 HD21 :: 6.936 HD22 :: 7.689 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 118.614 ND2 :: 113.194 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.I34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.84 I 0.15 HN Overlap>> 1.L142 1.L142 C Shift Assignments>> C :: 172.867 CA :: 58.169 CB :: 37.310 CG1 :: 24.456 CG2 :: 15.293 CD1 :: 13.267 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 :: 7.425 HA :: 4.789 HB :: 1.800 HG12 :: 1.695 HG13 :: 1.695 HG21 :: 0.624 HG22 :: 0.624 HG23 :: 0.624 HD11 :: 0.805 HD12 :: 0.805 HD13 :: 0.805 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 :: 119.203 Ave N Shift Values>> N :: 121.46(4.28) 1.V35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.94 A 0.05 C Shift Assignments>> C :: 172.386 CA :: 57.727 CB :: 32.986 CG1 :: 17.761 CG2 :: 17.530 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.546 HA :: 4.346 HB :: 1.897 HG11 :: 0.859 HG12 :: 0.859 HG13 :: 0.859 HG21 :: 0.784 HG22 :: 0.784 HG23 :: 0.784 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 128.698 Ave N Shift Values>> N :: 121.14(4.54) 1.A36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.78 M 0.2 C Shift Assignments>> C :: 174.036 CA :: 50.355 CB :: 16.239 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.742 HA :: 4.573 HB1 :: 1.327 HB2 :: 1.327 HB3 :: 1.327 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 129.945 Ave N Shift Values>> N :: 123.23(3.54) 1.V37 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.86 A 0.09 I 0.03 C Shift Assignments>> C :: 172.240 CA :: 57.153 CB :: 30.302 CG1 :: 20.298 CG2 :: 15.154(S) 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 :: 8.395 HA :: 4.558 HB :: 1.884 HG11 :: 0.800 HG12 :: 0.800 HG13 :: 0.800 HG21 :: 0.380 HG22 :: 0.380 HG23 :: 0.380 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 :: 116.124 Ave N Shift Values>> N :: 121.14(4.54) 1.G38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.38 L 0.29 G 0.1 D 0.05 F 0.05 C 0.03 Y 0.02 K 0.02 C Shift Assignments>> C :: 171.906 CA :: 43.561 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.191 HA2 :: 4.798 HA3 :: 4.425 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.362 Ave N Shift Values>> N :: 109.67(3.87) 1.S39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 58.288 CB :: 60.047 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.284 HA :: 4.274 HB2 :: 3.787 HB3 :: 3.787 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 :: 116.236 Ave N Shift Values>> N :: 116.28(3.52) 1.L40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.57 C 0.41 C Shift Assignments>> C :: 178.212 CA :: 56.705 CB :: 39.994 CG :: 25.435 CD1 :: 23.957 CD2 :: 23.639 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 :: 8.456 HA :: 4.074 HB2 :: 1.967 HB3 :: 1.967 HG :: 1.548 HD11 :: 0.792 HD12 :: 0.792 HD13 :: 0.792 HD21 :: 0.743 HD22 :: 0.743 HD23 :: 0.743 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.630 Ave N Shift Values>> N :: 121.86(3.9) 1.R41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.49 C 0.34 R 0.1 K 0.05 C Shift Assignments>> C :: 174.245 CA :: 56.250 CB :: 26.649 CG :: 26.458 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 :: 6.917 HA :: 3.951 HB2 :: 1.777 HB3 :: 1.777 HG2 :: 1.555 HG3 :: 1.555 HD2 :: 2.904 HD3 :: 2.904 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 :: 121.383 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.R42 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Anomalous H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.99 C Shift Assignments>> C :: 170.006 CA :: 54.777 CB :: 27.544 CG :: 33.885(S) CD :: 34.131(A) 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 :: 6.954 HA :: 3.627 HB2 :: 1.916 HB3 :: 1.779 HG2 :: 2.100 HG3 :: 2.100 HD2 :: 2.195(S) HD3 :: 2.195(S) HE :: 7.935 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 :: 112.879 NE :: 83.330 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.E43 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.56 K 0.34 A 0.05 V 0.01 Q 0.01 C Shift Assignments>> C :: 173.159 CA :: 54.323 CB :: 23.369(S) CG :: 34.062 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 :: 7.721 HA :: 3.642 HB2 :: 2.112 HB3 :: 2.112 HG2 :: 2.075 HG3 :: 2.075 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 :: 112.553 Ave N Shift Values>> N :: 120.67(3.48) 1.E44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.45 K 0.23 Q 0.16 R 0.06 E 0.05 I 0.01 C Shift Assignments>> C :: 172.115 CA :: 54.889 CB :: 26.202 CG :: 35.031 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 :: 7.264 HA :: 4.121 HB2 :: 2.210 HB3 :: 2.210 HG2 :: 2.350 HG3 :: 2.350 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 :: 119.124 Ave N Shift Values>> N :: 120.67(3.48) 1.K45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.97 A 0.01 HN Overlap>> 1.K32 1.K32 C Shift Assignments>> C :: 174.871 CA :: 57.154 CB :: 30.451 CG :: 22.866 CD :: 26.522 CE :: 39.463 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 :: 7.949 HA :: 3.839 HB2 :: 1.838 HB3 :: 1.838 HG2 :: 1.487 HG3 :: 1.595 HD2 :: 1.721 HD3 :: 1.721 HE2 :: 3.025 HE3 :: 3.025 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 115.473 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.M46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.8 C 0.11 K 0.03 R 0.01 M 0.01 C Shift Assignments>> C :: 171.363 CA :: 49.675 CB :: 31.569 CG :: 29.284 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 :: 7.650 HA :: 5.105 HB2 :: 1.837 HB3 :: 1.837 HG2 :: 2.616 HG3 :: 2.342 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 :: 115.233 Ave N Shift Values>> N :: 120.09(3.57) 1.L47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.85 C 0.08 L 0.03 G 0.01 C Shift Assignments>> C :: 171.364 CA :: 49.498 CB :: 41.335 CG :: 24.900 CD1 :: 24.919 CD2 :: 20.376 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 :: 9.479 HA :: 4.759 HB2 :: 1.529 HB3 :: 1.529 HG :: 1.376 HD11 :: 0.800 HD12 :: 0.800 HD13 :: 0.800 HD21 :: 0.725 HD22 :: 0.725 HD23 :: 0.725 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 :: 120.733 Ave N Shift Values>> N :: 121.86(3.9) 1.N48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.26 N 0.22 M 0.19 E 0.12 K 0.05 Q 0.05 Y 0.03 F 0.01 C Shift Assignments>> C :: 171.112 CA :: 53.078 CB :: 35.744 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 :: 10.097 HA :: 4.530 HB2 :: 2.800 HB3 :: 2.800 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 :: 123.092 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.D49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.6 C 0.13 G 0.1 D 0.09 F 0.01 L 0.01 Y 0.01 HN Overlap>> 1.H13 1.H13 C Shift Assignments>> CA :: 48.890 CB :: 38.801 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 :: 7.760 HA :: 4.250 HB2 :: 2.730 HB3 :: 2.730 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 :: 119.467 Ave N Shift Values>> N :: 120.65(3.86) 1.V50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.9 V 0.08 C Shift Assignments>> C :: 170.089 CA :: 59.990 CB :: 30.451 CG1 :: 18.997 CG2 :: 18.714 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 :: 7.772 HA :: 4.072 HB :: 1.760 HG11 :: 0.538 HG12 :: 0.538 HG13 :: 0.538 HG21 :: 0.664 HG22 :: 0.664 HG23 :: 0.664 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 :: 117.395 Ave N Shift Values>> N :: 121.14(4.54) 1.D51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.37 D 0.35 L 0.11 C 0.07 F 0.03 Y 0.02 K 0.01 C Shift Assignments>> CA :: 50.585 CB :: 40.739 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 :: 8.604 HA :: 5.450 HB2 :: 2.375 HB3 :: 2.420 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 :: 126.344 Ave N Shift Values>> N :: 120.65(3.86) 1.L52 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.5 A 0.42 C 0.06 C Shift Assignments>> C :: 170.298(S) CA :: 50.698 CB :: 43.572 CG :: 23.369 CD1 :: 22.472 CD2 :: 21.708 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 :: 9.454 HA :: 4.793 HB2 :: 1.442 HB3 :: 1.355 HG :: 1.335 HD11 :: 0.579 HD12 :: 0.579 HD13 :: 0.579 HD21 :: 0.637 HD22 :: 0.637 HD23 :: 0.637 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 :: 123.955 Ave N Shift Values>> N :: 121.86(3.9) 1.L53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.67 G 0.21 C 0.09 L 0.01 C Shift Assignments>> CA :: 50.591 CB :: 42.901 CG :: 24.021 CD1 :: 21.183 CD2 :: 25.026 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 :: 9.083 HA :: 4.799 HB2 :: 2.013 HB3 :: 2.013 HG :: 1.267 HD11 :: 0.640 HD12 :: 0.640 HD13 :: 0.640 HD21 :: 0.663 HD22 :: 0.663 HD23 :: 0.663 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 125.210 Ave N Shift Values>> N :: 121.86(3.9) 1.I54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.93 I 0.04 A 0.02 C Shift Assignments>> C :: 172.261 CA :: 56.475 CB :: 37.012 CG1 :: 24.782 CG2 :: 14.910 CD1 :: 11.461 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.297 HA :: 4.813 HB :: 1.690 HG12 :: 1.387 HG13 :: 0.950 HG21 :: 0.665 HG22 :: 0.665 HG23 :: 0.665 HD11 :: 0.623 HD12 :: 0.623 HD13 :: 0.623 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 127.066 Ave N Shift Values>> N :: 121.46(4.28) 1.I55 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.93 A 0.05 HN Overlap>> 1.C86 1.C86 C Shift Assignments>> C :: 172.867 CA :: 55.457 CB :: 32.864 CG1 :: 24.486 CG2 :: 14.964 CD1 :: 8.226 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.243 HA :: 4.679 HB :: 1.948 HG12 :: 1.457 HG13 :: 1.242 HG21 :: 0.688 HG22 :: 0.688 HG23 :: 0.688 HD11 :: 0.614 HD12 :: 0.614 HD13 :: 0.614 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 127.251 Ave N Shift Values>> N :: 121.46(4.28) 1.V56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.77 A 0.2 V 0.01 C Shift Assignments>> CA :: 56.583 CB :: 30.675 CG1 :: 18.586 CG2 :: 19.214 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.175 HA :: 4.294 HB :: 1.860 HG11 :: 0.786 HG12 :: 0.786 HG13 :: 0.786 HG21 :: 0.790 HG22 :: 0.790 HG23 :: 0.790 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 :: 129.261 Ave N Shift Values>> N :: 121.14(4.54) 1.P57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.24 I 0.2 V 0.17 P 0.12 W 0.11 E 0.03 R 0.03 H 0.02 K 0.01 Q 0.01 C Shift Assignments>> C :: 173.728 CA :: 62.249 CB :: 30.015 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 :: 4.345 HB2 :: 2.377 HB3 :: 2.060 HG2 :: 1.768 HG3 :: 1.768 HD2 :: 3.848 HD3 :: 3.848 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.E58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.3 C 0.27 K 0.2 M 0.14 P 0.03 R 0.02 E 0.01 C Shift Assignments>> C :: 173.180 CA :: 51.987 CB :: 29.787 CG :: 33.281 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 :: 6.736 HA :: 4.729 HB2 :: 2.067 HB3 :: 1.873 HG2 :: 2.246 HG3 :: 2.246 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 :: 113.921 Ave N Shift Values>> N :: 120.67(3.48) 1.K59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.16 E 0.15 Q 0.14 H 0.14 C 0.14 R 0.13 M 0.04 K 0.03 I 0.02 C Shift Assignments>> C :: 176.304 CA :: 57.420 CB :: 29.558 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 :: 8.921 HA :: 3.840 HB2 :: 1.880 HB3 :: 1.880 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 :: 126.244 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K60 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.76 A 0.11 L 0.11 C Shift Assignments>> C :: 174.224 CA :: 55.838 CB :: 28.886 CG :: 22.062 CD :: 26.740 CE :: 39.246 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 :: 8.956 HA :: 4.180 HB2 :: 1.964 HB3 :: 1.835 HG2 :: 1.221 HG3 :: 1.221 HD2 :: 1.672 HD3 :: 1.672 HE2 :: 2.913 HE3 :: 2.913 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 :: 117.478 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.89 C 0.1 C Shift Assignments>> C :: 175.686 CA :: 52.429 CB :: 39.397 CG :: 24.130 CD1 :: 23.074 CD2 :: 19.010 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 :: 7.313 HA :: 4.181 HB2 :: 1.611 HB3 :: 1.274 HG :: 1.380 HD11 :: 0.887 HD12 :: 0.887 HD13 :: 0.887 HD21 :: 0.353 HD22 :: 0.353 HD23 :: 0.353 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 :: 115.179 Ave N Shift Values>> N :: 121.86(3.9) 1.L62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.8 A 0.17 L 0.01 C Shift Assignments>> CA :: 56.715 CB :: 39.077 CG :: 24.130 CD1 :: 20.989 CD2 :: 21.887 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 :: 7.326 HA :: 3.760 HB2 :: 1.796 HB3 :: 1.542 HG :: 0.838 HD11 :: 0.796 HD12 :: 0.796 HD13 :: 0.796 HD21 :: 0.785 HD22 :: 0.785 HD23 :: 0.785 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 :: 119.327 Ave N Shift Values>> N :: 121.86(3.9) 1.K63 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.54 A 0.39 L 0.05 C Shift Assignments>> C :: 172.679 CA :: 55.159 CB :: 28.886 CG :: 20.711(S) CD :: 24.362(S) CE :: 38.923(S) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.123 HA :: 3.924 HB2 :: 1.528 HB3 :: 1.433 HG2 :: 1.112 HG3 :: 0.669 HD2 :: 1.252 HD3 :: 1.252 HE2 :: 2.902 HE3 :: 2.902 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 :: 114.038 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.H64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.49 C 0.33 W 0.16 C Shift Assignments>> C :: 173.618 CA :: 53.573 CB :: 30.461 CD2 :: 117.616 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 :: 7.601 HA :: 4.466 HB2 :: 3.391 HB3 :: 2.846 HD2 :: 7.003 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 :: 114.797 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.V65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.63 I 0.36 C Shift Assignments>> C :: 173.605 CA :: 63.760 CB :: 28.195 CG1 :: 17.680 CG2 :: 18.157 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 :: 6.850 HA :: 2.901 HB :: 1.658 HG11 :: 0.298 HG12 :: 0.298 HG13 :: 0.298 HG21 :: -0.085 HG22 :: -0.085 HG23 :: -0.085 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 :: 118.174 Ave N Shift Values>> N :: 121.14(4.54) 1.L66 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.6 A 0.29 V 0.09 C Shift Assignments>> C :: 175.101 CA :: 55.851 CB :: 34.775(S) CG :: 21.846(S) CD1 :: 22.514 CD2 :: 19.963 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 :: 8.703 HA :: 4.141 HB2 :: 2.047 HB3 :: 1.158 HG :: 1.550 HD11 :: 0.545 HD12 :: 0.545 HD13 :: 0.545 HD21 :: 0.502 HD22 :: 0.502 HD23 :: 0.502 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 :: 114.018 Ave N Shift Values>> N :: 121.86(3.9) 1.P67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.87 G 0.1 P 0.01 C Shift Assignments>> C :: 173.863 CA :: 62.646 CB :: 28.880 CG :: 25.135 CD :: 48.042 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 :: 4.439 HB2 :: 2.360 HB3 :: 1.620 HG2 :: 2.020 HG3 :: 2.020 HD2 :: 3.150 HD3 :: 3.150 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.N68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.51 G 0.25 C 0.14 D 0.05 F 0.01 Y 0.01 C Shift Assignments>> CA :: 48.600 CB :: 38.353 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 :: 7.011 HA :: 5.252 HB2 :: 3.361 HB3 :: 3.361 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 :: 111.480 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.I69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.76 I 0.18 A 0.04 C Shift Assignments>> C :: 171.509 CA :: 57.205 CB :: 36.580 CG1 :: 25.979 CG2 :: 16.405 CD1 :: 11.028 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 :: 7.151 HA :: 4.544 HB :: 2.199 HG12 :: 1.357 HG13 :: 1.083 HG21 :: 0.775 HG22 :: 0.775 HG23 :: 0.775 HD11 :: 0.745 HD12 :: 0.745 HD13 :: 0.745 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 :: 122.641 Ave N Shift Values>> N :: 121.46(4.28) 1.R70 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> P 0.66 C 0.09 H 0.06 R 0.04 M 0.04 W 0.03 Q 0.02 K 0.01 C Shift Assignments>> C :: 171.802 CA :: 50.857 CB :: 30.675 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 :: 8.945 HA :: 4.755 HB2 :: 1.445 HB3 :: 1.445 HG2 :: 1.125 HG3 :: 1.125 HD2 :: 1.766(S) HD3 :: 1.766(S) 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 :: 126.375 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.I71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.95 A 0.03 I 0.01 C Shift Assignments>> C :: 172.804 CA :: 57.418 CB :: 36.346 CG1 :: 23.260 CG2 :: 16.275 CD1 :: 10.115 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 :: 7.580 HA :: 4.634 HB :: 1.714 HG12 :: 0.886 HG13 :: 0.570 HG21 :: 0.652 HG22 :: 0.652 HG23 :: 0.652 HD11 :: 0.080 HD12 :: 0.080 HD13 :: 0.080 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 :: 119.088 Ave N Shift Values>> N :: 121.46(4.28) 1.K72 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.7 A 0.25 L 0.03 C Shift Assignments>> C :: 174.871 CA :: 54.932 CB :: 29.777 CG :: 21.857 CD :: 26.522 CE :: 39.463 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 :: 8.617 HA :: 4.207 HB2 :: 1.795 HB3 :: 1.710 HG2 :: 1.321 HG3 :: 1.401 HD2 :: 1.647 HD3 :: 1.647 HE2 :: 2.933 HE3 :: 2.933 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 :: 128.132 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.G73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.37 L 0.29 G 0.11 D 0.05 F 0.05 C 0.03 Y 0.02 K 0.02 C Shift Assignments>> C :: 171.071 CA :: 43.606 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.858 HA2 :: 4.142 HA3 :: 3.803 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 113.270 Ave N Shift Values>> N :: 109.67(3.87) 1.L74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.34 A 0.31 C 0.2 G 0.13 C Shift Assignments>> C :: 173.034 CA :: 51.310 CB :: 42.454 CG :: 24.565 CD1 :: 22.870 CD2 :: 23.012 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 :: 7.421 HA :: 4.930 HB2 :: 1.852 HB3 :: 1.531 HG :: 1.876 HD11 :: 1.080 HD12 :: 1.080 HD13 :: 1.080 HD21 :: 1.075 HD22 :: 1.075 HD23 :: 1.075 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 :: 119.818 Ave N Shift Values>> N :: 121.86(3.9) 1.S75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 170.361 CA :: 55.617 CB :: 61.050 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.965 HA :: 4.681 HB2 :: 3.880 HB3 :: 3.808 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 :: 119.707 Ave N Shift Values>> N :: 116.28(3.52) 1.F76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.44 C 0.32 Y 0.23 C Shift Assignments>> C :: 170.716 CA :: 53.118 CB :: 40.217 CD2 :: 130.268 CE2 :: 128.938 CZ :: 127.763 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 :: 8.069 HA :: 5.705 HB2 :: 3.036 HB3 :: 2.940 HD1 :: 7.052 HD2 :: 7.052 HE1 :: 7.418 HE2 :: 7.418 HZ :: 7.440 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 :: 118.818 Ave N Shift Values>> N :: 120.45(4.18) 1.S77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.89 P 0.09 C 0.01 C Shift Assignments>> CA :: 53.572 CB :: 63.312 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.976 HA :: 4.735 HB2 :: 3.792 HB3 :: 3.792 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 :: 114.348 Ave N Shift Values>> N :: 116.28(3.52) 1.V78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.94 V 0.03 I 0.02 C Shift Assignments>> C :: 173.326 CA :: 59.921 CB :: 30.004 CG1 :: 18.599 CG2 :: 18.380 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 :: 8.941 HA :: 4.235 HB :: 2.058 HG11 :: 0.772 HG12 :: 0.772 HG13 :: 0.772 HG21 :: 1.058 HG22 :: 1.058 HG23 :: 1.058 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 124.421 Ave N Shift Values>> N :: 121.14(4.54) 1.K79 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 A 0.45 L 0.01 C Shift Assignments>> C :: 173.702 CA :: 54.028 CB :: 30.010 CG :: 21.520 CD :: 25.552 CE :: 39.246 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 :: 9.177 HA :: 4.398 HB2 :: 1.635 HB3 :: 1.635 HG2 :: 1.135 HG3 :: 1.195 HD2 :: 1.355 HD3 :: 1.475 HE2 :: 2.701 HE3 :: 2.701 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 :: 129.422 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.96 A 0.02 C Shift Assignments>> CA :: 58.560 CB :: 32.060 CG1 :: 17.570 CG2 :: 18.083 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 :: 7.542 HA :: 4.261 HB :: 1.921 HG11 :: 0.782 HG12 :: 0.782 HG13 :: 0.782 HG21 :: 0.870 HG22 :: 0.870 HG23 :: 0.870 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 :: 116.181 Ave N Shift Values>> N :: 121.14(4.54) 1.C81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.23 K 0.21 R 0.19 C 0.16 Q 0.06 W 0.03 H 0.03 I 0.03 E 0.01 HN Overlap>> 1.L137 1.L137 C Shift Assignments>> C :: 169.797 CA :: 56.513 CB :: 25.931 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.934 HA :: 4.683 HB2 :: 2.885 HB3 :: 2.510 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 :: 126.647 Ave N Shift Values>> N :: 120.17(4.64) 1.G82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.21 K 0.21 D 0.2 F 0.13 Y 0.09 I 0.04 C 0.04 N 0.02 R 0.02 C Shift Assignments>> C :: 168.878 CA :: 41.560 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.044 HA2 :: 4.413 HA3 :: 3.906 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 117.876 Ave N Shift Values>> N :: 109.67(3.87) 1.E83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.28 C 0.27 K 0.23 E 0.1 R 0.06 I 0.01 M 0.01 C Shift Assignments>> C :: 175.936 CA :: 56.749 CB :: 28.196 CG :: 34.352 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 :: 8.286 HA :: 3.968 HB2 :: 1.973 HB3 :: 1.899 HG2 :: 2.203 HG3 :: 2.089 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 :: 116.633 Ave N Shift Values>> N :: 120.67(3.48) 1.R84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.53 K 0.22 L 0.18 A 0.05 C Shift Assignments>> C :: 173.430 CA :: 51.314 CB :: 29.334 CG :: 24.298 CD :: 40.460 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 :: 8.366 HA :: 4.848 HB2 :: 2.325 HB3 :: 1.855 HG2 :: 1.628 HG3 :: 1.628 HD2 :: 3.149 HD3 :: 3.149 HE :: 7.415 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 :: 113.342 NE :: 86.144 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.K85 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.55 K 0.26 A 0.15 V 0.01 C Shift Assignments>> C :: 172.031 CA :: 52.900 CB :: 32.729 CG :: 23.185 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 :: 6.794 HA :: 5.200 HB2 :: 1.574 HB3 :: 1.305 HE2 :: 1.990(S) HE3 :: 1.990(S) 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 :: 119.067 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.C86 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.16 C 0.15 H 0.14 K 0.12 R 0.11 L 0.1 W 0.09 E 0.05 M 0.03 HN Overlap>> 1.I55 1.I55 C Shift Assignments>> C :: 168.043(S) CA :: 53.124 CB :: 28.422 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 9.257 HA :: 4.926 HB2 :: 3.146 HB3 :: 2.683 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 :: 127.355 Ave N Shift Values>> N :: 120.17(4.64) 1.V87 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.93 I 0.05 C Shift Assignments>> C :: 171.864 CA :: 59.016 CB :: 31.144 CG1 :: 17.441 CG2 :: 16.858 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 :: 8.627 HA :: 4.705 HB :: 1.777 HG11 :: 0.807 HG12 :: 0.807 HG13 :: 0.807 HG21 :: 0.776 HG22 :: 0.776 HG23 :: 0.776 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 :: 125.351 Ave N Shift Values>> N :: 121.14(4.54) 1.L88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.42 G 0.31 C 0.14 A 0.1 C Shift Assignments>> C :: 172.992 CA :: 50.172 CB :: 42.700 CG :: 24.814 CD1 :: 23.503 CD2 :: 23.862 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 :: 9.566 HA :: 5.324 HB2 :: 1.794 HB3 :: 1.440 HG :: 1.682 HD11 :: 0.470 HD12 :: 0.470 HD13 :: 0.470 HD21 :: 0.745 HD22 :: 0.745 HD23 :: 0.745 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 :: 127.342 Ave N Shift Values>> N :: 121.86(3.9) 1.F89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.96 W 0.01 F 0.01 C Shift Assignments>> C :: 174.224 CA :: 53.119 CB :: 37.031 CD1 :: 128.242 CE1 :: 128.852 CZ :: 127.241 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 :: 8.928 HA :: 5.605 HB2 :: 2.968 HB3 :: 2.807 HD1 :: 7.123 HD2 :: 7.123 HE1 :: 7.313 HE2 :: 7.313 HZ :: 7.232 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 119.585 Ave N Shift Values>> N :: 120.45(4.18) 1.I90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.84 A 0.11 I 0.04 C Shift Assignments>> C :: 170.904 CA :: 56.296 CB :: 38.617 CG1 :: 23.478 CG2 :: 15.924 CD1 :: 11.551 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.351 HA :: 5.129 HB :: 1.856 HG12 :: 1.754 HG13 :: 1.073 HG21 :: 0.861 HG22 :: 0.861 HG23 :: 0.861 HD11 :: 0.736 HD12 :: 0.736 HD13 :: 0.736 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 118.580 Ave N Shift Values>> N :: 121.46(4.28) 1.E91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.29 C 0.26 K 0.17 P 0.11 R 0.1 M 0.02 E 0.01 C Shift Assignments>> C :: 172.867 CA :: 52.217 CB :: 27.975 CG :: 33.700 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 :: 8.149 HA :: 5.160 HB2 :: 2.027 HB3 :: 1.900 HG2 :: 1.996 HG3 :: 1.996 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 :: 122.976 Ave N Shift Values>> N :: 120.67(3.48) 1.W92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.97 W 0.02 C Shift Assignments>> C :: 172.240 CA :: 53.806 CB :: 28.662 CD1 :: 123.949 CE3 :: 117.614 CZ2 :: 111.759 CZ3 :: 118.072 CH2 :: 121.366 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 :: 9.313 HA :: 4.850 HB2 :: 3.277 HB3 :: 2.874 HD1 :: 6.981 HE1 :: 9.677 HE3 :: 7.381 HZ2 :: 7.073 HZ3 :: 6.376 HH2 :: 6.678 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 :: 126.743 NE1 :: 128.478 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.E93 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.51 C 0.42 R 0.02 Q 0.01 A 0.01 C Shift Assignments>> C :: 172.908 CA :: 54.477 CB :: 24.124(S) CG :: 32.633 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 :: 8.797 HA :: 3.474 HB2 :: 1.776 HB3 :: 1.627 HG2 :: 1.391(S) HG3 :: 1.005(S) 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 :: 126.797 Ave N Shift Values>> N :: 120.67(3.48) 1.K94 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Suspicious PRTL>> L 0.54 C 0.38 A 0.07 C Shift Assignments>> C :: 172.637 CA :: 55.159 CB :: 26.840(S) CG :: 22.671 CD :: 26.087 CE :: 39.463 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 :: 8.537 HA :: 3.698 HB2 :: 2.092 HB3 :: 1.953 HG2 :: 1.283 HG3 :: 1.252 HD2 :: 1.558 HD3 :: 1.620 HE2 :: 2.892 HE3 :: 2.892 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 :: 108.122(S) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.57 A 0.41 C Shift Assignments>> C :: 171.572 CA :: 51.985 CB :: 32.730 CG :: 22.623 CD :: 25.980 CE :: 39.681 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 :: 7.820 HA :: 4.560 HB2 :: 1.719 HB3 :: 1.448 HG2 :: 1.334 HG3 :: 1.470 HD2 :: 1.722 HD3 :: 1.722 HE2 :: 3.015 HE3 :: 3.015 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 :: 120.999 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.T96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 T 0.27 S 0.23 A 0.07 C Shift Assignments>> C :: 171.518 CA :: 58.781 CB :: 67.391 CG2 :: 19.456 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 :: 7.781 HA :: 5.254 HB :: 3.666 HG21 :: 1.026 HG22 :: 1.026 HG23 :: 1.026 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.342 Ave N Shift Values>> N :: 115.42(4.75) 1.Y97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.92 Y 0.07 C Shift Assignments>> C :: 170.444 CA :: 53.354 CB :: 39.756 CD1 :: 130.278 CE1 :: 115.451 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 :: 9.020 HA :: 4.760 HB2 :: 2.919 HB3 :: 2.297 HD1 :: 6.979 HD2 :: 6.979 HE1 :: 6.762 HE2 :: 6.762 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 :: 123.430 Ave N Shift Values>> N :: 120.52(4.2) 1.Q98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.32 C 0.25 K 0.21 R 0.13 M 0.03 P 0.02 E 0.01 C Shift Assignments>> C :: 169.901 CA :: 52.894 CB :: 27.974 CG :: 33.518 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 :: 8.695 HA :: 4.656 HB2 :: 2.020 HB3 :: 1.890 HG2 :: 2.205 HG3 :: 2.205 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 :: 122.635 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L99 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.54 G 0.33 C 0.07 L 0.04 C Shift Assignments>> C :: 169.895(S) CA :: 50.180 CB :: 43.146 CG :: 24.934 CD1 :: 21.184 CD2 :: 24.309 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 :: 9.206 HA :: 4.959 HB2 :: 1.679 HB3 :: 1.679 HG :: 1.219 HD11 :: 0.640 HD12 :: 0.640 HD13 :: 0.640 HD21 :: 0.575 HD22 :: 0.575 HD23 :: 0.575 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 :: 130.510 Ave N Shift Values>> N :: 121.86(3.9) 1.D100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.53 D 0.23 C 0.1 L 0.05 F 0.02 Y 0.01 G 0.01 C Shift Assignments>> CA :: 49.501 CB :: 39.994 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 :: 9.060 HA :: 5.105 HB2 :: 3.089 HB3 :: 2.024 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 :: 129.093 Ave N Shift Values>> N :: 120.65(3.86) 1.L101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.77 G 0.1 C 0.09 L 0.01 C Shift Assignments>> C :: 171.718 CA :: 49.501 CB :: 42.006 CG :: 23.695 CD1 :: 24.113 CD2 :: 21.184 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 :: 8.536 HA :: 5.192 HB2 :: 1.729 HB3 :: 0.934 HG :: 0.682 HD11 :: 0.585 HD12 :: 0.585 HD13 :: 0.585 HD21 :: 0.650 HD22 :: 0.650 HD23 :: 0.650 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 :: 119.756 Ave N Shift Values>> N :: 121.86(3.9) 1.F102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.94 F 0.04 C Shift Assignments>> CA :: 52.215 CB :: 39.528 CD1 :: 130.012 CE1 :: 127.981 CZ :: 125.893 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 :: 8.733 HA :: 5.324 HB2 :: 2.424 HB3 :: 2.171 HD1 :: 6.758 HD2 :: 6.758 HE1 :: 7.130 HE2 :: 7.130 HZ :: 7.323 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 119.803 Ave N Shift Values>> N :: 120.45(4.18) 1.T103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.65 C 0.21 T 0.12 C Shift Assignments>> C :: 172.052 CA :: 55.611 CB :: 69.217 CG2 :: 20.592 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 :: 7.940 HA :: 5.646 HB :: 3.867 HG21 :: 0.976 HG22 :: 0.976 HG23 :: 0.976 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 107.681 Ave N Shift Values>> N :: 115.42(4.75) 1.A104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.82 A 0.12 L 0.03 C Shift Assignments>> C :: 172.992 CA :: 47.683 CB :: 20.951 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.651 HA :: 4.573 HB1 :: 1.368 HB2 :: 1.368 HB3 :: 1.368 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.958 Ave N Shift Values>> N :: 123.23(3.54) 1.L105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.87 C 0.09 L 0.02 HN Overlap>> 1.K8 1.K8 C Shift Assignments>> C :: 172.031 CA :: 50.859 CB :: 40.201 CG :: 24.674 CD1 :: 22.953 CD2 :: 20.729 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 :: 8.351 HA :: 4.934 HB2 :: 1.964 HB3 :: 1.387 HG :: 1.701 HD11 :: 0.959 HD12 :: 0.959 HD13 :: 0.959 HD21 :: 0.865 HD22 :: 0.865 HD23 :: 0.865 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 :: 120.296 Ave N Shift Values>> N :: 121.86(3.9) 1.A106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.71 A 0.25 I 0.01 C 0.01 C Shift Assignments>> C :: 178.338 CA :: 54.032 CB :: 15.507 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.068 HA :: 3.827 HB1 :: 1.453 HB2 :: 1.453 HB3 :: 1.453 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.152 Ave N Shift Values>> N :: 123.23(3.54) 1.E107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.35 K 0.28 Q 0.18 R 0.14 E 0.01 C Shift Assignments>> C :: 174.892 CA :: 56.292 CB :: 26.159 CG :: 33.690 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 :: 9.664 HA :: 4.261 HB2 :: 2.182 HB3 :: 2.182 HG2 :: 2.376 HG3 :: 2.376 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 :: 115.897 Ave N Shift Values>> N :: 120.67(3.48) 1.E108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.25 Q 0.23 R 0.19 K 0.18 P 0.08 M 0.04 C Shift Assignments>> CA :: 52.671 CB :: 27.747 CG :: 32.954 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 :: 7.632 HA :: 4.512 HB2 :: 2.707 HB3 :: 2.707 HG2 :: 2.760 HG3 :: 2.760 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 :: 115.684 Ave N Shift Values>> N :: 120.67(3.48) 1.K109 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.29 C 0.23 W 0.15 E 0.07 Q 0.06 H 0.05 R 0.05 P 0.02 V 0.02 HN Overlap>> 1.Q25 1.Q25 1.L142 1.L142 C Shift Assignments>> C :: 169.839(S) CA :: 60.592 CB :: 28.655 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 :: 7.552 HA :: 3.843 HB2 :: 2.175 HB3 :: 2.175 HG2 :: 1.908 HG3 :: 1.908 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 :: 119.324 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P110 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Indeterminable PRTL>> I 0.74 C 0.18 W 0.02 V 0.01 C Shift Assignments>> C :: 174.285 CA :: 63.998 CB :: 27.747(S) 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 :: 3.925 HB2 :: 1.495 HB3 :: 0.900 HG2 :: 1.345 HG3 :: 1.345 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.Y111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.64 H 0.29 W 0.05 C Shift Assignments>> C :: 176.584 CA :: 56.745 CB :: 33.638 CD1 :: 130.057 CE1 :: 116.928 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 :: 6.388 HA :: 3.830 HB2 :: 3.436 HB3 :: 2.846 HD1 :: 6.924 HD2 :: 6.924 HE1 :: 6.735 HE2 :: 6.735 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 :: 114.378 Ave N Shift Values>> N :: 120.52(4.2) 1.A112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.55 M 0.43 C 0.01 C Shift Assignments>> C :: 176.208 CA :: 52.667 CB :: 16.420 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.620 HA :: 3.899 HB1 :: 1.605 HB2 :: 1.605 HB3 :: 1.605 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.190 Ave N Shift Values>> N :: 123.23(3.54) 1.I113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.79 I 0.2 C Shift Assignments>> C :: 175.477 CA :: 64.221 CB :: 35.664 CG1 :: 27.827 CG2 :: 13.777 CD1 :: 12.215 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 :: 8.640 HA :: 3.326 HB :: 1.655 HG12 :: 1.814 HG13 :: 0.620 HG21 :: 0.791 HG22 :: 0.791 HG23 :: 0.791 HD11 :: 0.836 HD12 :: 0.836 HD13 :: 0.836 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 118.663 Ave N Shift Values>> N :: 121.46(4.28) 1.F114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.95 F 0.03 C Shift Assignments>> C :: 175.372 CA :: 59.451 CB :: 37.723 CD1 :: 128.921 CE1 :: 128.547 CZ :: 126.548 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 :: 7.777 HA :: 4.550 HB2 :: 3.297 HB3 :: 2.940 HD1 :: 7.264 HD2 :: 7.264 HE1 :: 7.122 HE2 :: 7.122 HZ :: 7.096 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 121.946 Ave N Shift Values>> N :: 120.45(4.18) 1.H115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 H 0.35 W 0.28 C Shift Assignments>> C :: 174.328 CA :: 57.425 CB :: 30.010 CD2 :: 117.852 CE1 :: 136.134 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 :: 8.276 HA :: 3.920 HB2 :: 2.850 HB3 :: 2.850 HD2 :: 7.020 HE1 :: 7.581 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 118.270 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.F116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.8 W 0.17 F 0.01 C Shift Assignments>> C :: 174.850 CA :: 57.199 CB :: 34.997 CD1 :: 130.765 CE1 :: 127.992 CZ :: 126.850 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 :: 8.614 HA :: 4.440 HB2 :: 2.857 HB3 :: 2.545 HD1 :: 6.978 HD2 :: 6.978 HE1 :: 6.967 HE2 :: 6.967 HZ :: 7.034 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 :: 109.884 Ave N Shift Values>> N :: 120.45(4.18) 1.T117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.55 C 0.41 T 0.02 C Shift Assignments>> CA :: 64.224 CB :: 65.341 CG2 :: 18.286 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 :: 7.623 HA :: 4.309 HB :: 3.979 HG21 :: 1.044 HG22 :: 1.044 HG23 :: 1.044 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.995 Ave N Shift Values>> N :: 115.42(4.75) 1.G118 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.21 L 0.21 D 0.2 F 0.13 Y 0.09 I 0.04 C 0.04 N 0.02 R 0.02 C Shift Assignments>> C :: 167.625(S) CA :: 41.569 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 6.897 HA2 :: 3.026 HA3 :: 3.351 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.807 Ave N Shift Values>> N :: 109.67(3.87) 1.P119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.98 P 0.01 C Shift Assignments>> C :: 174.690 CA :: 60.373 CB :: 32.051 CG :: 26.353 CD :: 53.341 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 :: 4.668 HB2 :: 2.390 HB3 :: 2.130 HG2 :: 1.900 HG3 :: 1.900 HD2 :: 4.284 HD3 :: 4.284 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.V120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.73 I 0.24 V 0.02 C Shift Assignments>> C :: 174.670 CA :: 64.901 CB :: 28.422 CG1 :: 17.805 CG2 :: 19.281 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.418 HA :: 3.025 HB :: 1.615 HG11 :: 0.714 HG12 :: 0.714 HG13 :: 0.714 HG21 :: 0.408 HG22 :: 0.408 HG23 :: 0.408 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 :: 122.263 Ave N Shift Values>> N :: 121.14(4.54) 1.S121 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.95 C 0.04 HN Overlap>> 1.K171 1.K171 C Shift Assignments>> CA :: 58.791 CB :: 58.548(S) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.380 HA :: 3.815 HB2 :: 3.784 HB3 :: 3.784 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 113.164 Ave N Shift Values>> N :: 116.28(3.52) 1.Y122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.5 F 0.33 Y 0.14 H 0.01 C Shift Assignments>> C :: 173.262 CA :: 56.524 CB :: 36.811 CD2 :: 130.469 CE2 :: 115.739 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 :: 6.441 HA :: 4.177 HB2 :: 2.595 HB3 :: 2.473 HD1 :: 6.771 HD2 :: 6.771 HE1 :: 6.709 HE2 :: 6.709 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 :: 124.525 Ave N Shift Values>> N :: 120.52(4.2) 1.L123 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.65 C 0.34 C Shift Assignments>> C :: 176.772 CA :: 54.702 CB :: 37.952 CG :: 23.180 CD1 :: 23.183 CD2 :: 18.549 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 :: 7.416 HA :: 3.506 HB2 :: 1.649 HB3 :: 1.649 HG :: 1.309 HD11 :: 0.455 HD12 :: 0.455 HD13 :: 0.455 HD21 :: 0.354 HD22 :: 0.354 HD23 :: 0.354 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 :: 117.017 Ave N Shift Values>> N :: 121.86(3.9) 1.I124 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.91 I 0.08 C Shift Assignments>> C :: 175.957 CA :: 62.871 CB :: 35.225 CG1 :: 26.522 CG2 :: 14.153 CD1 :: 10.744 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 :: 8.440 HA :: 3.502 HB :: 1.731 HG12 :: 1.587 HG13 :: 1.032 HG21 :: 0.830 HG22 :: 0.830 HG23 :: 0.830 HD11 :: 0.709 HD12 :: 0.709 HD13 :: 0.709 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.820 Ave N Shift Values>> N :: 121.46(4.28) 1.R125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.45 C 0.33 K 0.19 C Shift Assignments>> C :: 176.813 CA :: 56.973 CB :: 27.288 CG :: 24.990 CD :: 40.768 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 :: 7.086 HA :: 4.103 HB2 :: 1.861 HB3 :: 1.861 HG2 :: 1.555 HG3 :: 1.737 HD2 :: 3.215 HD3 :: 3.215 HE :: 7.441 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 :: 120.740 NE :: 84.714 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.I126 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.99 HN Overlap>> 1.R17 1.R17 C Shift Assignments>> C :: 171.718 CA :: 59.917 CB :: 33.627 CG1 :: 24.130 CG2 :: 14.635 CD1 :: 6.624(S) 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 :: 7.811 HA :: 3.413 HB :: 1.691 HG12 :: 0.425 HG13 :: 0.480 HG21 :: 0.492 HG22 :: 0.492 HG23 :: 0.492 HD11 :: -0.253 HD12 :: -0.253 HD13 :: -0.253 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 :: 122.126 Ave N Shift Values>> N :: 121.46(4.28) 1.R127 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.4 L 0.26 R 0.18 K 0.15 C Shift Assignments>> C :: 177.001 CA :: 57.659 CB :: 27.521 CG :: 26.496 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 :: 8.807 HA :: 3.913 HB2 :: 1.908 HB3 :: 1.908 HG2 :: 1.733 HG3 :: 1.733 HD2 :: 1.779(S) HD3 :: 1.779(S) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 119.063 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) SRO Rule Breaks>> (HD2 > HB2 : 0.9950) (HD3 > HB2 : 0.9950) (HD2 > HB3 : 0.9951) (HD3 > HB3 : 0.9958) 1.A128 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.54 A 0.43 C 0.01 C Shift Assignments>> C :: 177.502 CA :: 52.443 CB :: 15.059 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.987 HA :: 4.182 HB1 :: 1.521 HB2 :: 1.521 HB3 :: 1.521 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.268 Ave N Shift Values>> N :: 123.23(3.54) 1.A129 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.5 M 0.47 C 0.01 C Shift Assignments>> C :: 178.735 CA :: 52.226 CB :: 15.512 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.528 HA :: 4.265 HB1 :: 1.736 HB2 :: 1.736 HB3 :: 1.736 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.273 Ave N Shift Values>> N :: 123.23(3.54) 1.L130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.6 C 0.37 L 0.02 C Shift Assignments>> C :: 177.106 CA :: 54.709 CB :: 38.618 CG :: 24.565 CD1 :: 25.423 CD2 :: 20.444 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 :: 8.388 HA :: 4.205 HB2 :: 1.650 HB3 :: 1.650 HG :: 1.955 HD11 :: 0.905 HD12 :: 0.905 HD13 :: 0.905 HD21 :: 0.978 HD22 :: 0.978 HD23 :: 0.978 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.557 Ave N Shift Values>> N :: 121.86(3.9) 1.K131 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.9 L 0.05 A 0.03 C Shift Assignments>> C :: 177.440 CA :: 56.753 CB :: 29.557 CG :: 22.403 CD :: 26.740 CE :: 39.572 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 :: 8.325 HA :: 4.271 HB2 :: 2.104 HB3 :: 2.002 HG2 :: 1.602 HG3 :: 1.544 HD2 :: 1.728 HD3 :: 1.776 HE2 :: 2.994 HE3 :: 2.994 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 121.673 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K132 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.87 L 0.07 A 0.05 C Shift Assignments>> C :: 174.642 CA :: 56.065 CB :: 29.557 CG :: 22.716 CD :: 26.522 CE :: 39.463 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 :: 7.342 HA :: 4.158 HB2 :: 1.982 HB3 :: 1.982 HG2 :: 1.563 HG3 :: 1.720 HD2 :: 1.770 HD3 :: 1.770 HE2 :: 3.025 HE3 :: 3.025 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 117.933 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.59 A 0.39 C Shift Assignments>> C :: 171.781 CA :: 52.443 CB :: 30.465 CG :: 22.611 CD :: 26.849 CE :: 39.463 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 :: 7.373 HA :: 4.417 HB2 :: 1.685 HB3 :: 1.685 HG2 :: 1.386 HG3 :: 1.456 HD2 :: 1.689 HD3 :: 1.689 HE2 :: 2.933 HE3 :: 2.933 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 :: 116.405 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.N134 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.26 C 0.26 Q 0.15 K 0.09 P 0.06 H 0.04 R 0.03 N 0.02 W 0.01 E 0.01 C Shift Assignments>> C :: 171.133 CA :: 51.993 CB :: 34.091 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 :: 7.969 HA :: 4.339 HB2 :: 3.110 HB3 :: 2.750 HD21 :: 6.825 HD22 :: 7.437 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 112.355 ND2 :: 112.072 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.Y135 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.72 Y 0.27 C Shift Assignments>> C :: 173.556 CA :: 53.351 CB :: 39.756 CD1 :: 130.653 CE1 :: 116.196 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 :: 7.748 HA :: 5.705 HB2 :: 2.879 HB3 :: 2.879 HD1 :: 6.970 HD2 :: 6.970 HE1 :: 6.551 HE2 :: 6.551 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 :: 114.995 Ave N Shift Values>> N :: 120.52(4.2) 1.K136 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.55 A 0.44 C Shift Assignments>> C :: 170.632 CA :: 52.452 CB :: 33.182 CG :: 22.408 CD :: 26.522 CE :: 39.246 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 :: 9.319 HA :: 4.636 HB2 :: 1.765 HB3 :: 1.705 HG2 :: 1.475 HG3 :: 1.210 HD2 :: 1.560 HD3 :: 1.560 HE2 :: 2.785 HE3 :: 2.720 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 121.899 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L137 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.56 A 0.37 C 0.04 L 0.01 HN Overlap>> 1.C81 1.C81 C Shift Assignments>> C :: 172.679 CA :: 50.631 CB :: 44.069 CG :: 24.490 CD1 :: 21.138 CD2 :: 24.488 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 :: 8.856 HA :: 5.372 HB2 :: 1.712 HB3 :: 1.238 HG :: 1.643 HD11 :: 1.165 HD12 :: 1.165 HD13 :: 1.165 HD21 :: 0.842 HD22 :: 0.842 HD23 :: 0.842 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 :: 126.698 Ave N Shift Values>> N :: 121.86(3.9) 1.N138 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 N 0.26 M 0.11 P 0.1 Q 0.02 K 0.01 E 0.01 G 0.01 C Shift Assignments>> C :: 172.198 CA :: 49.727 CB :: 35.446 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 :: 8.856 HA :: 4.750 HB2 :: 2.995 HB3 :: 2.899 HD21 :: 6.919 HD22 :: 7.620 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 :: 125.299 ND2 :: 112.978 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.Q139 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.48 K 0.45 A 0.02 V 0.01 Q 0.01 C Shift Assignments>> C :: 171.363 CA :: 54.480 CB :: 23.668 CG :: 33.020 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 :: 9.317 HA :: 3.538 HB2 :: 1.440 HB3 :: 1.440 HG2 :: 1.957 HG3 :: 1.957 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 :: 116.462 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.Y140 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.83 H 0.09 W 0.04 Y 0.02 C Shift Assignments>> CA :: 54.480 CB :: 35.452 CD1 :: 130.744 CE1 :: 115.510 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 :: 8.590 HA :: 4.507 HB2 :: 3.300 HB3 :: 2.901 HD1 :: 6.945 HD2 :: 6.945 HE1 :: 6.549 HE2 :: 6.549 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 :: 120.138 Ave N Shift Values>> N :: 120.52(4.2) 1.G141 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.21 L 0.21 D 0.2 F 0.13 Y 0.09 I 0.04 C 0.04 N 0.02 R 0.02 C Shift Assignments>> C :: 165.370(S) CA :: 41.566 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.236 HA2 :: 3.111 HA3 :: 1.495(S) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 105.529 Ave N Shift Values>> N :: 109.67(3.87) 1.L142 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.57 G 0.23 C 0.1 L 0.08 HN Overlap>> 1.I34 1.K109 1.I34 1.K109 C Shift Assignments>> C :: 169.860(S) CA :: 50.180 CB :: 42.700 CG :: 24.782 CD1 :: 21.614 CD2 :: 23.612 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 :: 7.516 HA :: 4.947 HB2 :: 1.852 HB3 :: 1.028 HG :: 1.243 HD11 :: 0.830 HD12 :: 0.830 HD13 :: 0.830 HD21 :: 0.505 HD22 :: 0.505 HD23 :: 0.505 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 :: 119.237 Ave N Shift Values>> N :: 121.86(3.9) 1.F143 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.75 F 0.23 C Shift Assignments>> C :: 172.470 CA :: 53.571 CB :: 40.430 CD1 :: 129.344 CE1 :: 128.808 CZ :: 127.028 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 9.403 HA :: 5.096 HB2 :: 2.722 HB3 :: 2.508 HD1 :: 6.736 HD2 :: 6.736 HE1 :: 7.158 HE2 :: 7.158 HZ :: 7.220 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 :: 122.506 Ave N Shift Values>> N :: 120.45(4.18) 1.K144 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.52 C 0.47 C Shift Assignments>> C :: 174.224 CA :: 52.670 CB :: 31.598 CG :: 21.969 CD :: 26.522 CE :: 39.463 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 :: 8.931 HA :: 4.683 HB2 :: 1.440 HB3 :: 1.440 HG2 :: 1.135 HG3 :: 1.160 HD2 :: 1.440 HD3 :: 1.440 HE2 :: 2.781 HE3 :: 2.781 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 :: 122.899 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.N145 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.27 C 0.23 Q 0.18 K 0.11 E 0.05 N 0.04 H 0.03 R 0.02 W 0.01 Y 0.01 C Shift Assignments>> CA :: 53.223 CB :: 34.577 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 9.225 HA :: 4.250 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 :: 126.562 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.Q146 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.46 C 0.36 R 0.14 Q 0.01 C Shift Assignments>> CA :: 54.316 CB :: 25.019 CG :: 31.776 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 :: 8.869 HA :: 3.990 HB2 :: 2.272 HB3 :: 2.190 HG2 :: 2.190 HG3 :: 2.240 HE21 :: 6.778 HE22 :: 7.390 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 :: 112.109 NE2 :: 111.732 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.T147 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.54 T 0.28 S 0.11 A 0.06 C Shift Assignments>> C :: 170.444 CA :: 59.235 CB :: 68.081 CG2 :: 18.807 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.018 HA :: 4.560 HB :: 4.163 HG21 :: 1.290 HG22 :: 1.290 HG23 :: 1.290 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.974 Ave N Shift Values>> N :: 115.42(4.75) 1.L148 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.74 C 0.23 L 0.02 C Shift Assignments>> C :: 173.952 CA :: 53.120 CB :: 39.982 CG :: 23.953 CD1 :: 21.348 CD2 :: 22.908 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 :: 8.717 HA :: 3.652 HB2 :: 1.437 HB3 :: 1.321 HG :: 1.062 HD11 :: 0.371 HD12 :: 0.371 HD13 :: 0.371 HD21 :: 0.569 HD22 :: 0.569 HD23 :: 0.569 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 :: 130.060 Ave N Shift Values>> N :: 121.86(3.9) 1.V149 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.83 A 0.15 HN Overlap>> 1.I27 1.I27 C Shift Assignments>> C :: 172.094 CA :: 56.970 CB :: 29.780 CG1 :: 18.052 CG2 :: 19.145 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.015 HA :: 4.222 HB :: 1.790 HG11 :: 0.819 HG12 :: 0.819 HG13 :: 0.819 HG21 :: 0.903 HG22 :: 0.903 HG23 :: 0.903 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 :: 130.244 Ave N Shift Values>> N :: 121.14(4.54) 1.P150 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.78 A 0.2 C Shift Assignments>> C :: 173.323 CA :: 59.697 CB :: 27.064(S) CG :: 22.073(S) CD :: 54.973(S) 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 :: 4.534 HB2 :: 2.070 HB3 :: 1.947 HG2 :: 1.259 HG3 :: 1.259 HD2 :: 3.695 HD3 :: 3.695 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.L151 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.87 C 0.07 G 0.04 C Shift Assignments>> C :: 174.892 CA :: 51.545 CB :: 42.476 CG :: 23.913 CD1 :: 22.934 CD2 :: 20.261 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 :: 7.941 HA :: 4.395 HB2 :: 1.729 HB3 :: 1.729 HG :: 1.574 HD11 :: 0.826 HD12 :: 0.826 HD13 :: 0.826 HD21 :: 0.728 HD22 :: 0.728 HD23 :: 0.728 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 :: 123.695 Ave N Shift Values>> N :: 121.86(3.9) 1.K152 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.48 L 0.26 C 0.24 C Shift Assignments>> C :: 172.261 CA :: 52.335 CB :: 27.594 CG :: 21.797 CD :: 26.305 CE :: 39.463 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 :: 9.306 HA :: 4.505 HB2 :: 1.810 HB3 :: 1.650 HG2 :: 1.315 HG3 :: 1.395 HD2 :: 1.635 HD3 :: 1.635 HE2 :: 2.925 HE3 :: 2.925 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 :: 126.881 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I153 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.63 A 0.31 I 0.04 C Shift Assignments>> C :: 173.075 CA :: 56.304 CB :: 39.979 CG1 :: 23.043 CG2 :: 17.446 CD1 :: 12.550 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 :: 7.154 HA :: 4.584 HB :: 1.803 HG12 :: 1.167 HG13 :: 0.826 HG21 :: 0.704 HG22 :: 0.704 HG23 :: 0.704 HD11 :: 0.439 HD12 :: 0.439 HD13 :: 0.439 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 :: 114.198 Ave N Shift Values>> N :: 121.46(4.28) 1.T154 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.53 C 0.4 S 0.02 A 0.02 C Shift Assignments>> CA :: 59.704 CB :: 68.529 CG2 :: 19.140 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 9.370 HA :: 4.539 HB :: 4.279 HG21 :: 1.150 HG22 :: 1.150 HG23 :: 1.150 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 :: 111.055 Ave N Shift Values>> N :: 115.42(4.75) 1.T155 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.74 C 0.21 T 0.03 C Shift Assignments>> C :: 172.081 CA :: 56.519 CB :: 70.667 CG2 :: 18.858 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 :: 7.692 HA :: 4.899 HB :: 4.695 HG21 :: 1.150 HG22 :: 1.150 HG23 :: 1.150 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 :: 111.163 Ave N Shift Values>> N :: 115.42(4.75) 1.E156 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 Q 0.26 R 0.18 K 0.14 E 0.02 M 0.01 C Shift Assignments>> CA :: 56.758 CB :: 26.873 CG :: 33.674 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 :: 9.411 HA :: 3.758 HB2 :: 2.161 HB3 :: 2.297 HG2 :: 2.420 HG3 :: 2.509 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 123.371 Ave N Shift Values>> N :: 120.67(3.48) 1.K157 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.81 V 0.11 K 0.04 L 0.02 C Shift Assignments>> C :: 175.957 CA :: 57.879 CB :: 29.768 CG :: 22.414 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 :: 8.238 HA :: 3.791 HB2 :: 1.529 HB3 :: 1.421 HG2 :: 1.459 HG3 :: 1.459 HD2 :: 1.715 HD3 :: 1.715 HE2 :: 2.947 HE3 :: 2.947 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 :: 119.344 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E158 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.31 Q 0.3 K 0.17 R 0.09 E 0.08 I 0.01 C Shift Assignments>> C :: 176.131 CA :: 56.296 CB :: 27.519 CG :: 34.368 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 :: 7.581 HA :: 3.849 HB2 :: 2.246 HB3 :: 2.014 HG2 :: 2.223 HG3 :: 2.223 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 :: 117.820 Ave N Shift Values>> N :: 120.67(3.48) 1.L159 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.6 A 0.38 C Shift Assignments>> C :: 173.681 CA :: 55.843 CB :: 38.381 CG :: 24.456 CD1 :: 20.358 CD2 :: 23.468 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 :: 7.576 HA :: 3.637 HB2 :: 1.992 HB3 :: 1.992 HG :: 0.910 HD11 :: 0.578 HD12 :: 0.578 HD13 :: 0.578 HD21 :: 0.303 HD22 :: 0.303 HD23 :: 0.303 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 :: 120.044 Ave N Shift Values>> N :: 121.86(3.9) 1.I160 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.79 I 0.2 C Shift Assignments>> C :: 174.328 CA :: 62.868 CB :: 35.893 CG1 :: 24.480 CG2 :: 15.237 CD1 :: 11.724 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 :: 7.823 HA :: 3.182 HB :: 1.806 HG12 :: 1.470 HG13 :: 1.383 HG21 :: 0.895 HG22 :: 0.895 HG23 :: 0.895 HD11 :: 0.999 HD12 :: 0.999 HD13 :: 0.999 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.708 Ave N Shift Values>> N :: 121.46(4.28) 1.K161 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.86 A 0.07 L 0.06 C Shift Assignments>> C :: 178.212 CA :: 56.516 CB :: 29.333 CG :: 21.997 CD :: 26.414 CE :: 39.355 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 :: 7.435 HA :: 4.214 HB2 :: 1.882 HB3 :: 1.882 HG2 :: 1.359 HG3 :: 1.485 HD2 :: 1.622 HD3 :: 1.622 HE2 :: 2.896 HE3 :: 2.896 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 :: 117.822 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E162 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 K 0.29 R 0.23 Q 0.12 C Shift Assignments>> C :: 175.978 CA :: 55.832 CB :: 26.156 CG :: 32.721 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 :: 8.255 HA :: 3.960 HB2 :: 2.011 HB3 :: 1.946 HG2 :: 2.305 HG3 :: 2.305 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 :: 121.391 Ave N Shift Values>> N :: 120.67(3.48) 1.L163 Overall: Suspicious Typing: Suspicious SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.87 C 0.12 C Shift Assignments>> CA :: 52.671 CB :: 39.530 CG :: 22.825(S) CD1 :: 23.571 CD2 :: 19.835 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 :: 7.833 HA :: 3.949 HB2 :: 1.823 HB3 :: 1.428 HG :: 1.893 HD11 :: 0.563 HD12 :: 0.563 HD13 :: 0.563 HD21 :: 0.678 HD22 :: 0.678 HD23 :: 0.678 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 :: 116.062 Ave N Shift Values>> N :: 121.86(3.9) 1.G164 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.32 K 0.22 D 0.13 R 0.09 F 0.09 Y 0.05 C 0.03 I 0.02 N 0.01 C Shift Assignments>> C :: 171.697 CA :: 42.242 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.620 HA2 :: 3.842 HA3 :: 3.590 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 104.226 Ave N Shift Values>> N :: 109.67(3.87) 1.F165 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.83 F 0.16 C Shift Assignments>> C :: 171.843 CA :: 53.361 CB :: 38.621 CD1 :: 129.294 CE1 :: 128.763 CZ :: 127.208 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 :: 7.333 HA :: 4.862 HB2 :: 3.407 HB3 :: 2.602 HD1 :: 7.130 HD2 :: 7.130 HE1 :: 7.125 HE2 :: 7.125 HZ :: 7.257 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 :: 118.516 Ave N Shift Values>> N :: 120.45(4.18) 1.T166 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.4 S 0.35 T 0.23 A 0.01 C Shift Assignments>> C :: 171.739 CA :: 60.154 CB :: 67.148 CG2 :: 19.029 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.514 HA :: 4.138 HB :: 3.984 HG21 :: 1.195 HG22 :: 1.195 HG23 :: 1.195 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.657 Ave N Shift Values>> N :: 115.42(4.75) 1.Y167 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.66 F 0.12 Y 0.11 H 0.06 W 0.03 C Shift Assignments>> CA :: 58.110 CB :: 35.312 CD2 :: 130.942 CE2 :: 115.491 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 :: 8.995 HA :: 4.040 HB2 :: 3.076 HB3 :: 2.815 HD1 :: 6.930 HD2 :: 6.930 HE1 :: 6.967 HE2 :: 6.967 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 :: 127.611 Ave N Shift Values>> N :: 120.52(4.2) 1.R168 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Anomalous H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.98 G 0.01 C Shift Assignments>> C :: 172.971 CA :: 49.948 CB :: 30.236 CG :: 32.578(S) CD :: 33.069(A) 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 :: 7.205 HA :: 4.472 HB2 :: 1.252 HB3 :: 1.252 HG2 :: 1.460 HG3 :: 1.460 HD2 :: 1.720(S) HD3 :: 1.720(S) 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 :: 126.847 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.I169 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.99 C Shift Assignments>> C :: 172.031 CA :: 58.334 CB :: 32.957 CG1 :: 22.716 CG2 :: 15.209 CD1 :: 11.488 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 :: 8.351 HA :: 4.126 HB :: 2.140 HG12 :: 1.262 HG13 :: 1.262 HG21 :: 1.148 HG22 :: 1.148 HG23 :: 1.148 HD11 :: 0.877 HD12 :: 0.877 HD13 :: 0.877 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.147 Ave N Shift Values>> N :: 121.46(4.28) 1.P170 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.94 G 0.03 K 0.01 I 0.01 C Shift Assignments>> C :: 174.623 CA :: 64.454 CB :: 29.329 CG :: 22.366(S) CD :: 41.641(S) 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 :: 3.361 HB2 :: 2.010 HB3 :: 1.730 HG2 :: 1.542 HG3 :: 1.542 HD2 :: 3.023 HD3 :: 3.023 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.K171 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.7 A 0.27 L 0.01 HN Overlap>> 1.S121 1.S121 C Shift Assignments>> C :: 173.347 CA :: 55.167 CB :: 30.010 CG :: 21.509 CD :: 27.035 CE :: 39.355 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 :: 8.334 HA :: 4.295 HB2 :: 1.955 HB3 :: 1.413 HG2 :: 1.156 HG3 :: 1.298 HD2 :: 1.598 HD3 :: 1.598 HE2 :: 2.892 HE3 :: 2.892 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 113.088 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K172 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.56 A 0.39 L 0.03 C Shift Assignments>> C :: 172.867 CA :: 51.763 CB :: 30.010 CG :: 22.771 CD :: 25.769 CE :: 39.355 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 :: 7.806 HA :: 4.320 HB2 :: 2.015 HB3 :: 1.437 HG2 :: 1.109 HG3 :: 1.269 HD2 :: 1.583 HD3 :: 1.628 HE2 :: 2.893 HE3 :: 2.893 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 :: 116.602 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.R173 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.4 C 0.15 Q 0.13 H 0.08 W 0.06 K 0.06 E 0.03 R 0.03 I 0.01 C Shift Assignments>> C :: 170.089 CA :: 54.713 CB :: 26.837 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 :: 6.852 HA :: 3.404 HB2 :: 1.288 HB3 :: 1.288 HG2 :: 0.897 HG3 :: 0.897 HD2 :: 1.775(S) HD3 :: 1.550(S) HE :: 5.840 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 :: 121.494 NE :: 82.494 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.L174 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 A 0.34 L 0.2 G 0.08 C Shift Assignments>> C :: 178.233 CA :: 54.482 CB :: 42.702 CG :: 24.456 CD1 :: 22.156 CD2 :: 22.047 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 :: 7.193 HA :: 3.988 HB2 :: 1.503 HB3 :: 1.379 HG :: 1.389 HD11 :: 0.784 HD12 :: 0.784 HD13 :: 0.784 HD21 :: 0.783 HD22 :: 0.783 HD23 :: 0.783 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 :: 128.188 Ave N Shift Values>> N :: 121.86(3.9) 2.MG1 Overall Status: Residue type MG not supported. 3.DGT1 Overall Status: Residue type DGT not supported. ########################################################################### Overall Results: #Consistent: 128 #Clerical: 0 #Suspicious: 18 #Anomalous: 1 #Mistyped: 27 #Indeterminable: 0 Typing Results: #Consistent: 145 #Suspicious: 2 #Mistyped: 27 #Indeterminable: 0 Shift Relative Order (SRO) Results: #Consistent: 173 #Suspicious: 1 C Shift Results: #Consistent: 762 #Duplicate: 0 #Unknown: 0 #Suspicious: 31 #Anomalous: 3 H Shift Results: #Consistent:1359 #Duplicate: 0 #Unknown: 0 #Suspicious: 22 #Anomalous: 0 N Shift Results: #Consistent: 178 #Duplicate: 0 #Unknown: 0 #Suspicious: 2 #Anomalous: 0 Error Summary: 1.K8 Typing: Suspicious 1.K8 CD = 40.584(A), Expected = 28.96, Std = 1.0800, ChiSquare = 5.1488e-27 1.K8 HD2 = 3.140(S), Expected = 1.61, Std = 0.2200, ChiSquare = 3.5370e-12 1.K8 HD3 = 3.140(S), Expected = 1.60, Std = 0.2200, ChiSquare = 2.5596e-12 1.I10 HG13 = -0.865(S), Expected = 1.19, Std = 0.4100, ChiSquare = 5.3813e-07 1.R15 Typing: Mistyped 1.R15 CG = 21.947(S), Expected = 27.21, Std = 1.2000, ChiSquare = 1.1554e-05 1.R15 CD = 39.168(S), Expected = 43.16, Std = 0.8800, ChiSquare = 5.7232e-06 1.R17 HD2 = 4.299(S), Expected = 3.12, Std = 0.2400, ChiSquare = 8.9922e-07 1.R17 HD3 = 4.299(S), Expected = 3.10, Std = 0.2600, ChiSquare = 3.9970e-06 1.R17 NE = 78.476(S), Expected = 84.63, Std = 1.6800, ChiSquare = 2.4919e-04 1.F20 CD2 = 127.909(S), Expected = 131.63, Std = 1.1200, ChiSquare = 8.9272e-04 1.I27 Typing: Mistyped 1.I27 HB = 0.616(S), Expected = 1.78, Std = 0.2900, ChiSquare = 5.9751e-05 1.K28 Typing: Mistyped 1.K28 CD = 24.286(S), Expected = 28.96, Std = 1.0800, ChiSquare = 1.5062e-05 1.K32 Typing: Mistyped 1.N33 HB2 = 3.918(S), Expected = 2.81, Std = 0.3100, ChiSquare = 3.5131e-04 1.V37 Typing: Mistyped 1.V37 CG2 = 15.154(S), Expected = 21.26, Std = 1.5600, ChiSquare = 9.0741e-05 1.R42 Typing: Mistyped 1.R42 CG = 33.885(S), Expected = 27.21, Std = 1.2000, ChiSquare = 2.6594e-08 1.R42 CD = 34.131(A), Expected = 43.16, Std = 0.8800, ChiSquare = 1.0646e-24 1.R42 HD2 = 2.195(S), Expected = 3.12, Std = 0.2400, ChiSquare = 1.1612e-04 1.R42 HD3 = 2.195(S), Expected = 3.10, Std = 0.2600, ChiSquare = 4.9998e-04 1.E43 Typing: Mistyped 1.E43 CB = 23.369(S), Expected = 30.01, Std = 1.7200, ChiSquare = 1.1290e-04 1.L52 C = 170.298(S), Expected = 176.99, Std = 1.9800, ChiSquare = 7.2539e-04 1.I55 Typing: Mistyped 1.K60 Typing: Mistyped 1.K63 Typing: Mistyped 1.K63 CG = 20.711(S), Expected = 24.89, Std = 1.1300, ChiSquare = 2.1711e-04 1.K63 CD = 24.362(S), Expected = 28.96, Std = 1.0800, ChiSquare = 2.0681e-05 1.K63 CE = 38.923(S), Expected = 41.89, Std = 0.8200, ChiSquare = 2.9655e-04 1.L66 Typing: Mistyped 1.L66 CB = 34.775(S), Expected = 42.31, Std = 1.8800, ChiSquare = 6.1241e-05 1.L66 CG = 21.846(S), Expected = 26.78, Std = 1.1000, ChiSquare = 7.2759e-06 1.R70 HD2 = 1.766(S), Expected = 3.12, Std = 0.2400, ChiSquare = 1.6841e-08 1.R70 HD3 = 1.766(S), Expected = 3.10, Std = 0.2600, ChiSquare = 2.8856e-07 1.K72 Typing: Mistyped 1.K79 Typing: Mistyped 1.K85 HE2 = 1.990(S), Expected = 2.92, Std = 0.1900, ChiSquare = 9.8437e-07 1.K85 HE3 = 1.990(S), Expected = 2.91, Std = 0.2000, ChiSquare = 4.2249e-06 1.C86 C = 168.043(S), Expected = 174.95, Std = 2.0700, ChiSquare = 8.4775e-04 1.V87 Typing: Mistyped 1.E93 Typing: Mistyped 1.E93 CB = 24.124(S), Expected = 30.01, Std = 1.7200, ChiSquare = 6.2141e-04 1.E93 HG2 = 1.391(S), Expected = 2.27, Std = 0.2100, ChiSquare = 2.8427e-05 1.E93 HG3 = 1.005(S), Expected = 2.25, Std = 0.2200, ChiSquare = 1.5218e-08 1.K94 Typing: Mistyped 1.K94 CB = 26.840(S), Expected = 32.79, Std = 1.7800, ChiSquare = 8.2969e-04 1.K94 N = 108.122(S), Expected = 121.05, Std = 3.7700, ChiSquare = 6.0541e-04 1.L99 C = 169.895(S), Expected = 176.99, Std = 1.9800, ChiSquare = 3.3924e-04 1.K109 C = 169.839(S), Expected = 176.64, Std = 2.0000, ChiSquare = 6.7263e-04 1.P110 CB = 27.747(S), Expected = 31.85, Std = 1.1800, ChiSquare = 5.0683e-04 1.G118 C = 167.625(S), Expected = 173.87, Std = 1.8800, ChiSquare = 8.9436e-04 1.S121 CB = 58.548(S), Expected = 63.80, Std = 1.4800, ChiSquare = 3.8721e-04 1.L123 Typing: Mistyped 1.I126 Typing: Mistyped 1.I126 CD1 = 6.624(S), Expected = 13.43, Std = 1.6700, ChiSquare = 4.5926e-05 1.R127 HD2 = 1.779(S), Expected = 3.12, Std = 0.2400, ChiSquare = 2.3036e-08 1.R127 HD3 = 1.779(S), Expected = 3.10, Std = 0.2600, ChiSquare = 3.7591e-07 1.R127 SRO Rule Break>> HD2 > HB2 : 0.994969040247678 1.R127 SRO Rule Break>> HD3 > HB2 : 0.994991652754591 1.R127 SRO Rule Break>> HD2 > HB3 : 0.995112016293279 1.R127 SRO Rule Break>> HD3 > HB3 : 0.995794785534062 1.G141 C = 165.370(S), Expected = 173.87, Std = 1.8800, ChiSquare = 6.1468e-06 1.G141 HA3 = 1.495(S), Expected = 3.90, Std = 0.3700, ChiSquare = 8.0320e-11 1.L142 C = 169.860(S), Expected = 176.99, Std = 1.9800, ChiSquare = 3.1698e-04 1.K144 Typing: Mistyped 1.P150 Typing: Mistyped 1.P150 CB = 27.064(S), Expected = 31.85, Std = 1.1800, ChiSquare = 4.9935e-05 1.P150 CG = 22.073(S), Expected = 27.17, Std = 1.0900, ChiSquare = 2.9232e-06 1.P150 CD = 54.973(S), Expected = 50.32, Std = 0.9900, ChiSquare = 2.6016e-06 1.K152 Typing: Mistyped 1.K161 Typing: Mistyped 1.L163 Typing: Suspicious 1.L163 CG = 22.825(S), Expected = 26.78, Std = 1.1000, ChiSquare = 3.2383e-04 1.R168 Typing: Mistyped 1.R168 CG = 32.578(S), Expected = 27.21, Std = 1.2000, ChiSquare = 7.7010e-06 1.R168 CD = 33.069(A), Expected = 43.16, Std = 0.8800, ChiSquare = 1.9314e-30 1.R168 HD2 = 1.720(S), Expected = 3.12, Std = 0.2400, ChiSquare = 5.4331e-09 1.R168 HD3 = 1.720(S), Expected = 3.10, Std = 0.2600, ChiSquare = 1.1102e-07 1.I169 Typing: Mistyped 1.P170 Typing: Mistyped 1.P170 CG = 22.366(S), Expected = 27.17, Std = 1.0900, ChiSquare = 1.0465e-05 1.P170 CD = 41.641(S), Expected = 50.32, Std = 0.9900, ChiSquare = 1.8403e-18 1.K171 Typing: Mistyped 1.K172 Typing: Mistyped 1.R173 HD2 = 1.775(S), Expected = 3.12, Std = 0.2400, ChiSquare = 2.0926e-08 1.R173 HD3 = 1.550(S), Expected = 3.10, Std = 0.2600, ChiSquare = 2.4987e-09