Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G4 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S5 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> CA :: 58.181 CB :: 64.043 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> HA :: 4.497 HB2 :: 3.814 HB3 :: 3.814 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) 1.G7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.46 L 0.2 R 0.16 C 0.1 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> CA :: 44.515 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.220 HA2 :: 4.178 HA3 :: 4.034 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.092 Ave N Shift Values>> N :: 109.91(4.29) 1.P8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.78 C 0.2 C Shift Assignments>> C :: 176.847 CA :: 62.913 CB :: 32.127 CG :: 27.366 CD :: 49.817 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.315 HB2 :: 2.138 HB3 :: 1.913 HG2 :: 1.996 HG3 :: 1.996 HD2 :: 3.611 HD3 :: 3.584 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.L9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.59 C 0.3 R 0.08 G 0.01 C Shift Assignments>> C :: 173.384 CA :: 55.694 CB :: 41.973 CG :: 27.119 CD1 :: 25.177 CD2 :: 25.130 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.829 HA :: 3.849 HB2 :: 0.752 HB3 :: 0.472 HG :: 1.044 HD11 :: 0.647 HD12 :: 0.647 HD13 :: 0.647 HD21 :: 0.390 HD22 :: 0.390 HD23 :: 0.390 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 124.373 Ave N Shift Values>> N :: 121.98(4.07) 1.Q10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.6 M 0.34 Q 0.03 E 0.02 C Shift Assignments>> C :: 175.901 CA :: 53.046 CB :: 34.151 CG :: 34.135 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 6.767 HA :: 4.820 HB2 :: 1.709 HB3 :: 2.243 HG2 :: 2.301 HG3 :: 2.173 HE21 :: 7.545 HE22 :: 6.796 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 115.145 NE2 :: 113.104 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.F11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.67 C 0.3 G 0.01 HN Overlap>> 1.A42 1.A42 C Shift Assignments>> C :: 176.201 CA :: 59.510 CB :: 42.182 CD1 :: 131.288 CD2 :: 131.288 CE1 :: 129.308 CE2 :: 129.308 CZ :: 129.216 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 9.281 HA :: 5.112 HB2 :: 3.190 HB3 :: 2.795 HD1 :: 7.225 HD2 :: 7.225 HE1 :: 6.035 HE2 :: 6.035 HZ :: 6.966 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 120.042 Ave N Shift Values>> N :: 120.69(4.18) 1.H12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.43 H 0.37 W 0.18 C Shift Assignments>> C :: 175.064 CA :: 58.171 CB :: 31.639 CD2 :: 117.550 CE1 :: 136.874 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 9.352 HA :: 4.047 HB2 :: 3.482 HB3 :: 2.992 HD2 :: 7.517 HE1 :: 7.450 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 124.139 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.S13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.515 CA :: 61.345 CB :: 63.111 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.251 HA :: 4.346 HB2 :: 3.989 HB3 :: 3.896 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 121.127 Ave N Shift Values>> N :: 116.3(3.95) 1.V14 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> V 0.81 C 0.18 C Shift Assignments>> C :: 174.650 CA :: 64.032 CB :: 30.288 CG1 :: 21.717 CG2 :: 19.541 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 11.427(A) HA :: 3.884 HB :: 1.725 HG11 :: 0.897 HG12 :: 0.897 HG13 :: 0.897 HG21 :: 0.667 HG22 :: 0.667 HG23 :: 0.667 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 128.011 Ave N Shift Values>> N :: 121.02(4.96) 1.H15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.43 W 0.38 H 0.18 C Shift Assignments>> C :: 175.256 CA :: 53.352 CB :: 32.100 CD2 :: 125.365 CE1 :: 138.950 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 7.901 HA :: 4.954 HB2 :: 2.996 HB3 :: 4.196 HD2 :: 7.285 HE1 :: 8.514 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 120.545 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.G16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.8 C 0.08 L 0.07 R 0.01 C Shift Assignments>> C :: 176.058 CA :: 45.703 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 9.841 HA2 :: 3.995 HA3 :: 3.673 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 105.449 Ave N Shift Values>> N :: 109.91(4.29) 1.D17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.18 K 0.17 Y 0.15 L 0.15 C 0.13 D 0.11 R 0.04 I 0.02 N 0.01 C Shift Assignments>> C :: 176.775 CA :: 57.030 CB :: 41.072 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.440 HA :: 4.575 HB2 :: 2.815 HB3 :: 2.270 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 121.607 Ave N Shift Values>> N :: 120.73(4.2) 1.N18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.48 C 0.25 Y 0.06 D 0.05 E 0.05 M 0.03 F 0.03 C Shift Assignments>> C :: 172.685 CA :: 52.715 CB :: 37.198 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.160 HA :: 4.693 HB2 :: 2.864 HB3 :: 2.447 HD21 :: 6.828 HD22 :: 6.776 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 114.907 ND2 :: 110.413 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.I19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.69 A 0.24 I 0.05 C Shift Assignments>> C :: 175.811 CA :: 56.144 CB :: 37.399 CG1 :: 25.512 CG2 :: 17.834 CD1 :: 9.124 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 7.080 HA :: 5.143 HB :: 1.821 HG12 :: 0.933 HG13 :: 1.473 HG21 :: 0.103 HG22 :: 0.103 HG23 :: 0.103 HD11 :: 0.371 HD12 :: 0.371 HD13 :: 0.371 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 118.019 Ave N Shift Values>> N :: 121.6(4.72) 1.R20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 R 0.26 K 0.25 G 0.06 HN Overlap>> 1.C52 1.C52 C Shift Assignments>> C :: 175.599 CA :: 54.614 CB :: 33.567 CG :: 27.393 CD :: 43.033 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.864 HA :: 4.526 HB2 :: 1.666 HB3 :: 1.536 HG2 :: 1.438 HG3 :: 1.438 HD2 :: 3.024 HD3 :: 2.764 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 124.507 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.I21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.48 I 0.47 A 0.03 C Shift Assignments>> C :: 176.017 CA :: 58.071 CB :: 38.002 CG1 :: 27.589 CG2 :: 18.323 CD1 :: 12.571 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.905 HA :: 4.961 HB :: 1.894 HG12 :: 1.293 HG13 :: 0.963 HG21 :: 1.191 HG22 :: 1.191 HG23 :: 1.191 HD11 :: 0.465 HD12 :: 0.465 HD13 :: 0.465 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 127.152 Ave N Shift Values>> N :: 121.6(4.72) 1.S22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 58.000 CB :: 63.843 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.012 HA :: 4.426 HB2 :: 3.881 HB3 :: 3.881 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 105.424 Ave N Shift Values>> N :: 116.3(3.95) 1.R23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> K 0.38 R 0.36 G 0.24 C Shift Assignments>> C :: 175.021 CB :: 33.572 CG :: 28.716 CD :: 43.554 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> HB2 :: 1.533 HB3 :: 1.501 HG2 :: 1.932 HG3 :: 1.932 HD2 :: 3.185 HD3 :: 3.185 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) 1.D24 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> G 0.81 C 0.1 L 0.06 R 0.01 C Shift Assignments>> CA :: 46.009 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> HA2 :: 4.417 HA3 :: 3.881 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) 1.T26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.94 C 0.05 C Shift Assignments>> C :: 172.655 CA :: 63.831 CB :: 71.739 CG2 :: 21.745 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.977 HA :: 4.895 HB :: 4.638 HG21 :: 1.394 HG22 :: 1.394 HG23 :: 1.394 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 108.346 Ave N Shift Values>> N :: 115.7(5.05) 1.L27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.47 L 0.27 C 0.21 R 0.02 A 0.01 HN Overlap>> 1.E49 1.E49 C Shift Assignments>> C :: 173.827 CA :: 54.242 CB :: 45.420 CG :: 27.897 CD1 :: 25.329 CD2 :: 23.953 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.054 HA :: 5.452 HB2 :: 1.704 HB3 :: 1.704 HG :: 1.355 HD11 :: 0.698 HD12 :: 0.698 HD13 :: 0.698 HD21 :: 0.698 HD22 :: 0.698 HD23 :: 0.698 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 123.950 Ave N Shift Values>> N :: 121.98(4.07) 1.A28 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.81 M 0.08 C 0.06 L 0.03 C Shift Assignments>> C :: 174.881 CA :: 50.067 CB :: 20.822 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.537 HA :: 4.725 HB1 :: -0.118(S) HB2 :: -0.118(S) HB3 :: -0.118(S) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 127.747 Ave N Shift Values>> N :: 123.23(3.7) 1.R29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.51 K 0.2 G 0.16 R 0.11 C Shift Assignments>> C :: 175.114 CA :: 53.668 CB :: 34.587 CG :: 28.230 CD :: 43.400 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.310 HA :: 5.263 HB2 :: 1.651 HB3 :: 1.471 HG2 :: 1.471 HG3 :: 1.342 HD2 :: 3.057 HD3 :: 3.057 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 118.549 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.R30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.46 C 0.31 K 0.17 G 0.02 L 0.01 HN Overlap>> 1.C52 1.C52 C Shift Assignments>> C :: 176.444 CA :: 54.260 CB :: 30.488 CG :: 27.140 CD :: 42.501 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 9.017 HA :: 5.134 HB2 :: 1.020 HB3 :: 1.239 HG2 :: 1.763 HG3 :: 1.798 HD2 :: 3.088 HD3 :: 2.840 HE :: 5.964 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 124.482 NE :: 83.600 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.F31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.43 C 0.32 Y 0.23 C Shift Assignments>> C :: 173.716 CA :: 57.674 CB :: 40.327 CD1 :: 132.214 CD2 :: 132.214 CE1 :: 131.743 CE2 :: 131.743 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.132 HA :: 4.567 HB2 :: 3.340 HB3 :: 2.584 HD1 :: 7.009 HD2 :: 7.009 HE1 :: 7.238 HE2 :: 7.238 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 125.153 Ave N Shift Values>> N :: 120.69(4.18) 1.E32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.43 M 0.34 E 0.16 Q 0.04 C Shift Assignments>> C :: 173.727 CA :: 55.111 CB :: 32.897 CG :: 35.419 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 6.799 HA :: 4.411 HB2 :: 1.653 HB3 :: 1.534 HG2 :: 1.898 HG3 :: 1.854 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 118.712 Ave N Shift Values>> N :: 120.68(3.68) 1.S33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.642 CA :: 56.756 CB :: 63.029 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.468 HA :: 3.866 HB2 :: 3.756 HB3 :: 3.696 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 110.682 Ave N Shift Values>> N :: 116.3(3.95) 1.F34 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.44 F 0.32 Y 0.23 C Shift Assignments>> C :: 172.322 CA :: 54.997 CB :: 39.281 CD1 :: 132.870 CD2 :: 132.870 CE1 :: 131.860 CE2 :: 131.860 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.310 HA :: 3.905 HB2 :: 2.417 HB3 :: 1.405(S) HD1 :: 6.893 HD2 :: 6.893 HE1 :: 7.437 HE2 :: 7.437 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 115.637 Ave N Shift Values>> N :: 120.69(4.18) 1.C35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.15 R 0.14 W 0.12 C 0.12 E 0.12 Q 0.12 M 0.08 K 0.07 C Shift Assignments>> C :: 173.284 CA :: 55.838 CB :: 30.406 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 6.517 HA :: 5.256 HB2 :: 2.624 HB3 :: 2.545 Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 113.810 Ave N Shift Values>> N :: 119.95(4.79) 1.R36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 G 0.17 R 0.15 L 0.09 K 0.07 C Shift Assignments>> C :: 176.310 CA :: 57.330 CB :: 27.201 CG :: 29.139 CD :: 43.767 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.504 HA :: 4.027 HB2 :: 1.339 HB3 :: 1.680 HG2 :: 1.390 HG3 :: 1.316 HD2 :: 3.035 HD3 :: 3.035 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 114.740 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.A37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.81 M 0.08 C 0.05 L 0.03 C Shift Assignments>> C :: 176.336 CA :: 50.178 CB :: 20.825 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 9.418 HA :: 4.393 HB1 :: 1.003 HB2 :: 1.003 HB3 :: 1.003 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 121.944 Ave N Shift Values>> N :: 123.23(3.7) 1.I38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.83 C 0.16 C Shift Assignments>> C :: 174.806 CA :: 64.175 CB :: 38.569 CG1 :: 29.582 CG2 :: 19.675 CD1 :: 14.078 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 6.691 HA :: 3.539 HB :: 1.405 HG12 :: 1.516 HG13 :: 0.358 HG21 :: 0.262 HG22 :: 0.262 HG23 :: 0.262 HD11 :: 0.439 HD12 :: 0.439 HD13 :: 0.439 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 117.253 Ave N Shift Values>> N :: 121.6(4.72) 1.T39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.78 T 0.21 C Shift Assignments>> C :: 172.025 CA :: 60.160 CB :: 74.009 CG2 :: 22.682 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.978 HA :: 4.880 HB :: 4.513 HG21 :: 0.865 HG22 :: 0.865 HG23 :: 0.865 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 117.731 Ave N Shift Values>> N :: 115.7(5.05) 1.F40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.77 C 0.19 F 0.02 C Shift Assignments>> C :: 176.863 CA :: 55.728 CB :: 45.224 CD1 :: 133.407 CD2 :: 133.407 CE1 :: 128.758 CE2 :: 128.758 CZ :: 129.391 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 9.673 HA :: 6.099 HB2 :: 3.508 HB3 :: 2.573 HD1 :: 7.517 HD2 :: 7.517 HE1 :: 6.780 HE2 :: 6.780 HZ :: 6.927 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 116.606 Ave N Shift Values>> N :: 120.69(4.18) 1.S41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.96 T 0.03 C Shift Assignments>> C :: 176.187 CA :: 58.898 CB :: 65.412 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.111 HA :: 4.818 HB2 :: 4.443 HB3 :: 4.180 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 113.937 Ave N Shift Values>> N :: 116.3(3.95) 1.A42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.57 M 0.37 C 0.03 I 0.01 HN Overlap>> 1.F11 1.F11 C Shift Assignments>> C :: 177.188 CA :: 54.079 CB :: 18.951 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 9.265 HA :: 4.274 HB1 :: 1.266 HB2 :: 1.266 HB3 :: 1.266 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 120.153 Ave N Shift Values>> N :: 123.23(3.7) 1.R43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 G 0.31 R 0.18 K 0.1 L 0.04 A 0.01 C Shift Assignments>> C :: 171.794 CA :: 51.563 CB :: 30.129 CG :: 24.675 CD :: 43.400 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.576 HA :: 5.235 HB2 :: 1.910 HB3 :: 1.692 HG2 :: 1.582 HG3 :: 1.457 HD2 :: 3.014 HD3 :: 3.014 HE :: 6.940 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 111.127 NE :: 84.799 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.P44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.69 C 0.3 C Shift Assignments>> C :: 177.137 CA :: 61.858 CB :: 31.941 CG :: 27.119 CD :: 50.757 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.040 HB2 :: 1.396 HB3 :: 1.174 HG2 :: 1.737 HG3 :: 1.295 HD2 :: 3.813 HD3 :: 3.561 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.V45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.59 V 0.38 C Shift Assignments>> C :: 174.814 CA :: 59.249 CB :: 33.871 CG1 :: 22.092 CG2 :: 19.332 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.996 HA :: 4.262 HB :: 2.000 HG11 :: 1.000 HG12 :: 1.000 HG13 :: 1.000 HG21 :: 0.912 HG22 :: 0.912 HG23 :: 0.912 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 118.339 Ave N Shift Values>> N :: 121.02(4.96) 1.R46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.38 C 0.33 K 0.2 G 0.07 C Shift Assignments>> C :: 177.869 CA :: 54.997 CB :: 31.970 CG :: 27.892 CD :: 43.312 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.473 HA :: 4.377 HB2 :: 1.834 HB3 :: 1.650 HG2 :: 1.569 HG3 :: 1.669 HD2 :: 3.175 HD3 :: 3.092 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 120.689 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.I47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.77 C 0.22 C Shift Assignments>> C :: 178.189 CA :: 62.849 CB :: 36.507 CG1 :: 28.124 CG2 :: 17.394 CD1 :: 12.282 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.366 HA :: 3.627 HB :: 1.655 HG12 :: 1.434 HG13 :: 1.153 HG21 :: 0.772 HG22 :: 0.772 HG23 :: 0.772 HD11 :: 0.709 HD12 :: 0.709 HD13 :: 0.709 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 122.410 Ave N Shift Values>> N :: 121.6(4.72) 1.N48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 Y 0.19 E 0.17 F 0.12 N 0.09 I 0.04 M 0.03 D 0.03 K 0.01 L 0.01 HN Overlap>> 1.S59 1.S59 C Shift Assignments>> C :: 173.813 CA :: 56.228 CB :: 37.504 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 9.497 HA :: 4.157 HB2 :: 3.209 HB3 :: 2.666 HD21 :: 7.479 HD22 :: 6.880 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 120.212 ND2 :: 113.220 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.E49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.29 C 0.29 M 0.14 Q 0.12 K 0.1 I 0.02 HN Overlap>> 1.L27 1.L27 C Shift Assignments>> C :: 175.171 CA :: 56.523 CB :: 30.481 CG :: 35.441 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.983 HA :: 4.071 HB2 :: 2.286 HB3 :: 1.701 HG2 :: 2.181 HG3 :: 1.930 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 123.940 Ave N Shift Values>> N :: 120.68(3.68) 1.R50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 R 0.34 K 0.18 G 0.05 C Shift Assignments>> C :: 174.914 CA :: 57.483 CB :: 30.251 CG :: 29.722 CD :: 43.095 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.679 HA :: 4.326 HB2 :: 1.769 HB3 :: 1.589 HG2 :: 1.493 HG3 :: 1.420 HD2 :: 2.658 HD3 :: 2.626 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 127.300 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.I51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.6 C 0.38 C Shift Assignments>> C :: 175.300 CA :: 60.752 CB :: 37.340 CG1 :: 27.072 CG2 :: 19.106 CD1 :: 14.138 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 9.420 HA :: 3.912 HB :: 1.181 HG12 :: 1.176 HG13 :: 1.103 HG21 :: 0.733 HG22 :: 0.733 HG23 :: 0.733 HD11 :: 0.669 HD12 :: 0.669 HD13 :: 0.669 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 130.879 Ave N Shift Values>> N :: 121.6(4.72) 1.C52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.15 E 0.14 R 0.13 C 0.12 H 0.12 Q 0.11 K 0.07 M 0.05 I 0.03 V 0.02 HN Overlap>> 1.R30 1.R20 1.R30 1.R20 C Shift Assignments>> C :: 173.603 CA :: 57.827 CB :: 30.238 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 8.961 HA :: 5.422 HB2 :: 2.796 HB3 :: 2.413 Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 124.457 Ave N Shift Values>> N :: 119.95(4.79) 1.V53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.66 V 0.31 I 0.01 C Shift Assignments>> C :: 173.169 CA :: 59.318 CB :: 35.533 CG1 :: 22.631 CG2 :: 20.874 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.585 HA :: 5.041 HB :: 1.870 HG11 :: 0.648 HG12 :: 0.648 HG13 :: 0.648 HG21 :: 0.852 HG22 :: 0.852 HG23 :: 0.852 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 122.729 Ave N Shift Values>> N :: 121.02(4.96) 1.K54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 R 0.3 K 0.24 G 0.01 M 0.01 C Shift Assignments>> C :: 177.220 CA :: 53.934 CB :: 36.298 CG :: 25.441 CD :: 29.649 CE :: 42.094 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 9.389 HA :: 4.971 HB2 :: 1.864 HB3 :: 1.590 HG2 :: 1.233 HG3 :: 1.042 HD2 :: 1.742 HD3 :: 1.645 HE2 :: 2.912 HE3 :: 2.844 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 124.886 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.F55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.59 F 0.39 C Shift Assignments>> C :: 174.013 CA :: 55.953 CB :: 35.903 CD1 :: 131.313 CD2 :: 131.313 CE1 :: 130.330 CE2 :: 130.330 CZ :: 129.061 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.410 HA :: 4.854 HB2 :: 3.508 HB3 :: 2.982 HD1 :: 7.441 HD2 :: 7.441 HE1 :: 7.202 HE2 :: 7.202 HZ :: 6.963 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 126.379 Ave N Shift Values>> N :: 120.69(4.18) 1.A56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.56 M 0.31 C 0.05 L 0.04 V 0.01 C Shift Assignments>> C :: 177.241 CA :: 53.834 CB :: 20.128 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.988 HA :: 4.292 HB1 :: 1.263 HB2 :: 1.263 HB3 :: 1.263 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 130.644 Ave N Shift Values>> N :: 123.23(3.7) 1.E57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.56 M 0.24 E 0.17 Q 0.01 C Shift Assignments>> C :: 174.170 CA :: 55.723 CB :: 33.413 CG :: 36.158 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.861 HA :: 4.599 HB2 :: 1.847 HB3 :: 1.693 HG2 :: 2.110 HG3 :: 2.110 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 115.293 Ave N Shift Values>> N :: 120.68(3.68) 1.I58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.53 I 0.37 A 0.08 HN Overlap>> 1.N73 1.N73 C Shift Assignments>> C :: 175.500 CA :: 57.602 CB :: 41.330 CG1 :: 26.516 CG2 :: 18.373 CD1 :: 11.846 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.672 HA :: 5.162 HB :: 1.917 HG12 :: 1.344 HG13 :: 1.218 HG21 :: 0.882 HG22 :: 0.882 HG23 :: 0.882 HD11 :: 0.759 HD12 :: 0.759 HD13 :: 0.759 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 123.791 Ave N Shift Values>> N :: 121.6(4.72) 1.S59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 T 0.01 HN Overlap>> 1.N48 1.N48 C Shift Assignments>> C :: 173.559 CA :: 56.374 CB :: 65.452 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 9.538 HA :: 4.689 HB2 :: 4.078 HB3 :: 3.883 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 120.189 Ave N Shift Values>> N :: 116.3(3.95) 1.N60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.45 D 0.18 C 0.16 Y 0.07 F 0.06 L 0.03 E 0.01 C Shift Assignments>> C :: 175.801 CA :: 53.046 CB :: 38.788 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.351 HA :: 4.814 HB2 :: 2.792 HB3 :: 2.792 HD21 :: 7.503 HD22 :: 6.794 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 119.877 ND2 :: 111.468 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.N61 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> N 0.33 C 0.2 D 0.13 Y 0.12 F 0.09 E 0.04 L 0.02 M 0.01 I 0.01 C Shift Assignments>> C :: 173.913 CA :: 54.270 CB :: 38.307 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.184 HA :: 4.249 HB2 :: 1.743 HB3 :: 1.622(S) HD21 :: 6.527 HD22 :: 6.462 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 116.635 ND2 :: 111.699 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.W62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.54 C 0.41 H 0.03 C Shift Assignments>> C :: 174.113 CA :: 55.110 CB :: 30.884 CD1 :: 127.180 CE3 :: 121.376 CZ2 :: 114.715 CZ3 :: 121.981 CH2 :: 124.281 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 8.044 HA :: 4.820 HB2 :: 3.211 HB3 :: 2.448 HD1 :: 6.854 HE1 :: 10.081 HE3 :: 7.465 HZ2 :: 7.339 HZ3 :: 6.985 HH2 :: 7.190 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 119.607 NE1 :: 128.107 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.N63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.31 L 0.2 N 0.11 C 0.1 K 0.1 F 0.05 Y 0.04 R 0.04 C Shift Assignments>> C :: 174.513 CA :: 53.145 CB :: 41.510 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.068 HA :: 4.938 HB2 :: 2.685 HB3 :: 2.641 HD21 :: 7.653 HD22 :: 6.851 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 117.311 ND2 :: 113.722 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.G64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.41 L 0.22 R 0.19 C 0.1 F 0.02 D 0.02 Y 0.01 C Shift Assignments>> C :: 172.543 CA :: 44.403 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.587 HA2 :: 4.552 HA3 :: 3.851 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.458 Ave N Shift Values>> N :: 109.91(4.29) 1.G65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.39 L 0.22 R 0.19 C 0.1 F 0.02 D 0.02 Y 0.01 C Shift Assignments>> C :: 174.063 CA :: 44.365 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.320 HA2 :: 4.986 HA3 :: 3.975 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 107.153 Ave N Shift Values>> N :: 109.91(4.29) 1.I66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.8 C 0.19 C Shift Assignments>> C :: 174.249 CA :: 62.786 CB :: 39.604 CG1 :: 27.050 CG2 :: 18.896 CD1 :: 14.758 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 6.756 HA :: 4.589 HB :: 2.040 HG12 :: 1.553 HG13 :: 1.120 HG21 :: 1.131 HG22 :: 1.131 HG23 :: 1.131 HD11 :: 0.752 HD12 :: 0.752 HD13 :: 0.752 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 114.506 Ave N Shift Values>> N :: 121.6(4.72) 1.R67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.65 G 0.26 K 0.04 R 0.03 C Shift Assignments>> C :: 175.230 CA :: 55.346 CB :: 33.493 CG :: 31.446 CD :: 43.950 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.921 HA :: 5.344 HB2 :: 1.504 HB3 :: 1.743 HG2 :: 1.156 HG3 :: 1.355 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 120.338 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.F68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.64 C 0.31 G 0.04 C Shift Assignments>> C :: 172.492 CA :: 55.091 CB :: 42.572 CD1 :: 131.270 CD2 :: 131.270 CE1 :: 129.733 CE2 :: 129.733 CZ :: 128.681 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.568 HA :: 5.597 HB2 :: 2.721 HB3 :: 2.548 HD1 :: 5.907 HD2 :: 5.907 HE1 :: 6.401 HE2 :: 6.401 HZ :: 6.203 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 118.171 Ave N Shift Values>> N :: 120.69(4.18) 1.G69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.8 C 0.09 L 0.07 R 0.01 C Shift Assignments>> CA :: 45.735 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.129 HA2 :: 5.259 HA3 :: 3.237 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 103.237 Ave N Shift Values>> N :: 109.91(4.29) 1.F70 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.52 C 0.41 F 0.05 C Shift Assignments>> C :: 173.727 CA :: 57.755 CB :: 47.155(S) CD1 :: 131.032 CD2 :: 131.032 CE1 :: 131.248 CE2 :: 131.248 CZ :: 131.378 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 9.817 HA :: 6.107 HB2 :: 3.485 HB3 :: 2.799 HD1 :: 7.019 HD2 :: 7.019 HE1 :: 7.332 HE2 :: 7.332 HZ :: 7.288 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 123.162 Ave N Shift Values>> N :: 120.69(4.18) 1.T71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.38 T 0.32 A 0.29 C Shift Assignments>> C :: 171.645 CA :: 58.151 CB :: 71.323 CG2 :: 18.528 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 9.994 HA :: 5.753 HB :: 4.139 HG21 :: 1.448 HG22 :: 1.448 HG23 :: 1.448 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 113.083 Ave N Shift Values>> N :: 115.7(5.05) 1.S72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.056 CA :: 57.542 CB :: 64.311 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.594 HA :: 5.662 HB2 :: 4.624 HB3 :: 3.901 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 120.755 Ave N Shift Values>> N :: 116.3(3.95) 1.N73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.35 D 0.31 C 0.12 L 0.08 F 0.04 Y 0.04 K 0.01 HN Overlap>> 1.I58 1.I58 C Shift Assignments>> C :: 170.395 CA :: 51.937 CB :: 40.183 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.616 HA :: 4.502 HB2 :: 2.040 HB3 :: 1.845 HD21 :: 6.625 HD22 :: 6.625 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 123.828 ND2 :: 116.003 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.D74 Overall: Anomalous Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> D 0.31 C 0.18 L 0.16 N 0.15 G 0.05 K 0.04 R 0.03 F 0.02 Y 0.01 C Shift Assignments>> C :: 176.539 CA :: 50.242 CB :: 41.958 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 7.829 HA :: 1.685(A) HB2 :: 2.305 HB3 :: 2.197 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 121.627 Ave N Shift Values>> N :: 120.73(4.2) SRO Rule Breaks>> (HA > HB2 : 0.9995) (HA > HB3 : 0.9997) 1.P75 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Indeterminable PRTL>> P 0.85 C 0.13 C Shift Assignments>> C :: 177.417 CA :: 64.408 CB :: 30.721 CG :: 27.970 CD :: 49.297 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 2.856(S) HB2 :: 0.635(S) HB3 :: -0.457(A) HG2 :: 1.265 HG3 :: 0.566(S) HD2 :: 2.020(S) HD3 :: 1.952(S) Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.V76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.94 C 0.05 C Shift Assignments>> C :: 178.838 CA :: 65.708 CB :: 31.602 CG1 :: 21.522 CG2 :: 21.127 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.572 HA :: 3.700 HB :: 1.961 HG11 :: 0.989 HG12 :: 0.989 HG13 :: 0.989 HG21 :: 0.926 HG22 :: 0.926 HG23 :: 0.926 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 111.736 Ave N Shift Values>> N :: 121.02(4.96) 1.T77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.94 C 0.05 C Shift Assignments>> C :: 175.229 CA :: 63.029 CB :: 69.865 CG2 :: 22.022 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.930 HA :: 4.133 HB :: 4.227 HG21 :: 1.193 HG22 :: 1.193 HG23 :: 1.193 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 109.770 Ave N Shift Values>> N :: 115.7(5.05) 1.L78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.55 C 0.25 A 0.08 R 0.07 G 0.01 C Shift Assignments>> C :: 177.047 CA :: 53.428 CB :: 41.867 CG :: 26.190 CD1 :: 26.986 CD2 :: 22.880 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.424 HA :: 4.183 HB2 :: 1.417 HB3 :: 1.285 HG :: 1.220 HD11 :: 0.457 HD12 :: 0.457 HD13 :: 0.457 HD21 :: 0.615 HD22 :: 0.615 HD23 :: 0.615 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 119.890 Ave N Shift Values>> N :: 121.98(4.07) 1.E79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.31 C 0.3 K 0.12 Q 0.11 I 0.07 M 0.06 C Shift Assignments>> C :: 177.059 CA :: 58.362 CB :: 29.749 CG :: 35.501 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 6.720 HA :: 3.788 HB2 :: 1.904 HB3 :: 1.904 HG2 :: 2.186 HG3 :: 2.186 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 120.869 Ave N Shift Values>> N :: 120.68(3.68) 1.G80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.8 C 0.09 L 0.07 R 0.01 C Shift Assignments>> C :: 175.173 CA :: 45.742 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.850 HA2 :: 4.206 HA3 :: 3.842 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 115.309 Ave N Shift Values>> N :: 109.91(4.29) 1.T81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.89 C 0.1 C Shift Assignments>> C :: 175.220 CA :: 60.347 CB :: 70.170 CG2 :: 20.941 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.911 HA :: 4.624 HB :: 4.335 HG21 :: 0.999 HG22 :: 0.999 HG23 :: 0.999 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 109.437 Ave N Shift Values>> N :: 115.7(5.05) 1.L82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.72 C 0.25 A 0.01 C Shift Assignments>> C :: 175.380 CA :: 53.353 CB :: 40.850 CG :: 26.322 CD1 :: 25.171 CD2 :: 24.285 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.164 HA :: 4.204 HB2 :: 1.862 HB3 :: 1.255 HG :: 1.766 HD11 :: 0.672 HD12 :: 0.672 HD13 :: 0.672 HD21 :: 0.837 HD22 :: 0.837 HD23 :: 0.837 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 123.986 Ave N Shift Values>> N :: 121.98(4.07) 1.P83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.5 C 0.48 C Shift Assignments>> CA :: 61.303 CB :: 32.695 CG :: 26.338 CD :: 49.301 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.715 HB2 :: 2.337 HB3 :: 2.111 HG2 :: 1.568 HG3 :: 1.568 HD2 :: 3.637 HD3 :: 3.062 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.K84 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.41 C 0.4 R 0.16 M 0.01 C Shift Assignments>> C :: 176.230 CA :: 59.764 CB :: 33.430 CG :: 25.508 CD :: 29.457 CE :: 41.664 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.235 HA :: 3.455 HB2 :: 1.099 HB3 :: 0.836(S) HG2 :: 1.222 HG3 :: 0.898 HD2 :: 1.520 HD3 :: 1.520 HE2 :: 2.848 HE3 :: 2.848 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 113.768 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.Y85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.51 Y 0.41 G 0.06 C Shift Assignments>> C :: 175.021 CA :: 54.347 CB :: 42.435 CD1 :: 134.204 CD2 :: 134.204 CE1 :: 118.380 CE2 :: 118.380 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 6.855 HA :: 4.875 HB2 :: 3.167 HB3 :: 2.454 HD1 :: 7.203 HD2 :: 7.203 HE1 :: 6.990 HE2 :: 6.990 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 111.402 Ave N Shift Values>> N :: 120.79(4.69) 1.A86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.55 M 0.38 C 0.03 I 0.01 C Shift Assignments>> C :: 177.774 CA :: 54.193 CB :: 18.958 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 9.555 HA :: 3.856 HB1 :: 1.101 HB2 :: 1.101 HB3 :: 1.101 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.236 Ave N Shift Values>> N :: 123.23(3.7) 1.C87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.17 Q 0.15 K 0.14 C 0.13 W 0.1 R 0.1 E 0.09 M 0.04 L 0.03 C Shift Assignments>> C :: 172.945 CA :: 54.496 CB :: 29.174 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 8.571 HA :: 4.899 HB2 :: 2.948 HB3 :: 2.306 Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 115.822 Ave N Shift Values>> N :: 119.95(4.79) 1.P88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.64 P 0.32 A 0.02 G 0.01 C Shift Assignments>> C :: 177.263 CA :: 64.634 CB :: 34.104 CG :: 24.242 CD :: 49.620 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.748 HB2 :: 2.087 HB3 :: 2.037 HG2 :: 1.913 HG3 :: 1.673 HD2 :: 3.477 HD3 :: 3.335 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.D89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.28 Y 0.24 C 0.17 I 0.15 K 0.05 L 0.04 D 0.02 C Shift Assignments>> C :: 178.632 CA :: 59.242 CB :: 40.320 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 7.657 HA :: 3.984 HB2 :: 3.212 HB3 :: 2.340 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 120.320 Ave N Shift Values>> N :: 120.73(4.2) 1.L90 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.49 C 0.47 A 0.02 C Shift Assignments>> C :: 177.674 CA :: 56.523 CB :: 40.548 CG :: 25.319 CD1 :: 25.500 CD2 :: 22.671 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.732 HA :: 3.818 HB2 :: 1.672 HB3 :: 0.377(S) HG :: 1.062 HD11 :: 0.487 HD12 :: 0.487 HD13 :: 0.487 HD21 :: 0.157 HD22 :: 0.157 HD23 :: 0.157 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 113.888 Ave N Shift Values>> N :: 121.98(4.07) 1.T91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.78 C 0.21 C Shift Assignments>> C :: 175.272 CA :: 64.673 CB :: 67.790 CG2 :: 24.095 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.435 HA :: 3.901 HB :: 4.576 HG21 :: 1.152 HG22 :: 1.152 HG23 :: 1.152 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 107.476 Ave N Shift Values>> N :: 115.7(5.05) 1.N92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.44 C 0.17 D 0.16 Y 0.08 F 0.06 L 0.03 E 0.01 C Shift Assignments>> C :: 175.602 CA :: 53.246 CB :: 38.565 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 7.679 HA :: 4.709 HB2 :: 2.941 HB3 :: 2.729 HD21 :: 7.510 HD22 :: 6.949 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 118.299 ND2 :: 110.841 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.R93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.35 C 0.31 R 0.29 L 0.02 K 0.01 C Shift Assignments>> C :: 173.743 CA :: 53.756 CB :: 30.142 CG :: 26.318 CD :: 44.455 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.163 HA :: 4.707 HB2 :: 2.118 HB3 :: 1.980 HG2 :: 1.715 HG3 :: 1.676 HD2 :: 3.134 HD3 :: 2.868 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 122.398 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.P94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.82 C 0.16 C Shift Assignments>> C :: 178.246 CA :: 63.429 CB :: 31.920 CG :: 27.794 CD :: 50.316 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.242 HB2 :: 2.288 HB3 :: 1.819 HG2 :: 2.098 HG3 :: 1.993 HD2 :: 3.877 HD3 :: 3.626 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.G95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.81 C 0.11 L 0.05 C Shift Assignments>> C :: 173.484 CA :: 46.273 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.390 HA2 :: 3.517 HA3 :: 3.124 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.941 Ave N Shift Values>> N :: 109.91(4.29) 1.F96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.4 F 0.37 G 0.22 C Shift Assignments>> C :: 173.498 CA :: 57.868 CB :: 43.541 CD1 :: 133.178 CD2 :: 133.178 CE1 :: 131.220 CE2 :: 131.220 CZ :: 128.962 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 6.804 HA :: 4.741 HB2 :: 2.864 HB3 :: 2.162 HD1 :: 6.991 HD2 :: 6.991 HE1 :: 7.149 HE2 :: 7.149 HZ :: 7.174 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 116.249 Ave N Shift Values>> N :: 120.69(4.18) 1.W97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 W 0.47 H 0.02 C Shift Assignments>> C :: 173.556 CA :: 58.008 CB :: 31.932 CD1 :: 128.186 CE3 :: 121.315 CZ2 :: 114.573 CZ3 :: 121.058 CH2 :: 123.315 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 8.919 HA :: 4.995 HB2 :: 3.202 HB3 :: 3.161 HD1 :: 7.400 HE1 :: 10.095 HE3 :: 7.609 HZ2 :: 7.688 HZ3 :: 6.863 HH2 :: 7.317 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 121.648 NE1 :: 130.961 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.A98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.79 M 0.15 C 0.03 L 0.01 C Shift Assignments>> C :: 173.985 CA :: 51.975 CB :: 19.806 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.354 HA :: 4.764 HB1 :: 0.744 HB2 :: 0.744 HB3 :: 0.744 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.338 Ave N Shift Values>> N :: 123.23(3.7) 1.K99 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 R 0.34 K 0.12 G 0.02 C Shift Assignments>> C :: 173.507 CA :: 54.566 CB :: 37.645 CG :: 25.263 CD :: 29.115 CE :: 42.300 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 7.906 HA :: 4.346 HB2 :: 1.317 HB3 :: 1.317 HG2 :: 1.468 HG3 :: 1.468 HD2 :: 1.724 HD3 :: 1.724 HE2 :: 3.045 HE3 :: 3.045 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 118.811 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.A100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.79 M 0.17 C 0.02 C Shift Assignments>> C :: 176.438 CA :: 52.052 CB :: 19.023 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.085 HA :: 4.652 HB1 :: 1.184 HB2 :: 1.184 HB3 :: 1.184 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.174 Ave N Shift Values>> N :: 123.23(3.7) 1.L101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.42 C 0.25 R 0.16 L 0.14 C Shift Assignments>> C :: 176.203 CA :: 53.123 CB :: 44.437 CG :: 26.263 CD1 :: 28.450 CD2 :: 24.575 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.318 HA :: 4.359 HB2 :: 1.813 HB3 :: 1.371 HG :: 2.320 HD11 :: 1.129 HD12 :: 1.129 HD13 :: 1.129 HD21 :: 1.112 HD22 :: 1.112 HD23 :: 1.112 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 124.079 Ave N Shift Values>> N :: 121.98(4.07) 1.H102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.38 H 0.31 W 0.3 C Shift Assignments>> C :: 177.309 CA :: 59.624 CB :: 31.034 CD2 :: 118.225 CE1 :: 138.591 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 8.594 HA :: 4.104 HB2 :: 3.214 HB3 :: 2.935 HD2 :: 7.050 HE1 :: 7.722 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 127.000 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.E103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.34 C 0.32 E 0.27 K 0.03 M 0.01 C Shift Assignments>> C :: 179.251 CA :: 60.466 CB :: 29.526 CG :: 36.733 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.822 HA :: 3.928 HB2 :: 1.965 HB3 :: 1.965 HG2 :: 2.248 HG3 :: 2.248 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 127.527 Ave N Shift Values>> N :: 120.68(3.68) 1.Q104 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.3 K 0.24 R 0.23 Q 0.16 M 0.02 E 0.01 C Shift Assignments>> C :: 176.730 CA :: 57.877 CB :: 27.442 CG :: 32.472 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 10.960(S) HA :: 4.151 HB2 :: 1.913 HB3 :: 1.802 HG2 :: 1.620 HG3 :: 1.154(S) HE21 :: 6.569 HE22 :: 6.032 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 123.040 NE2 :: 109.919 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.Y105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.56 C 0.43 C Shift Assignments>> C :: 176.630 CA :: 56.519 CB :: 38.660 CD1 :: 132.618 CD2 :: 132.618 CE1 :: 118.366 CE2 :: 118.366 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 7.642 HA :: 4.828 HB2 :: 3.617 HB3 :: 2.944 HD1 :: 7.332 HD2 :: 7.332 HE1 :: 7.001 HE2 :: 7.001 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 116.146 Ave N Shift Values>> N :: 120.79(4.69) 1.C106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.2 K 0.18 C 0.15 L 0.13 I 0.11 Q 0.07 W 0.05 H 0.04 E 0.02 C Shift Assignments>> C :: 172.454 CA :: 58.204 CB :: 26.019 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 7.738 HA :: 3.828 HB2 :: 3.154 HB3 :: 2.638 Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 121.508 Ave N Shift Values>> N :: 119.95(4.79) 1.E107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.51 M 0.28 E 0.17 Q 0.01 C Shift Assignments>> C :: 175.237 CA :: 54.308 CB :: 32.878 CG :: 36.241 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 6.863 HA :: 4.496 HB2 :: 1.975 HB3 :: 1.701 HG2 :: 2.222 HG3 :: 2.106 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 119.290 Ave N Shift Values>> N :: 120.68(3.68) 1.K108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.38 C 0.37 R 0.19 M 0.02 G 0.01 C Shift Assignments>> C :: 176.521 CA :: 58.553 CB :: 32.625 CG :: 24.887 CD :: 29.416 CE :: 42.329 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.790 HA :: 3.816 HB2 :: 1.750 HB3 :: 1.675 HG2 :: 1.442 HG3 :: 1.291 HD2 :: 1.796 HD3 :: 1.618 HE2 :: 3.102 HE3 :: 3.102 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 123.791 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.D109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.27 C 0.22 F 0.22 I 0.1 E 0.06 D 0.04 N 0.02 L 0.02 C Shift Assignments>> C :: 175.701 CA :: 57.711 CB :: 38.639 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 9.317 HA :: 4.090 HB2 :: 3.273 HB3 :: 2.888 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 119.365 Ave N Shift Values>> N :: 120.73(4.2) 1.N110 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.45 C 0.17 D 0.16 Y 0.08 F 0.06 L 0.02 E 0.01 C Shift Assignments>> C :: 174.569 CA :: 53.174 CB :: 38.525 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.081 HA :: 5.083 HB2 :: 3.566 HB3 :: 2.565 HD21 :: 7.868 HD22 :: 7.751 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 119.066 ND2 :: 110.569 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.I111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.64 C 0.34 C Shift Assignments>> C :: 176.315 CA :: 59.868 CB :: 40.237 CG1 :: 27.860 CG2 :: 17.500 CD1 :: 13.504 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.371 HA :: 4.759 HB :: 1.764 HG12 :: 1.681 HG13 :: 0.731 HG21 :: 0.622 HG22 :: 0.622 HG23 :: 0.622 HD11 :: 0.752 HD12 :: 0.752 HD13 :: 0.752 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 118.051 Ave N Shift Values>> N :: 121.6(4.72) 1.L112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.5 L 0.24 C 0.2 R 0.04 C Shift Assignments>> C :: 174.657 CA :: 53.550 CB :: 45.094 CG :: 28.119 CD1 :: 24.534 CD2 :: 25.654 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 9.015 HA :: 5.112 HB2 :: 1.621 HB3 :: 1.315 HG :: 1.198 HD11 :: 0.825 HD12 :: 0.825 HD13 :: 0.825 HD21 :: 0.098 HD22 :: 0.098 HD23 :: 0.098 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 133.094 Ave N Shift Values>> N :: 121.98(4.07) 1.Y113 Overall: Anomalous Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> Y 0.47 C 0.36 G 0.15 C Shift Assignments>> C :: 174.027 CA :: 54.931 CB :: 43.190 CD1 :: 133.093 CD2 :: 133.093 CE1 :: 117.162 CE2 :: 117.162 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 8.726 HA :: 6.700(A) HB2 :: 2.936 HB3 :: 2.771 HD1 :: 6.926 HD2 :: 6.926 HE1 :: 6.450 HE2 :: 6.450 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 123.930 Ave N Shift Values>> N :: 120.79(4.69) SRO Rule Breaks>> (HE1 > HA : 1.0000) (HE2 > HA : 0.9994) 1.Y114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.55 C 0.44 C Shift Assignments>> C :: 172.912 CA :: 56.706 CB :: 40.907 CD1 :: 133.972 CD2 :: 133.972 CE1 :: 117.713 CE2 :: 117.713 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 9.148 HA :: 5.864 HB2 :: 3.333 HB3 :: 3.036 HD1 :: 6.676 HD2 :: 6.676 HE1 :: 5.980 HE2 :: 5.980 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 115.208 Ave N Shift Values>> N :: 120.79(4.69) 1.Y115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.61 C 0.38 C Shift Assignments>> C :: 171.719 CA :: 56.396 CB :: 40.745 CD1 :: 133.074 CD2 :: 133.074 CE1 :: 117.893 CE2 :: 117.893 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 8.860 HA :: 5.048 HB2 :: 3.266 HB3 :: 2.586 HD1 :: 6.699 HD2 :: 6.699 HE1 :: 6.750 HE2 :: 6.750 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 112.966 Ave N Shift Values>> N :: 120.79(4.69) 1.V116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.77 V 0.12 A 0.1 C Shift Assignments>> C :: 173.916 CA :: 57.245 CB :: 33.894 CG1 :: 21.018 CG2 :: 18.224 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.194 HA :: 5.396 HB :: 1.244 HG11 :: 0.494 HG12 :: 0.494 HG13 :: 0.494 HG21 :: 0.257 HG22 :: 0.257 HG23 :: 0.257 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 119.772 Ave N Shift Values>> N :: 121.02(4.96) 1.N117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.45 D 0.25 C 0.16 L 0.04 F 0.03 Y 0.02 C Shift Assignments>> C :: 177.217 CA :: 50.334 CB :: 39.922 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.617 HA :: 5.209 HB2 :: 3.583 HB3 :: 2.840 HD21 :: 7.625 HD22 :: 7.510 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 126.000 ND2 :: 110.455 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.G118 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.76 C 0.17 L 0.04 C Shift Assignments>> C :: 174.799 CA :: 46.930 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.602 HA2 :: 3.797 HA3 :: 3.675 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 103.457 Ave N Shift Values>> N :: 109.91(4.29) 1.A119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.82 M 0.15 C 0.02 C Shift Assignments>> C :: 178.403 CA :: 51.713 CB :: 18.979 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.515 HA :: 4.350 HB1 :: 1.367 HB2 :: 1.367 HB3 :: 1.367 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 121.144 Ave N Shift Values>> N :: 123.23(3.7) 1.G120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.81 C 0.1 L 0.06 C Shift Assignments>> C :: 172.555 CA :: 46.099 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.141 HA2 :: 4.202 HA3 :: 3.018 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.861 Ave N Shift Values>> N :: 109.91(4.29) 1.D121 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.32 L 0.19 N 0.13 C 0.11 K 0.09 F 0.05 Y 0.04 R 0.03 C Shift Assignments>> C :: 174.868 CA :: 53.019 CB :: 41.360 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 7.655 HA :: 4.977 HB2 :: 2.588 HB3 :: 2.414 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 118.677 Ave N Shift Values>> N :: 120.73(4.2) 1.V122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.55 C 0.43 C Shift Assignments>> C :: 174.456 CA :: 60.580 CB :: 32.280 CG1 :: 22.152 CG2 :: 23.039 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.725 HA :: 5.084 HB :: 2.040 HG11 :: 1.109 HG12 :: 1.109 HG13 :: 1.109 HG21 :: 0.925 HG22 :: 0.925 HG23 :: 0.925 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 119.866 Ave N Shift Values>> N :: 121.02(4.96) 1.I123 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.5 I 0.47 M 0.01 C Shift Assignments>> C :: 174.403 CA :: 59.470 CB :: 39.110 CG1 :: 30.300 CG2 :: 19.088 CD1 :: 13.961 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.281 HA :: 4.670 HB :: 0.628(S) HG12 :: 1.207 HG13 :: 1.066 HG21 :: 0.756 HG22 :: 0.756 HG23 :: 0.756 HD11 :: 0.739 HD12 :: 0.739 HD13 :: 0.739 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 132.263 Ave N Shift Values>> N :: 121.6(4.72) 1.Y124 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.53 C 0.25 Y 0.21 C Shift Assignments>> C :: 173.112 CA :: 54.048 CB :: 44.200 CD1 :: 133.097 CD2 :: 133.097 CE1 :: 117.982 CE2 :: 117.982 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 8.649 HA :: 5.780 HB2 :: 3.273 HB3 :: 2.830 HD1 :: 6.857 HD2 :: 6.857 HE1 :: 6.353 HE2 :: 6.353 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 122.098 Ave N Shift Values>> N :: 120.79(4.69) 1.G125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.8 C 0.08 L 0.07 R 0.01 C Shift Assignments>> C :: 170.381 CA :: 45.676 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.364 HA2 :: 3.670 HA3 :: 3.345 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 107.489 Ave N Shift Values>> N :: 109.91(4.29) 1.I126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.71 I 0.17 A 0.11 C Shift Assignments>> C :: 176.887 CA :: 56.335 CB :: 39.001 CG1 :: 24.503 CG2 :: 16.379 CD1 :: 10.851 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 7.835 HA :: 5.088 HB :: 1.533 HG12 :: 1.021 HG13 :: 0.738 HG21 :: 0.811 HG22 :: 0.811 HG23 :: 0.811 HD11 :: 0.910 HD12 :: 0.910 HD13 :: 0.910 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 116.673 Ave N Shift Values>> N :: 121.6(4.72) 1.N127 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.3 E 0.2 M 0.12 N 0.12 Y 0.07 K 0.06 F 0.03 Q 0.02 I 0.01 C Shift Assignments>> C :: 174.678 CA :: 54.767 CB :: 36.123 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 10.030 HA :: 4.411 HB2 :: 3.105 HB3 :: 2.950 HD21 :: 7.828 HD22 :: 6.643 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 129.573 ND2 :: 112.504 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.N128 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.27 C 0.21 Y 0.15 D 0.13 F 0.11 E 0.04 L 0.03 I 0.01 M 0.01 C Shift Assignments>> C :: 173.942 CA :: 54.767 CB :: 38.373 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 9.047 HA :: 4.388 HB2 :: 3.048 HB3 :: 2.813 HD21 :: 7.529 HD22 :: 6.803 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 111.626 ND2 :: 112.484 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.E129 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.39 E 0.3 M 0.23 Q 0.02 K 0.01 I 0.01 C Shift Assignments>> C :: 174.530 CA :: 55.159 CB :: 31.736 CG :: 36.335 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.022 HA :: 4.623 HB2 :: 2.012 HB3 :: 1.946 HG2 :: 2.308 HG3 :: 2.062 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 120.732 Ave N Shift Values>> N :: 120.68(3.68) 1.E130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.45 E 0.29 I 0.19 M 0.04 C Shift Assignments>> C :: 176.755 CA :: 58.859 CB :: 31.104 CG :: 37.811 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.759 HA :: 4.002 HB2 :: 2.033 HB3 :: 1.958 HG2 :: 2.081 HG3 :: 1.987 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 127.979 Ave N Shift Values>> N :: 120.68(3.68) 1.K131 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> R 0.36 K 0.28 C 0.27 G 0.03 M 0.01 C Shift Assignments>> C :: 176.764 CA :: 54.051 CB :: 31.547 CG :: 24.282 CD :: 27.941 CE :: 42.822 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 9.235 HA :: 4.488 HB2 :: 1.406 HB3 :: 0.208(S) HG2 :: 1.010 HG3 :: 0.739 HD2 :: 1.507 HD3 :: 1.432 HE2 :: 2.599 HE3 :: 2.530 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 124.878 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.G132 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.52 L 0.18 R 0.13 C 0.1 F 0.01 D 0.01 Y 0.01 C Shift Assignments>> C :: 171.292 CA :: 44.645 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.022 HA2 :: 4.473 HA3 :: 3.888 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 105.865 Ave N Shift Values>> N :: 109.91(4.29) 1.V133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.71 C 0.28 C Shift Assignments>> C :: 177.613 CA :: 62.034 CB :: 32.707 CG1 :: 21.728 CG2 :: 22.110 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.390 HA :: 4.693 HB :: 1.893 HG11 :: 0.915 HG12 :: 0.915 HG13 :: 0.915 HG21 :: 0.806 HG22 :: 0.806 HG23 :: 0.806 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 120.077 Ave N Shift Values>> N :: 121.02(4.96) 1.I134 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.51 C 0.48 C Shift Assignments>> C :: 173.241 CA :: 59.934 CB :: 40.831 CG1 :: 29.621 CG2 :: 15.667 CD1 :: 13.426 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 9.258 HA :: 4.709 HB :: 1.769 HG12 :: 0.717 HG13 :: 1.373 HG21 :: 0.656 HG22 :: 0.656 HG23 :: 0.656 HD11 :: 0.300 HD12 :: 0.300 HD13 :: 0.300 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 126.418 Ave N Shift Values>> N :: 121.6(4.72) 1.L135 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.87 L 0.06 G 0.05 C Shift Assignments>> C :: 173.884 CA :: 53.685 CB :: 48.680(S) CG :: 26.820 CD1 :: 25.118 CD2 :: 25.678 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.217 HA :: 4.804 HB2 :: 1.468 HB3 :: 1.468 HG :: 1.430 HD11 :: 0.965 HD12 :: 0.965 HD13 :: 0.965 HD21 :: 0.746 HD22 :: 0.746 HD23 :: 0.746 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 121.486 Ave N Shift Values>> N :: 121.98(4.07) 1.T136 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.79 C 0.2 C Shift Assignments>> C :: 173.881 CA :: 59.944 CB :: 71.922 CG2 :: 21.285 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.050 HA :: 5.026 HB :: 4.101 HG21 :: 1.042 HG22 :: 1.042 HG23 :: 1.042 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 110.248 Ave N Shift Values>> N :: 115.7(5.05) 1.G137 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.79 C 0.08 L 0.07 R 0.02 C Shift Assignments>> C :: 174.514 CA :: 45.545 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.647 HA2 :: 3.942 HA3 :: 3.605 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 107.874 Ave N Shift Values>> N :: 109.91(4.29) 1.I138 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.68 I 0.15 M 0.15 C Shift Assignments>> C :: 175.417 CA :: 61.575 CB :: 35.252 CG1 :: 31.006 CG2 :: 20.583 CD1 :: 14.548 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.200 HA :: 1.504(S) HB :: 1.136 HG12 :: 0.692 HG13 :: 0.511 HG21 :: -0.167(S) HG22 :: -0.167(S) HG23 :: -0.167(S) HD11 :: 0.341 HD12 :: 0.341 HD13 :: 0.341 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 123.118 Ave N Shift Values>> N :: 121.6(4.72) 1.D139 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> D 0.31 N 0.17 L 0.15 C 0.11 F 0.07 K 0.07 Y 0.06 R 0.01 C Shift Assignments>> C :: 175.210 CA :: 53.651 CB :: 40.754 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 5.172(A) HA :: 4.410 HB2 :: 3.061 HB3 :: 2.860 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 124.500 Ave N Shift Values>> N :: 120.73(4.2) 1.T140 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.88 C 0.1 C Shift Assignments>> C :: 175.606 CA :: 61.171 CB :: 68.194 CG2 :: 21.449 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.678 HA :: 4.027 HB :: 4.449 HG21 :: 0.923 HG22 :: 0.923 HG23 :: 0.923 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 115.034 Ave N Shift Values>> N :: 115.7(5.05) 1.R141 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.44 C 0.38 K 0.08 G 0.07 C Shift Assignments>> C :: 176.804 CA :: 58.000 CB :: 30.562 CG :: 27.037 CD :: 43.390 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.035 HA :: 4.076 HB2 :: 1.952 HB3 :: 1.876 HG2 :: 1.727 HG3 :: 1.665 HD2 :: 3.230 HD3 :: 3.140 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 120.224 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.S142 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 173.480 CA :: 56.027 CB :: 64.114 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.503 HA :: 4.580 HB2 :: 3.889 HB3 :: 3.700 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 114.061 Ave N Shift Values>> N :: 116.3(3.95) 1.L143 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.49 C 0.25 R 0.13 G 0.07 A 0.04 C Shift Assignments>> C :: 176.587 CA :: 55.303 CB :: 43.266 CG :: 27.137 CD1 :: 25.711 CD2 :: 22.607 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.821 HA :: 4.078 HB2 :: 1.650 HB3 :: 0.458 HG :: 1.586 HD11 :: 0.916 HD12 :: 0.916 HD13 :: 0.916 HD21 :: 0.672 HD22 :: 0.672 HD23 :: 0.672 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 121.747 Ave N Shift Values>> N :: 121.98(4.07) 1.L144 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.64 G 0.16 L 0.09 A 0.08 C Shift Assignments>> C :: 174.522 CA :: 53.269 CB :: 47.926 CG :: 26.241 CD1 :: 26.748 CD2 :: 23.662 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.631 HA :: 5.350 HB2 :: 1.533 HB3 :: 1.105 HG :: 1.501 HD11 :: 0.244 HD12 :: 0.244 HD13 :: 0.244 HD21 :: 0.782 HD22 :: 0.782 HD23 :: 0.782 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 119.304 Ave N Shift Values>> N :: 121.98(4.07) 1.W145 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.56 W 0.41 H 0.01 C Shift Assignments>> C :: 177.746 CA :: 58.745 CB :: 33.202 CD1 :: 126.986 CE3 :: 122.750 CZ2 :: 113.060 CZ3 :: 121.828 CH2 :: 124.801 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 9.718 HA :: 4.835 HB2 :: 3.556 HB3 :: 3.214 HD1 :: 7.451 HE1 :: 10.380 HE3 :: 7.625 HZ2 :: 7.279 HZ3 :: 6.620 HH2 :: 7.083 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 120.532 NE1 :: 127.835 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.T146 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.93 C 0.06 C Shift Assignments>> C :: 172.917 CA :: 62.493 CB :: 69.913 CG2 :: 22.154 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.811 HA :: 4.973 HB :: 4.377 HG21 :: 1.343 HG22 :: 1.343 HG23 :: 1.343 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 112.791 Ave N Shift Values>> N :: 115.7(5.05) 1.V147 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.63 V 0.33 I 0.02 C Shift Assignments>> C :: 173.770 CA :: 59.548 CB :: 35.008 CG1 :: 22.089 CG2 :: 19.412 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.570 HA :: 5.028 HB :: 1.854 HG11 :: 0.828 HG12 :: 0.828 HG13 :: 0.828 HG21 :: 0.668 HG22 :: 0.668 HG23 :: 0.668 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 120.193 Ave N Shift Values>> N :: 121.02(4.96) 1.I148 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.6 C 0.38 C Shift Assignments>> C :: 175.014 CA :: 60.925 CB :: 41.672 CG1 :: 28.646 CG2 :: 17.898 CD1 :: 14.872 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.293 HA :: 4.654 HB :: 1.439 HG12 :: 1.683 HG13 :: 1.079 HG21 :: 0.709 HG22 :: 0.709 HG23 :: 0.709 HD11 :: 0.863 HD12 :: 0.863 HD13 :: 0.863 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 124.267 Ave N Shift Values>> N :: 121.6(4.72) 1.D149 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.41 L 0.23 C 0.12 R 0.11 D 0.07 F 0.01 C Shift Assignments>> C :: 176.937 CA :: 52.549 CB :: 44.179 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 9.437 HA :: 4.891 HB2 :: 1.933 HB3 :: 2.993 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 130.760 Ave N Shift Values>> N :: 120.73(4.2) 1.I150 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.49 C 0.49 C Shift Assignments>> CA :: 61.563 CB :: 34.866 CG1 :: 27.813 CG2 :: 17.871 CD1 :: 15.543 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.390 HA :: 3.663 HB :: 1.769 HG12 :: 1.661 HG13 :: 0.487 HG21 :: 0.558 HG22 :: 0.558 HG23 :: 0.558 HD11 :: 0.428 HD12 :: 0.428 HD13 :: 0.428 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 129.958 Ave N Shift Values>> N :: 121.6(4.72) 1.Y151 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.54 H 0.45 C Shift Assignments>> CA :: 57.584 CD1 :: 133.491 CD2 :: 133.491 CE1 :: 117.757 CE2 :: 117.757 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 7.634 HA :: 3.991 HB2 :: 2.775 HB3 :: 2.775 HD1 :: 7.155 HD2 :: 7.155 HE1 :: 6.837 HE2 :: 6.837 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 126.997 Ave N Shift Values>> N :: 120.79(4.69) 1.G152 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.79 C 0.08 L 0.08 R 0.02 C Shift Assignments>> C :: 175.143 CA :: 45.512 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.478 HA2 :: 3.935 HA3 :: 3.603 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 112.257 Ave N Shift Values>> N :: 109.91(4.29) 1.N153 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.23 N 0.21 Y 0.17 F 0.12 D 0.09 E 0.08 I 0.02 L 0.02 M 0.02 C Shift Assignments>> C :: 176.058 CA :: 55.226 CB :: 38.072 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.826 HA :: 4.686 HB2 :: 3.188 HB3 :: 2.879 HD21 :: 6.478 HD22 :: 7.436 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 123.253 ND2 :: 109.830 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.C154 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.2 R 0.16 C 0.14 W 0.1 K 0.08 Q 0.08 E 0.06 H 0.06 L 0.05 P 0.01 C Shift Assignments>> C :: 172.254 CA :: 59.471 CB :: 27.428 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 8.530 HA :: 4.630 HB2 :: 2.658 HB3 :: 2.658 Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 120.989 Ave N Shift Values>> N :: 119.95(4.79) 1.T155 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.86 C 0.13 C Shift Assignments>> C :: 175.071 CA :: 61.508 CB :: 69.271 CG2 :: 22.808 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.738 HA :: 4.280 HB :: 4.354 HG21 :: 1.140 HG22 :: 1.140 HG23 :: 1.140 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 111.991 Ave N Shift Values>> N :: 115.7(5.05) 1.G156 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.8 C 0.13 L 0.05 C Shift Assignments>> C :: 172.512 CA :: 46.512 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.783 HA2 :: 5.265 HA3 :: 3.409 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.947 Ave N Shift Values>> N :: 109.91(4.29) 1.I157 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 I 0.43 A 0.03 C Shift Assignments>> C :: 172.210 CA :: 58.618 CB :: 41.622 CG1 :: 25.655 CG2 :: 18.792 CD1 :: 14.088 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.982 HA :: 5.285 HB :: 1.720 HG12 :: 1.408 HG13 :: 0.982 HG21 :: 0.794 HG22 :: 0.794 HG23 :: 0.794 HD11 :: 0.665 HD12 :: 0.665 HD13 :: 0.665 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 120.641 Ave N Shift Values>> N :: 121.6(4.72) 1.E158 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.91 M 0.07 E 0.01 C Shift Assignments>> C :: 177.265 CA :: 53.072 CB :: 35.410 CG :: 35.665 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.507 HA :: 5.800(S) HB2 :: 2.020 HB3 :: 1.780 HG2 :: 2.219 HG3 :: 2.130 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 123.723 Ave N Shift Values>> N :: 120.68(3.68) 1.F159 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.57 C 0.41 C Shift Assignments>> C :: 176.609 CA :: 56.814 CB :: 40.924 CD1 :: 130.288 CD2 :: 130.288 CE1 :: 130.249 CE2 :: 130.249 CZ :: 127.314 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 9.148 HA :: 5.306 HB2 :: 2.970 HB3 :: 2.726 HD1 :: 6.565 HD2 :: 6.565 HE1 :: 6.152 HE2 :: 6.152 HZ :: 6.553 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 125.287 Ave N Shift Values>> N :: 120.69(4.18) 1.L160 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.35 G 0.27 A 0.17 C 0.16 R 0.03 C Shift Assignments>> C :: 176.473 CA :: 52.587 CB :: 43.936 CG :: 26.464 CD1 :: 26.489 CD2 :: 22.159 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.401 HA :: 4.678 HB2 :: 1.427 HB3 :: 1.289 HG :: 1.531 HD11 :: 0.469 HD12 :: 0.469 HD13 :: 0.469 HD21 :: 0.666 HD22 :: 0.666 HD23 :: 0.666 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 121.752 Ave N Shift Values>> N :: 121.98(4.07) 1.D161 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.3 L 0.18 N 0.13 C 0.11 K 0.1 F 0.07 Y 0.06 R 0.02 C Shift Assignments>> C :: 177.356 CA :: 53.806 CB :: 41.040 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.547 HA :: 4.589 HB2 :: 2.961 HB3 :: 2.559 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 120.004 Ave N Shift Values>> N :: 120.73(4.2) 1.S162 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.621 CA :: 60.542 CB :: 63.760 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.876 HA :: 4.292 HB2 :: 4.031 HB3 :: 3.976 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 124.081 Ave N Shift Values>> N :: 116.3(3.95) 1.R163 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.45 C 0.37 K 0.09 G 0.06 L 0.02 C Shift Assignments>> C :: 177.582 CA :: 58.162 CB :: 29.888 CG :: 27.110 CD :: 43.225 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.418 HA :: 4.086 HB2 :: 1.814 HB3 :: 1.814 HG2 :: 1.648 HG3 :: 1.648 HD2 :: 3.171 HD3 :: 3.171 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 121.150 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.I164 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.76 C 0.23 C Shift Assignments>> C :: 176.652 CA :: 62.209 CB :: 38.497 CG1 :: 27.374 CG2 :: 16.981 CD1 :: 13.068 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 7.415 HA :: 3.912 HB :: 1.769 HG12 :: 1.225 HG13 :: 1.057 HG21 :: 0.514 HG22 :: 0.514 HG23 :: 0.514 HD11 :: 0.794 HD12 :: 0.794 HD13 :: 0.794 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 115.767 Ave N Shift Values>> N :: 121.6(4.72) 1.Y165 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.6 C 0.39 C Shift Assignments>> C :: 175.363 CA :: 59.389 CB :: 39.209 CD1 :: 133.338 CD2 :: 133.338 CE1 :: 118.173 CE2 :: 118.173 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 7.437 HA :: 4.284 HB2 :: 2.974 HB3 :: 2.543 HD1 :: 7.098 HD2 :: 7.098 HE1 :: 6.717 HE2 :: 6.717 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 118.524 Ave N Shift Values>> N :: 120.79(4.69) 1.M166 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.49 C 0.38 A 0.12 C Shift Assignments>> C :: 175.357 CA :: 55.151 CB :: 32.326 CG :: 31.801 CE :: 16.412 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 7.695 HA :: 4.311 HB2 :: 1.760 HB3 :: 1.760 HG2 :: 2.217 HG3 :: 2.217 HE1 :: 1.649 HE2 :: 1.649 HE3 :: 1.649 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 118.539 Ave N Shift Values>> N :: 120.1(3.88) 1.Y167 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.54 C 0.45 C Shift Assignments>> C :: 174.766 CA :: 57.579 CB :: 38.217 CD1 :: 133.125 CD2 :: 133.125 CE1 :: 118.217 CE2 :: 118.217 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 7.773 HA :: 4.488 HB2 :: 2.999 HB3 :: 2.789 HD1 :: 6.995 HD2 :: 6.995 HE1 :: 6.726 HE2 :: 6.726 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 120.295 Ave N Shift Values>> N :: 120.79(4.69) 1.Q168 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.26 Q 0.22 E 0.17 M 0.17 K 0.13 R 0.01 C Shift Assignments>> C :: 180.144 CA :: 57.234 CB :: 30.572 CG :: 34.180 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.657 HA :: 4.058 HB2 :: 2.007 HB3 :: 1.813 HG2 :: 2.153 HG3 :: 2.153 HE21 :: 7.381 HE22 :: 6.700 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 125.683 NE2 :: 112.058 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) ########################################################################### Overall Results: #Consistent: 151 #Clerical: 0 #Suspicious: 12 #Anomalous: 5 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 162 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 6 Shift Relative Order (SRO) Results: #Consistent: 166 #Suspicious: 2 C Shift Results: #Consistent: 731 #Duplicate: 0 #Unknown: 0 #Suspicious: 2 #Anomalous: 0 H Shift Results: #Consistent:1118 #Duplicate: 0 #Unknown: 0 #Suspicious: 21 #Anomalous: 5 N Shift Results: #Consistent: 173 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.V14 H = 11.427(A), Expected = 8.29, Std = 0.7100, ChiSquare = 9.9476e-06 1.A28 HB1 = -0.118(S), Expected = 1.38, Std = 0.2500, ChiSquare = 2.0728e-09 1.A28 HB2 = -0.118(S), Expected = 1.38, Std = 0.2500, ChiSquare = 2.0728e-09 1.A28 HB3 = -0.118(S), Expected = 1.38, Std = 0.2500, ChiSquare = 2.0728e-09 1.F34 HB3 = 1.405(S), Expected = 2.97, Std = 0.3800, ChiSquare = 3.8148e-05 1.N61 HB3 = 1.622(S), Expected = 2.78, Std = 0.3400, ChiSquare = 6.5951e-04 1.F70 CB = 47.155(S), Expected = 39.95, Std = 2.0400, ChiSquare = 4.1264e-04 1.D74 HA = 1.685(A), Expected = 4.61, Std = 0.3100, ChiSquare = 3.8919e-21 1.D74 SRO Rule Break>> HA > HB2 : 0.999496728736789 1.D74 SRO Rule Break>> HA > HB3 : 0.999739311783107 1.P75 HA = 2.856(S), Expected = 4.41, Std = 0.3600, ChiSquare = 1.5840e-05 1.P75 HB2 = 0.635(S), Expected = 2.05, Std = 0.3900, ChiSquare = 2.8540e-04 1.P75 HB3 = -0.457(A), Expected = 2.05, Std = 0.3900, ChiSquare = 1.2912e-10 1.P75 HG3 = 0.566(S), Expected = 1.92, Std = 0.3700, ChiSquare = 2.5275e-04 1.P75 HD2 = 2.020(S), Expected = 3.64, Std = 0.3600, ChiSquare = 6.7953e-06 1.P75 HD3 = 1.952(S), Expected = 3.63, Std = 0.4000, ChiSquare = 2.7287e-05 1.K84 HB3 = 0.836(S), Expected = 1.78, Std = 0.2600, ChiSquare = 2.8258e-04 1.L90 HB3 = 0.377(S), Expected = 1.57, Std = 0.3600, ChiSquare = 9.2008e-04 1.Q104 H = 10.960(S), Expected = 8.22, Std = 0.6200, ChiSquare = 9.8996e-06 1.Q104 HG3 = 1.154(S), Expected = 2.32, Std = 0.2900, ChiSquare = 5.8028e-05 1.Y113 HA = 6.700(A), Expected = 4.63, Std = 0.5600, ChiSquare = 2.1865e-04 1.Y113 SRO Rule Break>> HE1 > HA : 1 1.Y113 SRO Rule Break>> HE2 > HA : 0.999400119976005 1.I123 HB = 0.628(S), Expected = 1.80, Std = 0.3100, ChiSquare = 1.5642e-04 1.K131 HB3 = 0.208(S), Expected = 1.78, Std = 0.2600, ChiSquare = 1.4834e-09 1.L135 CB = 48.680(S), Expected = 42.37, Std = 1.8600, ChiSquare = 6.9265e-04 1.I138 HA = 1.504(S), Expected = 4.20, Std = 0.5600, ChiSquare = 1.4773e-06 1.I138 HG21 = -0.167(S), Expected = 0.80, Std = 0.2900, ChiSquare = 8.5458e-04 1.I138 HG22 = -0.167(S), Expected = 0.80, Std = 0.2900, ChiSquare = 8.5458e-04 1.I138 HG23 = -0.167(S), Expected = 0.80, Std = 0.2900, ChiSquare = 8.5458e-04 1.D139 H = 5.172(A), Expected = 8.33, Std = 0.5700, ChiSquare = 3.0187e-08 1.E158 HA = 5.800(S), Expected = 4.26, Std = 0.4300, ChiSquare = 3.4176e-04