Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> R 0.36 L 0.27 G 0.11 C 0.08 D 0.04 F 0.04 K 0.03 Y 0.02 C Shift Assignments>> CA :: 43.554 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> HA2 :: 3.894 HA3 :: 3.894 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) 1.M2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> M 0.45 C 0.4 A 0.12 C Shift Assignments>> C :: 176.449 CA :: 55.892 CB :: 33.170 CE :: 17.227 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>> HA :: 4.519 HB2 :: 2.112 HB3 :: 2.027 HE1 :: 2.099 HE2 :: 2.099 HE3 :: 2.099 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) 1.N3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.38 D 0.22 C 0.15 Y 0.08 F 0.07 L 0.05 C Shift Assignments>> C :: 175.599 CA :: 53.408 CB :: 39.118 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 :: 8.707 HA :: 4.811 HB2 :: 2.878 HB3 :: 2.814 HD21 :: 7.682 HD22 :: 6.954 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 :: 119.720 ND2 :: 113.333 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.T4 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 :: 174.734 CA :: 62.297 CB :: 69.699 CG2 :: 22.017 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 :: 8.159 HA :: 4.337 HB :: 4.226 HG21 :: 1.232 HG22 :: 1.232 HG23 :: 1.232 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 :: 115.198 Ave N Shift Values>> N :: 115.7(5.05) 1.V5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.74 C 0.25 C Shift Assignments>> C :: 176.331 CA :: 62.389 CB :: 33.162 CG1 :: 21.850 CG2 :: 20.863 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 :: 8.080 HA :: 4.207 HB :: 2.047 HG11 :: 0.932 HG12 :: 0.932 HG13 :: 0.932 HG21 :: 0.952 HG22 :: 0.952 HG23 :: 0.952 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 121.955 Ave N Shift Values>> N :: 121.02(4.96) 1.K6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 K 0.36 R 0.22 M 0.01 G 0.01 C Shift Assignments>> C :: 175.859 CA :: 55.669 CB :: 35.017 CG :: 25.116 CD :: 29.275 CE :: 42.315 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 :: 8.150 HA :: 4.529 HB2 :: 1.741 HB3 :: 1.657 HG2 :: 1.404 HG3 :: 1.404 HD2 :: 1.542 HD3 :: 1.542 HE2 :: 2.944 HE3 :: 2.944 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 :: 122.917 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.N7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.37 D 0.3 C 0.13 L 0.08 F 0.04 Y 0.04 K 0.01 HN Overlap>> 1.F67 1.F67 C Shift Assignments>> C :: 175.603 CA :: 51.701 CB :: 40.173 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 :: 8.316 HA :: 4.740 HB2 :: 3.089 HB3 :: 2.899 HD21 :: 7.512 HD22 :: 6.875 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 :: 117.298 ND2 :: 112.337 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.K8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.43 R 0.23 G 0.15 K 0.15 M 0.01 C Shift Assignments>> C :: 177.427 CA :: 60.627 CB :: 32.632 CG :: 25.108 CD :: 29.834 CE :: 43.618 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 :: 8.644 HA :: 3.613 HB2 :: 1.824 HB3 :: 1.824 HG2 :: 1.319 HG3 :: 1.252 HD2 :: 1.740 HD3 :: 1.740 HE2 :: 2.942 HE3 :: 2.942 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 :: 118.813 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.Q9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.32 Q 0.2 K 0.2 E 0.1 R 0.07 I 0.06 P 0.02 M 0.01 C Shift Assignments>> C :: 179.119 CA :: 59.579 CB :: 27.904 CG :: 34.026 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.318 HA :: 3.959 HB2 :: 2.197 HB3 :: 2.102 HG2 :: 2.465 HG3 :: 2.489 HE21 :: 6.918 HE22 :: 7.761 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 :: 117.655 NE2 :: 112.550 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.E10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 E 0.33 I 0.23 M 0.03 K 0.02 C Shift Assignments>> C :: 180.346 CA :: 59.200 CB :: 30.239 CG :: 37.308 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 :: 8.211 HA :: 4.052 HB2 :: 2.240 HB3 :: 2.009 HG2 :: 2.335 HG3 :: 2.553 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 :: 118.882 Ave N Shift Values>> N :: 120.68(3.68) 1.I11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.88 C 0.11 HN Overlap>> 1.R115 1.R115 C Shift Assignments>> C :: 176.917 CA :: 64.593 CB :: 37.190 CG1 :: 29.590 CG2 :: 17.882 CD1 :: 13.729 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 :: 7.935 HA :: 3.439 HB :: 1.913 HG12 :: 0.935 HG13 :: 1.554 HG21 :: 0.544 HG22 :: 0.544 HG23 :: 0.544 HD11 :: 0.661 HD12 :: 0.661 HD13 :: 0.661 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 :: 121.647 Ave N Shift Values>> N :: 121.6(4.72) 1.L12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.5 L 0.46 R 0.02 C Shift Assignments>> C :: 179.992 CA :: 58.183 CB :: 40.490 CG :: 26.994 CD1 :: 25.931 CD2 :: 22.350 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 :: 8.131 HA :: 3.806 HB2 :: 1.491 HB3 :: 1.976 HG :: 1.857 HD11 :: 0.970 HD12 :: 0.970 HD13 :: 0.970 HD21 :: 0.626 HD22 :: 0.626 HD23 :: 0.626 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 :: 118.165 Ave N Shift Values>> N :: 121.98(4.07) 1.E13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.32 E 0.31 I 0.15 K 0.11 Q 0.06 M 0.01 C Shift Assignments>> C :: 178.711 CA :: 58.860 CB :: 28.983 CG :: 35.940 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.947 HA :: 4.112 HB2 :: 2.085 HB3 :: 2.146 HG2 :: 2.500 HG3 :: 2.445 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 117.629 Ave N Shift Values>> N :: 120.68(3.68) 1.A14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.48 A 0.4 C 0.04 I 0.02 V 0.01 L 0.01 C Shift Assignments>> C :: 182.087 CA :: 55.116 CB :: 19.325 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.516 HA :: 4.227 HB1 :: 1.610 HB2 :: 1.610 HB3 :: 1.610 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 121.217 Ave N Shift Values>> N :: 123.23(3.7) 1.F15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.38 F 0.31 C 0.29 HN Overlap>> 1.M21 1.M21 C Shift Assignments>> C :: 177.899 CA :: 60.476 CB :: 38.663 CD1 :: 130.015 CD2 :: 130.015 CE1 :: 131.730 CE2 :: 131.730 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 7.771 HA :: 4.104 HB2 :: 3.002 HB3 :: 2.455 HD1 :: 7.241 HD2 :: 7.241 HE1 :: 7.236 HE2 :: 7.236 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 117.497 Ave N Shift Values>> N :: 120.69(4.18) 1.R16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.41 C 0.36 K 0.14 G 0.07 C Shift Assignments>> C :: 178.628 CA :: 58.277 CB :: 30.751 CG :: 28.066 CD :: 43.372 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 :: 7.669 HA :: 4.688 HB2 :: 2.145 HB3 :: 2.145 HG2 :: 1.882 HG3 :: 1.957 HD2 :: 3.328 HD3 :: 3.380 HE :: 7.574 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 116.207 NE :: 84.438 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.E17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.37 C 0.35 M 0.09 K 0.09 Q 0.04 I 0.04 C Shift Assignments>> C :: 176.284 CA :: 56.131 CB :: 30.034 CG :: 36.296 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 :: 7.661 HA :: 4.263 HB2 :: 2.064 HB3 :: 2.378 HG2 :: 2.425 HG3 :: 2.636 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 :: 115.237 Ave N Shift Values>> N :: 120.68(3.68) 1.S18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.89 P 0.07 C 0.03 C Shift Assignments>> CA :: 53.638 CB :: 63.727 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.525 HA :: 5.277 HB2 :: 4.284 HB3 :: 4.412 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 116.291 Ave N Shift Values>> N :: 116.3(3.95) 1.P19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.74 C 0.24 C Shift Assignments>> C :: 180.631 CA :: 64.635 CB :: 32.186 CG :: 27.641 CD :: 51.565 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 :: 4.332 HB2 :: 2.393 HB3 :: 1.993 HG2 :: 2.171 HG3 :: 2.108 HD2 :: 4.215 HD3 :: 4.341 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.D20 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> K 0.19 F 0.19 Y 0.15 C 0.14 L 0.13 D 0.07 R 0.05 I 0.04 C Shift Assignments>> CA :: 57.699 CB :: 41.258 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 :: 7.372 HA :: 4.303 HB2 :: 1.241(A) HB3 :: 1.241(S) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 114.712 Ave N Shift Values>> N :: 120.73(4.2) 1.M21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 M 0.44 A 0.04 HN Overlap>> 1.F15 1.F15 C Shift Assignments>> CA :: 57.308 CB :: 31.600 CG :: 33.204 CE :: 17.493 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 :: 7.810 HA :: 4.149 HB2 :: 2.178 HB3 :: 2.085 HG2 :: 2.174 HG3 :: 2.174 HE1 :: 1.506 HE2 :: 1.506 HE3 :: 1.506 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 :: 117.503 Ave N Shift Values>> N :: 120.1(3.88) 1.M22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.6 M 0.35 A 0.03 C Shift Assignments>> C :: 180.464 CA :: 56.227 CB :: 29.162 CG :: 32.492 CE :: 15.398 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 :: 8.143 HA :: 4.574 HB2 :: 2.036 HB3 :: 2.036 HG2 :: 3.028 HG3 :: 2.811 HE1 :: 1.913 HE2 :: 1.913 HE3 :: 1.913 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 :: 114.780 Ave N Shift Values>> N :: 120.1(3.88) 1.A23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.6 A 0.29 I 0.05 C 0.03 C Shift Assignments>> C :: 180.689 CA :: 55.557 CB :: 17.980 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.093 HA :: 4.121 HB1 :: 1.601 HB2 :: 1.601 HB3 :: 1.601 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.842 Ave N Shift Values>> N :: 123.23(3.7) 1.I24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.92 C 0.07 C Shift Assignments>> C :: 178.222 CA :: 65.778 CB :: 38.544 CG1 :: 29.948 CG2 :: 18.776 CD1 :: 14.699 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 :: 8.302 HA :: 3.540 HB :: 1.685 HG12 :: 0.215 HG13 :: 1.131 HG21 :: 0.695 HG22 :: 0.695 HG23 :: 0.695 HD11 :: -0.057 HD12 :: -0.057 HD13 :: -0.057 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 :: 119.156 Ave N Shift Values>> N :: 121.6(4.72) 1.L25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.49 C 0.32 R 0.14 G 0.02 C Shift Assignments>> C :: 180.835 CA :: 58.030 CB :: 42.332 CG :: 26.952 CD1 :: 26.296 CD2 :: 24.041 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 :: 8.655 HA :: 3.980 HB2 :: 1.319 HB3 :: 1.886 HG :: 1.865 HD11 :: 0.810 HD12 :: 0.810 HD13 :: 0.810 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 :: 117.715 Ave N Shift Values>> N :: 121.98(4.07) 1.T26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 HN Overlap>> 1.F152 1.D137 1.F152 1.D137 C Shift Assignments>> C :: 175.417 CA :: 67.584 CB :: 68.699 CG2 :: 21.122 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 :: 7.871 HA :: 3.643 HB :: 4.318 HG21 :: 1.159 HG22 :: 1.159 HG23 :: 1.159 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 :: 117.831 Ave N Shift Values>> N :: 115.7(5.05) 1.I27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.93 C 0.06 C Shift Assignments>> C :: 179.352 CA :: 65.624 CB :: 38.603 CG1 :: 29.975 CG2 :: 17.617 CD1 :: 13.586 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 :: 8.160 HA :: 3.498 HB :: 1.887 HG12 :: 1.530 HG13 :: 0.395 HG21 :: 0.326 HG22 :: 0.326 HG23 :: 0.326 HD11 :: 0.296 HD12 :: 0.296 HD13 :: 0.296 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 :: 123.913 Ave N Shift Values>> N :: 121.6(4.72) 1.I28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.91 C 0.08 HN Overlap>> 1.T172 1.Q171 1.T172 1.Q171 C Shift Assignments>> C :: 179.486 CA :: 65.800 CB :: 39.092 CG1 :: 28.887 CG2 :: 17.683 CD1 :: 16.422 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 :: 8.396 HA :: 3.382 HB :: 1.757 HG12 :: 2.197 HG13 :: 0.959 HG21 :: 0.970 HG22 :: 0.970 HG23 :: 0.970 HD11 :: 0.787 HD12 :: 0.787 HD13 :: 0.787 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 :: 116.419 Ave N Shift Values>> N :: 121.6(4.72) 1.R29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.42 C 0.36 G 0.11 K 0.07 L 0.02 C Shift Assignments>> C :: 179.763 CA :: 59.496 CB :: 29.583 CG :: 26.770 CD :: 43.569 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 :: 7.937 HA :: 3.962 HB2 :: 1.939 HB3 :: 1.939 HG2 :: 1.444 HG3 :: 1.746 HD2 :: 2.933 HD3 :: 2.806 HE :: 6.983 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 :: 122.023 NE :: 84.656 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.D30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.18 Y 0.18 D 0.18 C 0.16 L 0.11 N 0.07 K 0.05 I 0.02 C Shift Assignments>> C :: 178.074 CA :: 56.098 CB :: 40.082 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 :: 8.312 HA :: 4.402 HB2 :: 2.804 HB3 :: 2.691 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 :: 119.454 Ave N Shift Values>> N :: 120.73(4.2) 1.L31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.5 C 0.35 G 0.06 R 0.04 A 0.02 C Shift Assignments>> C :: 179.308 CA :: 56.793 CB :: 42.898 CG :: 25.614 CD1 :: 22.662 CD2 :: 25.689 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 :: 7.724 HA :: 4.025 HB2 :: 1.895 HB3 :: 1.217 HG :: 2.091 HD11 :: 0.718 HD12 :: 0.718 HD13 :: 0.718 HD21 :: 0.670 HD22 :: 0.670 HD23 :: 0.670 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 :: 120.366 Ave N Shift Values>> N :: 121.98(4.07) 1.G32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.72 C 0.2 L 0.03 A 0.01 P 0.01 C Shift Assignments>> C :: 175.481 CA :: 47.166 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.414 HA2 :: 3.743 HA3 :: 3.811 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 104.257 Ave N Shift Values>> N :: 109.91(4.29) 1.L33 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.61 C 0.19 L 0.14 G 0.03 C Shift Assignments>> CA :: 52.995 CB :: 42.292 CG :: 25.650 CD1 :: 20.620 CD2 :: 24.630 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 :: 8.504 HA :: 4.177 HB2 :: 0.761 HB3 :: 1.209 HG :: 1.098 HD11 :: -0.136(S) HD12 :: -0.136(S) HD13 :: -0.136(S) HD21 :: -0.241(S) HD22 :: -0.241(S) HD23 :: -0.241(S) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 120.556 Ave N Shift Values>> N :: 121.98(4.07) 1.K34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 R 0.36 K 0.22 G 0.02 M 0.01 C Shift Assignments>> C :: 176.269 CA :: 57.803 CB :: 33.994 CG :: 26.434 CD :: 30.148 CE :: 42.703 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 :: 9.116 HA :: 4.068 HB2 :: 2.010 HB3 :: 1.965 HG2 :: 1.500 HG3 :: 1.752 HD2 :: 1.691 HD3 :: 1.892 HE2 :: 3.140 HE3 :: 3.140 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 :: 123.552 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.D35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.3 N 0.22 C 0.12 L 0.12 F 0.08 Y 0.08 K 0.03 C Shift Assignments>> C :: 175.271 CA :: 53.827 CB :: 40.220 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 :: 8.827 HA :: 4.218 HB2 :: 2.506 HB3 :: 3.643 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 122.628 Ave N Shift Values>> N :: 120.73(4.2) 1.S36 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> S 0.8 T 0.19 C Shift Assignments>> C :: 175.342 CA :: 56.142 CB :: 66.761 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.987 HA :: 5.954(S) HB2 :: 3.627 HB3 :: 3.561 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 :: 113.241 Ave N Shift Values>> N :: 116.3(3.95) 1.W37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.72 W 0.26 H 0.01 C Shift Assignments>> C :: 175.291 CA :: 56.875 CB :: 33.431 CD1 :: 127.468 CZ2 :: 113.565 CZ3 :: 118.707 CH2 :: 122.614 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 :: 8.927 HA :: 4.529 HB2 :: 3.262 HB3 :: 2.622 HD1 :: 7.027 HE1 :: 9.632 HE3 :: 7.312 HZ2 :: 6.909 HZ3 :: 7.237 HH2 :: 6.811 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 :: 118.273 NE1 :: 128.809 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.L38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.3 C 0.28 R 0.28 G 0.1 K 0.02 C Shift Assignments>> CA :: 54.878 CB :: 43.413 CG :: 27.490 CD1 :: 27.770 CD2 :: 25.168 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 :: 8.990 HA :: 5.062 HB2 :: 2.039 HB3 :: 1.153 HG :: 1.360 HD11 :: 0.680 HD12 :: 0.680 HD13 :: 0.680 HD21 :: 0.982 HD22 :: 0.982 HD23 :: 0.982 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 122.812 Ave N Shift Values>> N :: 121.98(4.07) 1.A39 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.61 L 0.13 C 0.11 R 0.05 K 0.03 H 0.02 Q 0.01 W 0.01 C Shift Assignments>> CA :: 51.118 CB :: 26.069(S) Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 9.014 HA :: 5.619 HB1 :: 1.575 HB2 :: 1.575 HB3 :: 1.575 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 129.381 Ave N Shift Values>> N :: 123.23(3.7) 1.A40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.66 M 0.3 C 0.01 C Shift Assignments>> CA :: 52.808 CB :: 17.587 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.380 HA :: 4.529 HB1 :: 1.370 HB2 :: 1.370 HB3 :: 1.370 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 115.857 Ave N Shift Values>> N :: 123.23(3.7) 1.G41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.39 C 0.26 P 0.18 A 0.08 N 0.03 L 0.01 D 0.01 C Shift Assignments>> C :: 171.649 CA :: 48.000 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.603 HA2 :: 4.037 HA3 :: 3.286 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.138 Ave N Shift Values>> N :: 109.91(4.29) 1.S42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 T 0.01 C Shift Assignments>> C :: 175.136 CA :: 62.270 CB :: 63.859 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.406 HA :: 4.164 HB2 :: 3.753 HB3 :: 3.877 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 :: 113.712 Ave N Shift Values>> N :: 116.3(3.95) 1.V43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.9 C 0.09 C Shift Assignments>> C :: 176.478 CA :: 64.820 CB :: 32.779 CG1 :: 22.275 CG2 :: 22.063 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 :: 7.025 HA :: 3.595 HB :: 1.824 HG11 :: 0.546 HG12 :: 0.546 HG13 :: 0.546 HG21 :: 0.660 HG22 :: 0.660 HG23 :: 0.660 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 :: 117.488 Ave N Shift Values>> N :: 121.02(4.96) 1.R44 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.44 R 0.29 G 0.15 K 0.1 C Shift Assignments>> C :: 176.199 CA :: 59.404 CB :: 31.085 CG :: 25.029 CD :: 43.746 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 :: 7.821 HA :: 3.024 HB2 :: 0.921 HB3 :: 1.320 HG2 :: 0.232(S) HG3 :: -1.298(A) HD2 :: 1.862(S) HD3 :: 1.814(S) 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 :: 120.015 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.N45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 E 0.18 N 0.14 Y 0.14 F 0.07 M 0.06 D 0.03 I 0.02 K 0.02 HN Overlap>> 1.Q153 1.Q153 C Shift Assignments>> CA :: 55.396 CB :: 37.069 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 :: 8.722 HA :: 3.750 HB2 :: 3.008 HB3 :: 2.933 HD21 :: 7.406 HD22 :: 7.000 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 :: 114.827 ND2 :: 107.618 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.F46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.62 C 0.37 C Shift Assignments>> CA :: 59.971 CB :: 39.396 CD1 :: 130.364 CD2 :: 130.364 CE1 :: 131.261 CE2 :: 131.261 CZ :: 128.732 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 :: 6.529 HA :: 4.595 HB2 :: 3.415 HB3 :: 3.122 HD1 :: 6.592 HD2 :: 6.592 HE1 :: 6.433 HE2 :: 6.433 HZ :: 6.773 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 :: 118.906 Ave N Shift Values>> N :: 120.69(4.18) 1.I47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.92 C 0.07 C Shift Assignments>> CA :: 65.847 CB :: 37.565 CG1 :: 29.250 CG2 :: 18.954 CD1 :: 14.061 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 :: 7.491 HA :: 3.502 HB :: 1.593 HG12 :: 0.790 HG13 :: 0.755 HG21 :: 0.696 HG22 :: 0.696 HG23 :: 0.696 HD11 :: 0.750 HD12 :: 0.750 HD13 :: 0.750 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 :: 117.934 Ave N Shift Values>> N :: 121.6(4.72) 1.W48 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.93 W 0.05 H 0.01 C Shift Assignments>> CA :: 58.190 CB :: 26.607 CD1 :: 123.084 CZ2 :: 111.680 CZ3 :: 119.924 CH2 :: 125.630 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 :: 8.403 HA :: 4.223 HB2 :: 1.457(S) HB3 :: 2.241 HD1 :: 5.631(A) HE1 :: 9.352 HZ2 :: 6.599 HZ3 :: 5.492 HH2 :: 6.445 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 :: 120.640 NE1 :: 126.229 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.N49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.22 C 0.22 F 0.18 D 0.1 N 0.1 E 0.04 I 0.04 L 0.04 C Shift Assignments>> C :: 178.033 CA :: 56.208 CB :: 38.738 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 :: 8.917 HA :: 4.581 HB2 :: 3.345 HB3 :: 2.627 HD21 :: 7.098 HD22 :: 7.033 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 :: 120.895 ND2 :: 109.047 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.L50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.35 C 0.33 L 0.22 G 0.04 K 0.04 C Shift Assignments>> C :: 181.206 CA :: 58.381 CB :: 42.881 CG :: 28.484 CD1 :: 26.631 CD2 :: 24.151 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 :: 8.374 HA :: 4.115 HB2 :: 2.192 HB3 :: 1.470 HG :: 1.541 HD11 :: 0.804 HD12 :: 0.804 HD13 :: 0.804 HD21 :: 0.902 HD22 :: 0.902 HD23 :: 0.902 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 :: 123.398 Ave N Shift Values>> N :: 121.98(4.07) 1.L51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.33 C 0.32 R 0.27 K 0.02 G 0.01 A 0.01 C Shift Assignments>> C :: 178.000 CA :: 56.536 CB :: 42.344 CG :: 27.753 CD1 :: 27.307 CD2 :: 23.031 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 :: 8.677 HA :: 4.309 HB2 :: 2.028 HB3 :: 2.171 HG :: 2.028 HD11 :: 0.922 HD12 :: 0.922 HD13 :: 0.922 HD21 :: 0.965 HD22 :: 0.965 HD23 :: 0.965 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 :: 117.586 Ave N Shift Values>> N :: 121.98(4.07) 1.S52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 173.454 CA :: 57.774 CB :: 63.518 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.852 HA :: 4.769 HB2 :: 4.243 HB3 :: 4.243 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 :: 113.962 Ave N Shift Values>> N :: 116.3(3.95) 1.D53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.2 C 0.19 F 0.18 D 0.15 N 0.11 L 0.06 I 0.03 E 0.02 HN Overlap>> 1.K54 1.K54 C Shift Assignments>> C :: 175.040 CA :: 55.908 CB :: 39.232 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 :: 7.958 HA :: 4.462 HB2 :: 3.077 HB3 :: 2.738 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 :: 116.675 Ave N Shift Values>> N :: 120.73(4.2) 1.K54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.39 K 0.36 R 0.19 G 0.02 M 0.02 HN Overlap>> 1.S105 1.D53 1.S105 1.D53 C Shift Assignments>> C :: 176.883 CA :: 53.966 CB :: 35.407 CG :: 24.767 CD :: 29.378 CE :: 42.348 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 :: 7.872 HA :: 4.615 HB2 :: 1.821 HB3 :: 1.411 HG2 :: 1.454 HG3 :: 1.416 HD2 :: 1.684 HD3 :: 1.684 HE2 :: 3.003 HE3 :: 3.021 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 :: 116.661 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.S55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 56.991 CB :: 63.047 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.430 HA :: 4.456 HB2 :: 3.934 HB3 :: 3.857 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 :: 118.512 Ave N Shift Values>> N :: 116.3(3.95) 1.P56 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Indeterminable PRTL>> P 0.57 C 0.42 C Shift Assignments>> CA :: 65.707 CB :: 31.261 CG :: 28.495 CD :: 51.547 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 :: 3.940 HB2 :: 0.879 HB3 :: 0.512(S) HG2 :: 1.872 HG3 :: 1.539 HD2 :: 3.709 HD3 :: 3.923 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.F57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.64 F 0.34 C Shift Assignments>> CA :: 58.916 CB :: 40.745 CD1 :: 131.884 CD2 :: 131.884 CE1 :: 130.965 CE2 :: 130.965 CZ :: 133.409 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 :: 8.203 HA :: 4.460 HB2 :: 3.005 HB3 :: 3.234 HD1 :: 6.975 HD2 :: 6.975 HE1 :: 7.059 HE2 :: 7.059 HZ :: 7.286 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 117.176 Ave N Shift Values>> N :: 120.69(4.18) 1.D58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.26 D 0.25 C 0.11 R 0.11 K 0.09 N 0.06 F 0.03 Y 0.02 G 0.02 C Shift Assignments>> CA :: 52.700 CB :: 42.408 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 :: 7.763 HA :: 4.680 HB2 :: 2.523 HB3 :: 2.791 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 :: 127.870 Ave N Shift Values>> N :: 120.73(4.2) 1.H59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> W 0.38 H 0.34 C 0.27 C Shift Assignments>> CA :: 58.358 CB :: 28.575 CD2 :: 120.500 CE1 :: 137.292 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>> HA :: 4.278 HB2 :: 3.544 HB3 :: 3.397 HD2 :: 7.549 HE1 :: 8.578 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) 1.E60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.39 C 0.38 I 0.08 K 0.06 M 0.04 Q 0.01 HN Overlap>> 1.L146 1.L146 C Shift Assignments>> CA :: 56.713 CB :: 29.716 CG :: 36.880 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 :: 8.604 HA :: 4.341 HB2 :: 2.159 HB3 :: 1.934 HG2 :: 2.160 HG3 :: 2.160 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 118.550 Ave N Shift Values>> N :: 120.68(3.68) 1.T61 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>> CA :: 62.160 CB :: 70.171 CG2 :: 21.652 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 :: 7.229 HA :: 4.301 HB :: 4.032 HG21 :: 1.240 HG22 :: 1.240 HG23 :: 1.240 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 :: 116.913 Ave N Shift Values>> N :: 115.7(5.05) 1.D62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.24 L 0.18 K 0.13 C 0.11 F 0.1 Y 0.09 N 0.07 R 0.02 C Shift Assignments>> CA :: 54.994 CB :: 40.985 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 :: 8.445 HA :: 4.509 HB2 :: 2.426 HB3 :: 2.637 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 :: 126.422 Ave N Shift Values>> N :: 120.73(4.2) 1.I63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.86 I 0.1 A 0.02 C Shift Assignments>> C :: 173.897 CA :: 58.723 CB :: 35.055 CG1 :: 26.761 CG2 :: 19.996 CD1 :: 10.582 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 :: 8.700 HA :: 3.940 HB :: 1.713 HG12 :: 0.563 HG13 :: 1.232 HG21 :: 0.545 HG22 :: 0.545 HG23 :: 0.545 HD11 :: 0.381 HD12 :: 0.381 HD13 :: 0.381 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 :: 123.318 Ave N Shift Values>> N :: 121.6(4.72) 1.D64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.27 N 0.2 C 0.13 L 0.11 F 0.1 Y 0.1 K 0.03 C Shift Assignments>> C :: 173.513 CA :: 54.300 CB :: 40.006 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 :: 8.563 HA :: 5.084 HB2 :: 3.259 HB3 :: 2.844 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 :: 128.513 Ave N Shift Values>> N :: 120.73(4.2) 1.V65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.67 C 0.32 C Shift Assignments>> C :: 176.612 CA :: 61.532 CB :: 32.551 CG1 :: 22.110 CG2 :: 21.957 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 :: 8.960 HA :: 4.982 HB :: 2.371 HG11 :: 1.303 HG12 :: 1.303 HG13 :: 1.303 HG21 :: 0.906 HG22 :: 0.906 HG23 :: 0.906 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 :: 125.834 Ave N Shift Values>> N :: 121.02(4.96) 1.I66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.59 I 0.29 A 0.06 G 0.04 C Shift Assignments>> C :: 174.675 CA :: 58.010 CB :: 42.457 CG1 :: 26.975 CG2 :: 18.711 CD1 :: 14.655 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 :: 9.124 HA :: 6.020 HB :: 2.035 HG12 :: 1.781 HG13 :: 1.336 HG21 :: 1.084 HG22 :: 1.084 HG23 :: 1.084 HD11 :: 0.903 HD12 :: 0.903 HD13 :: 0.903 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 :: 120.472 Ave N Shift Values>> N :: 121.6(4.72) 1.F67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.39 C 0.39 F 0.21 HN Overlap>> 1.N7 1.N7 C Shift Assignments>> CA :: 55.825 CB :: 38.276 CD1 :: 133.281 CD2 :: 133.281 CE1 :: 130.641 CE2 :: 130.738 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 :: 8.374 HA :: 5.492 HB2 :: 3.438 HB3 :: 2.879 HD1 :: 7.018 HD2 :: 7.018 HE1 :: 6.949 HE2 :: 6.949 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 117.207 Ave N Shift Values>> N :: 120.69(4.18) 1.F68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.35 F 0.33 C 0.31 HN Overlap>> 1.L84 1.L84 C Shift Assignments>> CA :: 58.492 CB :: 41.218 CD1 :: 133.131 CD2 :: 133.131 CE1 :: 131.090 CE2 :: 131.090 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 :: 8.188 HA :: 4.493 HB2 :: 3.495 HB3 :: 3.064 HD1 :: 6.864 HD2 :: 6.864 HE1 :: 6.909 HE2 :: 6.909 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 :: 121.015 Ave N Shift Values>> N :: 120.69(4.18) 1.D69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.26 L 0.23 D 0.15 C 0.13 R 0.12 N 0.02 K 0.02 F 0.01 Y 0.01 C Shift Assignments>> CA :: 51.565 CB :: 43.386 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 :: 7.575 HA :: 5.101 HB2 :: 3.181 HB3 :: 2.913 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 :: 120.610 Ave N Shift Values>> N :: 120.73(4.2) 1.P70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.8 C 0.19 C Shift Assignments>> C :: 176.698 CA :: 64.066 CB :: 32.431 CG :: 26.931 CD :: 51.358 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 :: 4.166 HB2 :: 2.036 HB3 :: 2.308 HG2 :: 1.925 HG3 :: 2.110 HD2 :: 4.069 HD3 :: 3.407 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.D71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.24 L 0.19 K 0.13 C 0.11 F 0.1 Y 0.08 N 0.07 R 0.03 C Shift Assignments>> C :: 175.282 CA :: 54.871 CB :: 41.107 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 :: 8.475 HA :: 4.718 HB2 :: 2.891 HB3 :: 2.752 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 :: 116.772 Ave N Shift Values>> N :: 120.73(4.2) 1.F72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.49 C 0.29 Y 0.2 C Shift Assignments>> C :: 176.865 CA :: 57.281 CB :: 41.514 CD1 :: 131.551 CD2 :: 131.565 CE1 :: 131.565 CE2 :: 131.565 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 7.545 HA :: 4.874 HB2 :: 3.325 HB3 :: 3.018 HD1 :: 7.348 HD2 :: 7.348 HE1 :: 7.266 HE2 :: 7.266 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 :: 124.237 Ave N Shift Values>> N :: 120.69(4.18) 1.S73 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 :: 175.921 CA :: 58.420 CB :: 65.516 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 9.265 HA :: 4.650 HB2 :: 4.157 HB3 :: 4.487 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 :: 124.287 Ave N Shift Values>> N :: 116.3(3.95) 1.Y74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.68 C 0.3 C Shift Assignments>> C :: 177.944 CA :: 62.573 CB :: 38.125 CD1 :: 133.053 CD2 :: 133.053 CE1 :: 118.643 CE2 :: 118.643 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 :: 9.300 HA :: 3.910 HB2 :: 2.659 HB3 :: 2.178 HD1 :: 6.881 HD2 :: 6.881 HE1 :: 6.854 HE2 :: 6.854 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 :: 126.962 Ave N Shift Values>> N :: 120.79(4.69) 1.E75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.49 C 0.3 E 0.17 K 0.01 HN Overlap>> 1.D148 1.E134 1.D148 1.E134 C Shift Assignments>> C :: 180.159 CA :: 60.875 CB :: 29.105 CG :: 37.376 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 :: 9.032 HA :: 3.827 HB2 :: 1.984 HB3 :: 2.117 HG2 :: 2.506 HG3 :: 2.334 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 :: 118.599 Ave N Shift Values>> N :: 120.68(3.68) 1.E76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 I 0.32 E 0.27 K 0.03 C Shift Assignments>> C :: 180.147 CA :: 59.425 CB :: 29.092 CG :: 37.282 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 :: 8.210 HA :: 3.911 HB2 :: 1.913 HB3 :: 1.679 HG2 :: 2.220 HG3 :: 2.140 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 :: 119.870 Ave N Shift Values>> N :: 120.68(3.68) 1.T77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.98 C 0.01 C Shift Assignments>> CA :: 68.825 CB :: 68.423 CG2 :: 22.468 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 :: 8.367 HA :: 4.015 HB :: 4.743 HG21 :: 1.487 HG22 :: 1.487 HG23 :: 1.487 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 :: 120.259 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 0.52 C 0.35 R 0.09 G 0.01 C Shift Assignments>> CA :: 58.036 CB :: 42.152 CG :: 26.568 CD1 :: 26.094 CD2 :: 22.787 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 :: 7.916 HA :: 4.078 HB2 :: 1.429 HB3 :: 1.889 HG :: 1.373 HD11 :: 0.808 HD12 :: 0.808 HD13 :: 0.808 HD21 :: 0.832 HD22 :: 0.832 HD23 :: 0.832 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 :: 121.346 Ave N Shift Values>> N :: 121.98(4.07) 1.L79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.56 C 0.35 R 0.06 C Shift Assignments>> C :: 180.067 CA :: 57.951 CB :: 41.736 CG :: 26.990 CD1 :: 25.250 CD2 :: 23.199 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 :: 7.670 HA :: 4.130 HB2 :: 1.562 HB3 :: 1.898 HG :: 1.799 HD11 :: 0.915 HD12 :: 0.915 HD13 :: 0.915 HD21 :: 0.893 HD22 :: 0.893 HD23 :: 0.893 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 :: 119.662 Ave N Shift Values>> N :: 121.98(4.07) 1.L80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.52 C 0.34 R 0.1 K 0.01 C Shift Assignments>> C :: 178.626 CA :: 57.578 CB :: 41.706 CG :: 27.018 CD1 :: 26.280 CD2 :: 23.813 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 :: 8.009 HA :: 4.236 HB2 :: 1.795 HB3 :: 1.760 HG :: 1.540 HD11 :: 0.794 HD12 :: 0.794 HD13 :: 0.794 HD21 :: 0.854 HD22 :: 0.854 HD23 :: 0.854 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 :: 123.710 Ave N Shift Values>> N :: 121.98(4.07) 1.E81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.46 E 0.24 I 0.24 M 0.03 C Shift Assignments>> C :: 177.565 CA :: 59.979 CB :: 31.449 CG :: 37.674 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 :: 8.513 HA :: 3.692 HB2 :: 2.282 HB3 :: 2.492 HG2 :: 2.016 HG3 :: 2.178 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 :: 120.833 Ave N Shift Values>> N :: 120.68(3.68) 1.K82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.38 K 0.35 R 0.22 M 0.02 G 0.01 C Shift Assignments>> C :: 178.725 CA :: 59.811 CB :: 33.072 CG :: 25.129 CD :: 30.043 CE :: 42.360 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 :: 7.912 HA :: 3.981 HB2 :: 1.978 HB3 :: 2.012 HG2 :: 1.403 HG3 :: 1.607 HD2 :: 1.735 HD3 :: 1.692 HE2 :: 3.029 HE3 :: 3.000 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 :: 118.836 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.K83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.38 K 0.36 R 0.19 M 0.03 G 0.01 C Shift Assignments>> CA :: 59.314 CB :: 32.685 CG :: 24.792 CD :: 30.018 CE :: 42.407 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 :: 7.736 HA :: 4.043 HB2 :: 1.853 HB3 :: 2.030 HG2 :: 1.359 HG3 :: 1.467 HD3 :: 1.735 HE2 :: 2.976 HE3 :: 2.976 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 :: 120.533 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.L84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.61 C 0.34 R 0.02 G 0.01 HN Overlap>> 1.F68 1.F68 C Shift Assignments>> C :: 178.543 CA :: 58.334 CB :: 41.968 CG :: 26.323 CD1 :: 24.055 CD2 :: 24.300 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 :: 8.188 HA :: 3.892 HB2 :: 1.356 HB3 :: 0.629 HG :: 0.833 HD11 :: 0.194 HD12 :: 0.194 HD13 :: 0.194 HD21 :: 0.214 HD22 :: 0.214 HD23 :: 0.214 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 :: 121.096 Ave N Shift Values>> N :: 121.98(4.07) 1.R85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.45 G 0.35 R 0.17 K 0.01 C Shift Assignments>> C :: 179.212 CA :: 59.197 CB :: 30.961 CG :: 29.710 CD :: 44.621 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 :: 7.758 HA :: 4.279 HB2 :: 2.043 HB3 :: 2.135 HG2 :: 2.216 HG3 :: 2.216 HD2 :: 3.230 HD3 :: 3.357 HE :: 6.917 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 :: 114.363 NE :: 84.517 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.E86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.37 C 0.35 I 0.11 M 0.06 K 0.05 Q 0.02 HN Overlap>> 1.D137 1.D137 C Shift Assignments>> C :: 179.007 CA :: 58.139 CB :: 30.152 CG :: 36.574 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 :: 7.840 HA :: 4.117 HB2 :: 2.158 HB3 :: 2.013 HG2 :: 2.256 HG3 :: 2.517 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 :: 118.006 Ave N Shift Values>> N :: 120.68(3.68) 1.D87 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.16 F 0.16 L 0.16 D 0.14 Y 0.13 C 0.13 R 0.03 N 0.02 I 0.02 C Shift Assignments>> C :: 177.421 CA :: 56.485 CB :: 40.989 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 :: 8.806 HA :: 4.172 HB2 :: 2.477 HB3 :: 1.723(S) 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 :: 120.709 Ave N Shift Values>> N :: 120.73(4.2) 1.F88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.5 F 0.49 HN Overlap>> 1.L150 1.L150 C Shift Assignments>> CA :: 55.793 CB :: 40.516 CD1 :: 133.204 CD2 :: 133.204 CE1 :: 131.467 CE2 :: 131.467 CZ :: 129.388 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 :: 8.115 HA :: 5.327 HB2 :: 3.550 HB3 :: 3.493 HD1 :: 7.361 HD2 :: 7.361 HE1 :: 7.336 HE2 :: 7.336 HZ :: 7.318 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 :: 116.549 Ave N Shift Values>> N :: 120.69(4.18) 1.P89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.88 C 0.11 C Shift Assignments>> C :: 177.553 CA :: 64.591 CB :: 32.495 CG :: 26.903 CD :: 50.500 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 :: 4.986 HB2 :: 2.491 HB3 :: 2.163 HG2 :: 2.062 HG3 :: 1.916 HD2 :: 3.696 HD3 :: 3.464 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.Q90 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.3 R 0.28 K 0.23 Q 0.11 M 0.03 C Shift Assignments>> CA :: 57.233 CB :: 27.337 CG :: 32.058 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 9.848 HA :: 4.179 HB2 :: 1.744 HB3 :: 1.818 HG2 :: 1.223(S) HG3 :: 1.999 HE21 :: 7.585 HE22 :: 7.104 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 121.094 NE2 :: 111.682 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.Y91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.63 C 0.36 HN Overlap>> 1.L174 1.L174 C Shift Assignments>> CA :: 54.792 CB :: 40.584 CD1 :: 133.070 CD2 :: 133.070 CE1 :: 117.491 CE2 :: 117.491 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 :: 7.497 HA :: 5.158 HB2 :: 2.402 HB3 :: 1.765 HD1 :: 7.077 HD2 :: 7.077 HE1 :: 6.554 HE2 :: 6.554 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 :: 119.311 Ave N Shift Values>> N :: 120.79(4.69) 1.Q92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.29 C 0.27 K 0.25 E 0.08 R 0.05 M 0.03 C Shift Assignments>> CA :: 53.982 CB :: 28.446 CG :: 34.096 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.782 HA :: 4.680 HB2 :: 2.213 HB3 :: 2.034 HG2 :: 2.374 HG3 :: 2.430 HE21 :: 6.706 HE22 :: 7.667 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 121.527 NE2 :: 112.846 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.W93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.54 W 0.39 H 0.06 C Shift Assignments>> CA :: 58.580 CB :: 32.180 CD1 :: 129.215 CE3 :: 120.864 CZ2 :: 113.972 CZ3 :: 121.065 CH2 :: 124.223 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 7.782 HA :: 4.840 HB2 :: 3.176 HB3 :: 2.983 HD1 :: 7.394 HE1 :: 11.125 HE3 :: 7.400 HZ2 :: 7.320 HZ3 :: 6.703 HH2 :: 6.846 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 123.035 NE1 :: 132.328 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.E94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.35 M 0.3 E 0.22 Q 0.08 K 0.02 C Shift Assignments>> CA :: 55.585 CB :: 32.090 CG :: 35.336 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 :: 9.365 HA :: 4.872 HB2 :: 2.141 HB3 :: 2.141 HG2 :: 2.392 HG3 :: 2.201 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 :: 124.539 Ave N Shift Values>> N :: 120.68(3.68) 1.L95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.45 C 0.22 L 0.22 R 0.08 C Shift Assignments>> CA :: 53.985 CB :: 45.018 CG :: 28.327 CD1 :: 26.316 CD2 :: 24.411 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 :: 9.840 HA :: 5.557 HB2 :: 1.907 HB3 :: 1.130 HG :: 1.487 HD11 :: 0.806 HD12 :: 0.806 HD13 :: 0.806 HD21 :: 0.743 HD22 :: 0.743 HD23 :: 0.743 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 :: 128.150 Ave N Shift Values>> N :: 121.98(4.07) 1.K96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.42 R 0.26 K 0.22 G 0.07 C Shift Assignments>> CA :: 53.956 CB :: 35.967 CG :: 25.179 CD :: 28.770 CE :: 43.013 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 :: 8.730 HA :: 4.998 HB2 :: 1.693 HB3 :: 1.876 HG2 :: 1.470 HG3 :: 1.620 HD2 :: 1.934 HD3 :: 1.816 HE2 :: 3.101 HE3 :: 2.998 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 :: 122.936 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.N97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.58 C 0.17 D 0.14 Y 0.04 F 0.03 L 0.01 C Shift Assignments>> C :: 178.401 CA :: 51.307 CB :: 38.515 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 :: 9.125 HA :: 3.778 HB2 :: 2.497 HB3 :: 3.163 HD21 :: 6.145 HD22 :: 7.827 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 :: 124.506 ND2 :: 111.207 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.Q98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.29 E 0.25 K 0.18 Q 0.16 I 0.04 M 0.02 R 0.01 C Shift Assignments>> C :: 176.814 CA :: 57.161 CB :: 28.726 CG :: 35.303 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 9.863 HA :: 4.029 HB2 :: 2.645 HB3 :: 2.622 HG2 :: 2.231 HG3 :: 2.885 HE21 :: 6.243 HE22 :: 7.410 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 :: 123.111 NE2 :: 113.962 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.V99 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> V 0.86 C 0.12 C Shift Assignments>> C :: 175.456 CA :: 64.071 CB :: 32.113 CG1 :: 21.000 CG2 :: 20.523 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 :: 6.884 HA :: 3.620 HB :: 0.689(S) HG11 :: -0.264(S) HG12 :: -0.264(S) HG13 :: -0.264(S) HG21 :: 0.083 HG22 :: 0.083 HG23 :: 0.083 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 :: 119.381 Ave N Shift Values>> N :: 121.02(4.96) 1.Y100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.57 C 0.42 C Shift Assignments>> CA :: 56.650 CB :: 39.378 CD1 :: 133.006 CD2 :: 133.006 CE1 :: 118.664 CE2 :: 118.664 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 :: 7.098 HA :: 5.088 HB2 :: 3.577 HB3 :: 2.829 HD1 :: 7.268 HD2 :: 7.268 HE1 :: 6.841 HE2 :: 6.841 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 :: 113.637 Ave N Shift Values>> N :: 120.79(4.69) 1.M101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.48 C 0.37 A 0.14 C Shift Assignments>> CA :: 55.050 CB :: 32.313 CG :: 32.300 CE :: 16.550 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 :: 7.089 HA :: 5.000 HB2 :: 2.569 HB3 :: 2.617 HG2 :: 2.704 HG3 :: 2.214 HE1 :: 2.137 HE2 :: 2.137 HE3 :: 2.137 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 :: 114.595 Ave N Shift Values>> N :: 120.1(3.88) 1.H102 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.Q103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.25 K 0.25 Q 0.24 R 0.13 E 0.05 M 0.04 C Shift Assignments>> CA :: 56.967 CB :: 28.185 CG :: 33.130 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 :: 6.916 HA :: 3.960 HB2 :: 1.671 HB3 :: 1.490 HG2 :: 1.641 HG3 :: 1.844 HE21 :: 7.316 HE22 :: 6.758 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 :: 116.185 NE2 :: 110.787 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.H104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.35 H 0.35 C 0.29 C Shift Assignments>> CA :: 56.307 CB :: 30.228 CD2 :: 120.030 CE1 :: 138.622 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 :: 7.389 HA :: 4.601 HB2 :: 3.484 HB3 :: 3.103 HD2 :: 7.231 HE1 :: 8.053 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 :: 116.446 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.S105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 C 0.01 HN Overlap>> 1.K54 1.K54 C Shift Assignments>> CA :: 54.394 CB :: 64.430 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.788 HA :: 5.069 HB2 :: 3.888 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 116.708 Ave N Shift Values>> N :: 116.3(3.95) 1.P106 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 :: 176.985 CA :: 64.060 CB :: 32.800 CG :: 26.877 CD :: 51.379 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 :: 4.054 HB2 :: 1.485 HB3 :: 2.018 HG2 :: 1.921 HG3 :: 2.034 HD2 :: 4.054 HD3 :: 3.409 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.H107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.35 W 0.32 C 0.31 C Shift Assignments>> C :: 174.381 CA :: 55.750 CB :: 27.082 CD2 :: 120.519 CE1 :: 139.709 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 :: 8.948 HA :: 4.342 HB2 :: 3.354 HB3 :: 3.084 HD2 :: 7.295 HE1 :: 7.990 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 :: 117.976 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.T108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.96 C 0.03 HN Overlap>> 1.W179 1.W179 C Shift Assignments>> C :: 174.032 CA :: 63.652 CB :: 70.401 CG2 :: 21.530 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 :: 8.105 HA :: 4.444 HB :: 4.361 HG21 :: 1.483 HG22 :: 1.483 HG23 :: 1.483 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 :: 119.097 Ave N Shift Values>> N :: 115.7(5.05) 1.A109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.81 M 0.14 C 0.03 L 0.01 C Shift Assignments>> C :: 176.543 CA :: 51.654 CB :: 19.853 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.717 HA :: 4.247 HB1 :: 1.401 HB2 :: 1.401 HB3 :: 1.401 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 131.700 Ave N Shift Values>> N :: 123.23(3.7) 1.S110 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.179 CA :: 59.456 CB :: 63.002 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.676 HA :: 2.784(S) HB2 :: 3.510 HB3 :: 3.421 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 :: 112.604 Ave N Shift Values>> N :: 116.3(3.95) 1.Y111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.57 C 0.42 C Shift Assignments>> C :: 178.548 CA :: 55.773 CB :: 38.773 CD1 :: 133.014 CD2 :: 133.014 CE1 :: 118.180 CE2 :: 118.180 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 :: 8.889 HA :: 5.086 HB2 :: 3.301 HB3 :: 2.764 HD1 :: 7.323 HD2 :: 7.323 HE1 :: 6.570 HE2 :: 6.570 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 :: 124.264 Ave N Shift Values>> N :: 120.79(4.69) 1.T112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.92 C 0.07 C Shift Assignments>> C :: 174.623 CA :: 62.019 CB :: 69.742 CG2 :: 21.870 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 :: 9.733 HA :: 4.305 HB :: 4.321 HG21 :: 1.159 HG22 :: 1.159 HG23 :: 1.159 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 :: 109.591 Ave N Shift Values>> N :: 115.7(5.05) 1.S113 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 57.251 CB :: 63.871 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.185 HA :: 2.727(S) HB2 :: 3.969 HB3 :: 3.948 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 :: 114.150 Ave N Shift Values>> N :: 116.3(3.95) 1.S114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.956 CA :: 62.886 CB :: 62.886 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 9.257 HA :: 4.008 HB2 :: 4.047 HB3 :: 3.546 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 :: 118.980 Ave N Shift Values>> N :: 116.3(3.95) 1.R115 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> R 0.39 C 0.38 G 0.17 K 0.03 HN Overlap>> 1.I11 1.I11 C Shift Assignments>> C :: 178.534 CA :: 59.732 CB :: 29.570 CG :: 28.357 CD :: 43.803 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 :: 7.991 HA :: 3.061 HB2 :: 1.111 HB3 :: 1.157 HG2 :: -0.842(A) HG3 :: 1.017 HD2 :: 2.667 HD3 :: 2.558 HE :: 7.192 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 :: 121.729 NE :: 85.408 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.D116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.27 L 0.22 K 0.13 C 0.11 F 0.08 Y 0.06 D 0.05 G 0.02 C Shift Assignments>> C :: 178.234 CA :: 56.965 CB :: 42.933 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 :: 7.476 HA :: 4.079 HB2 :: 2.591 HB3 :: 2.499 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 :: 120.339 Ave N Shift Values>> N :: 120.73(4.2) 1.A117 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> M 0.49 A 0.4 C 0.04 I 0.02 V 0.01 L 0.01 C Shift Assignments>> C :: 180.501 CA :: 55.108 CB :: 19.103 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.049 HA :: 2.366(S) HB1 :: 0.972 HB2 :: 0.972 HB3 :: 0.972 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 119.179 Ave N Shift Values>> N :: 123.23(3.7) 1.M118 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.69 M 0.26 I 0.03 C Shift Assignments>> C :: 178.096 CA :: 58.721 CB :: 36.067 CG :: 33.359 CE :: 15.163 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 :: 8.125 HA :: 3.037 HB2 :: 1.945 HB3 :: 1.397 HG2 :: 2.179 HG3 :: 2.179 HE1 :: 0.067(S) HE2 :: 0.067(S) HE3 :: 0.067(S) 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 :: 115.682 Ave N Shift Values>> N :: 120.1(3.88) 1.S119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.971 CA :: 61.465 CB :: 63.145 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.790 HA :: 4.142 HB2 :: 4.072 HB3 :: 4.072 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 :: 109.986 Ave N Shift Values>> N :: 116.3(3.95) 1.K120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.9 M 0.07 K 0.02 C Shift Assignments>> C :: 176.348 CA :: 56.656 CB :: 32.934 CG :: 26.882 CD :: 32.931 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 :: 7.317 HA :: 4.407 HB2 :: 1.250 HB3 :: 1.228 HG2 :: 1.288 HG3 :: 0.575 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 :: 121.689 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.Y121 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 Y 0.48 H 0.01 C Shift Assignments>> CA :: 56.990 CB :: 36.951 CD1 :: 133.153 CD2 :: 133.153 CE1 :: 118.295 CE2 :: 118.295 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 :: 6.852 HA :: 5.001 HB2 :: 2.784 HB3 :: 2.995 HD1 :: 7.422 HD2 :: 7.422 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 :: 119.226 Ave N Shift Values>> N :: 120.79(4.69) 1.P122 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Indeterminable PRTL>> P 0.83 C 0.16 C Shift Assignments>> CA :: 65.520 CB :: 31.607 CG :: 28.319 CD :: 50.489 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 :: 2.956(S) HB2 :: 1.352 HB3 :: 1.864 HG2 :: 1.718 HG3 :: 1.915 HD2 :: 4.013 HD3 :: 3.498 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.E123 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Anomalous PRTL>> C 0.45 M 0.3 E 0.2 Q 0.02 C Shift Assignments>> CA :: 53.676 CB :: 32.171 CG :: 36.171 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 :: 6.246(S) HA :: 5.533 HB2 :: 2.360 HB3 :: 2.404 HG2 :: 2.268 HG3 :: 2.268 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 :: 106.670(A) Ave N Shift Values>> N :: 120.68(3.68) 1.R124 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.41 R 0.37 K 0.17 G 0.02 HN Overlap>> 1.K189 1.K189 C Shift Assignments>> C :: 179.939 CA :: 60.321 CB :: 29.740 CG :: 28.678 CD :: 42.399 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 :: 9.231 HA :: 3.682 HB2 :: 1.560 HB3 :: 1.576 HG2 :: 1.162 HG3 :: 0.587(S) HD2 :: 2.943 HD3 :: 2.943 HE :: 7.190 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 :: 123.172 NE :: 83.849 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.C125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.15 Q 0.14 R 0.12 H 0.12 W 0.11 C 0.11 E 0.1 L 0.05 I 0.03 M 0.02 C Shift Assignments>> C :: 176.512 CA :: 56.929 CB :: 28.416 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 8.693 HA :: 4.269 HB2 :: 2.811 HB3 :: 2.811 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 :: 113.317 Ave N Shift Values>> N :: 119.95(4.79) 1.T126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.79 T 0.19 C Shift Assignments>> CA :: 61.863 CB :: 68.722 CG2 :: 25.319 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 :: 7.237 HA :: 3.802 HB :: 4.224 HG21 :: 1.143 HG22 :: 1.143 HG23 :: 1.143 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 :: 117.105 Ave N Shift Values>> N :: 115.7(5.05) 1.A127 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.84 M 0.13 C 0.01 C Shift Assignments>> C :: 173.566 CA :: 51.157 CB :: 18.283 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.313 HA :: 4.636 HB1 :: 1.615 HB2 :: 1.615 HB3 :: 1.615 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 126.808 Ave N Shift Values>> N :: 123.23(3.7) 1.V128 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.6 V 0.37 A 0.01 C Shift Assignments>> C :: 172.608 CA :: 58.750 CB :: 33.783 CG1 :: 22.309 CG2 :: 19.883 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 :: 8.051 HA :: 5.234 HB :: 1.820 HG11 :: 0.652 HG12 :: 0.652 HG13 :: 0.652 HG21 :: 0.652 HG22 :: 0.652 HG23 :: 0.652 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 :: 120.712 Ave N Shift Values>> N :: 121.02(4.96) 1.G129 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.78 L 0.08 C 0.07 R 0.03 C Shift Assignments>> CA :: 45.347 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.559 HA2 :: 5.344(S) HA3 :: 3.511 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 111.103 Ave N Shift Values>> N :: 109.91(4.29) 1.L130 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.78 A 0.17 L 0.02 G 0.01 C Shift Assignments>> C :: 171.462 CA :: 53.582 CB :: 49.185(S) CG :: 27.034 CD1 :: 26.444 CD2 :: 23.159 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 :: 10.115 HA :: 5.756 HB2 :: 0.960 HB3 :: 1.500 HG :: 1.272 HD11 :: -0.307(S) HD12 :: -0.307(S) HD13 :: -0.307(S) HD21 :: 0.607 HD22 :: 0.607 HD23 :: 0.607 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 125.770 Ave N Shift Values>> N :: 121.98(4.07) 1.R131 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.43 R 0.3 K 0.16 G 0.09 C Shift Assignments>> C :: 174.242 CA :: 54.742 CB :: 33.322 CG :: 26.621 CD :: 43.314 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 :: 8.632 HA :: 4.900 HB2 :: 1.627 HB3 :: 1.627 HG2 :: 0.759 HG3 :: 0.759 HD2 :: 2.127(S) HD3 :: 1.318(S) HE :: 6.290 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 :: 119.062 NE :: 86.800 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) SRO Rule Breaks>> (HD3 > HB2 : 0.9950) (HD3 > HB3 : 0.9958) 1.L132 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.52 L 0.29 C 0.16 C Shift Assignments>> C :: 177.117 CA :: 53.081 CB :: 45.757 CG :: 26.772 CD1 :: 25.324 CD2 :: 24.404 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 :: 8.725 HA :: 4.908 HB2 :: 1.370 HB3 :: 1.285 HG :: 1.485 HD11 :: 0.515 HD12 :: 0.515 HD13 :: 0.515 HD21 :: 0.333 HD22 :: 0.333 HD23 :: 0.333 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 :: 120.388 Ave N Shift Values>> N :: 121.98(4.07) 1.N133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.52 D 0.2 C 0.16 Y 0.03 L 0.03 F 0.03 C Shift Assignments>> C :: 178.032 CA :: 50.767 CB :: 39.322 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 :: 8.551 HA :: 4.698 HB2 :: 2.657 HB3 :: 3.438 HD21 :: 7.374 HD22 :: 7.580 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 :: 121.549 ND2 :: 111.492 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.E134 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 E 0.3 I 0.26 K 0.06 Q 0.01 M 0.01 HN Overlap>> 1.E75 1.D148 1.E75 1.D148 C Shift Assignments>> C :: 177.525 CA :: 59.538 CB :: 29.063 CG :: 36.547 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 :: 8.968 HA :: 3.973 HB2 :: 2.038 HB3 :: 2.038 HG2 :: 2.345 HG3 :: 2.345 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 :: 118.531 Ave N Shift Values>> N :: 120.68(3.68) 1.E135 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.39 E 0.37 K 0.1 I 0.07 M 0.03 Q 0.02 C Shift Assignments>> C :: 175.672 CA :: 55.998 CB :: 29.067 CG :: 36.697 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 :: 7.585 HA :: 4.286 HB2 :: 2.194 HB3 :: 1.891 HG2 :: 2.194 HG3 :: 2.194 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 117.639 Ave N Shift Values>> N :: 120.68(3.68) 1.L136 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.63 L 0.35 C Shift Assignments>> C :: 175.243 CA :: 56.297 CB :: 38.518 CG :: 27.559 CD1 :: 25.290 CD2 :: 23.627 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 :: 8.037 HA :: 3.505 HB2 :: 1.997 HB3 :: 1.542 HG :: 1.385 HD11 :: 0.836 HD12 :: 0.836 HD13 :: 0.836 HD21 :: 0.770 HD22 :: 0.770 HD23 :: 0.770 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 :: 114.467 Ave N Shift Values>> N :: 121.98(4.07) 1.D137 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.26 D 0.24 C 0.12 R 0.12 K 0.07 N 0.05 G 0.05 F 0.03 Y 0.02 HN Overlap>> 1.E86 1.F152 1.E86 1.F152 1.T26 1.T26 C Shift Assignments>> C :: 176.076 CA :: 52.268 CB :: 42.697 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 :: 7.840 HA :: 4.644 HB2 :: 2.610 HB3 :: 2.452 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 :: 117.934 Ave N Shift Values>> N :: 120.73(4.2) 1.F138 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.49 C 0.29 Y 0.2 C Shift Assignments>> C :: 177.361 CA :: 57.432 CB :: 41.683 CD1 :: 131.564 CD2 :: 131.564 CE1 :: 131.641 CE2 :: 131.641 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 :: 8.380 HA :: 5.130 HB2 :: 2.861 HB3 :: 2.861 HD1 :: 7.121 HD2 :: 7.121 HE1 :: 7.235 HE2 :: 7.235 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 :: 118.215 Ave N Shift Values>> N :: 120.69(4.18) 1.E139 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.44 E 0.3 M 0.21 I 0.01 Q 0.01 C Shift Assignments>> C :: 173.783 CA :: 56.164 CB :: 32.176 CG :: 36.586 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 :: 9.096 HA :: 4.584 HB2 :: 1.777 HB3 :: 1.980 HG2 :: 2.339 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 :: 122.909 Ave N Shift Values>> N :: 120.68(3.68) 1.L140 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.58 L 0.18 C 0.17 R 0.02 A 0.02 C Shift Assignments>> C :: 175.922 CA :: 53.200 CB :: 45.279 CG :: 27.711 CD1 :: 23.672 CD2 :: 26.138 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 :: 8.652 HA :: 5.429 HB2 :: 1.906 HB3 :: 1.234 HG :: 1.483 HD11 :: 0.853 HD12 :: 0.853 HD13 :: 0.853 HD21 :: 0.812 HD22 :: 0.812 HD23 :: 0.812 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 127.840 Ave N Shift Values>> N :: 121.98(4.07) 1.Y141 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.57 C 0.42 C Shift Assignments>> C :: 173.859 CA :: 56.980 CB :: 39.459 CD1 :: 133.230 CD2 :: 133.182 CE1 :: 118.312 CE2 :: 118.312 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 :: 9.719 HA :: 4.756 HB2 :: 2.394 HB3 :: 1.965 HD1 :: 6.898 HD2 :: 6.898 HE1 :: 6.615 HE2 :: 6.615 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 :: 131.050 Ave N Shift Values>> N :: 120.79(4.69) 1.V142 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.74 A 0.14 V 0.1 C Shift Assignments>> CA :: 56.844 CB :: 32.660 CG1 :: 23.859 CG2 :: 19.663 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 :: 8.198 HA :: 4.710 HB :: 1.754 HG11 :: 0.768 HG12 :: 0.768 HG13 :: 0.768 HG21 :: 0.863 HG22 :: 0.863 HG23 :: 0.863 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 :: 117.974 Ave N Shift Values>> N :: 121.02(4.96) 1.P143 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Indeterminable PRTL>> P 0.79 C 0.19 G 0.01 C Shift Assignments>> CA :: 63.785 CB :: 30.636 CG :: 26.920 CD :: 48.882 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 :: 3.766 HB2 :: 0.901 HB3 :: 0.901 HG2 :: 1.107 HG3 :: 1.340 HD2 :: 3.481 HD3 :: 1.058(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) SRO Rule Breaks>> (HD3 > HG2 : 0.9928) (HD3 > HG3 : 0.9953) 1.Y144 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.52 C 0.47 C Shift Assignments>> CA :: 57.135 CB :: 37.800 CD1 :: 133.367 CD2 :: 133.367 CE1 :: 117.811 CE2 :: 117.811 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 :: 8.826 HA :: 4.768 HB2 :: 2.670 HB3 :: 3.504 HD1 :: 7.285 HD2 :: 7.285 HE1 :: 6.849 HE2 :: 6.849 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 117.384 Ave N Shift Values>> N :: 120.79(4.69) 1.G145 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.49 L 0.19 R 0.15 C 0.1 F 0.01 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.847 CA :: 44.571 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.742 HA2 :: 3.731 HA3 :: 4.569 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.500 Ave N Shift Values>> N :: 109.91(4.29) 1.L146 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.52 C 0.24 G 0.13 R 0.09 HN Overlap>> 1.E60 1.E60 C Shift Assignments>> C :: 178.303 CA :: 55.027 CB :: 43.708 CG :: 27.205 CD1 :: 25.186 CD2 :: 24.040 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 :: 8.663 HA :: 4.209 HB2 :: 1.639 HB3 :: 1.504 HG :: 1.643 HD11 :: 0.807 HD12 :: 0.807 HD13 :: 0.807 HD21 :: 0.747 HD22 :: 0.747 HD23 :: 0.747 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 :: 118.600 Ave N Shift Values>> N :: 121.98(4.07) 1.E147 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.63 C 0.25 E 0.09 C Shift Assignments>> C :: 178.056 CA :: 62.204 CB :: 29.179 CG :: 37.248 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 :: 8.784 HA :: 3.763 HB2 :: 2.163 HB3 :: 1.984 HG2 :: 2.279 HG3 :: 2.458 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 :: 120.980 Ave N Shift Values>> N :: 120.68(3.68) 1.D148 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.27 F 0.25 C 0.2 I 0.13 D 0.03 E 0.03 L 0.02 N 0.01 HN Overlap>> 1.E75 1.E75 1.E134 1.E134 C Shift Assignments>> C :: 179.003 CA :: 58.252 CB :: 39.099 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 :: 8.996 HA :: 4.230 HB2 :: 3.009 HB3 :: 2.543 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 :: 118.563 Ave N Shift Values>> N :: 120.73(4.2) 1.I149 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.93 C 0.06 C Shift Assignments>> C :: 179.093 CA :: 65.989 CB :: 37.993 CG1 :: 30.543 CG2 :: 18.125 CD1 :: 13.478 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 :: 7.260 HA :: 3.555 HB :: 1.744 HG12 :: 0.561 HG13 :: 0.608 HG21 :: 0.440 HG22 :: 0.440 HG23 :: 0.440 HD11 :: 0.613 HD12 :: 0.613 HD13 :: 0.613 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 :: 116.534 Ave N Shift Values>> N :: 121.6(4.72) 1.L150 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.55 C 0.35 R 0.07 HN Overlap>> 1.F88 1.F88 C Shift Assignments>> C :: 177.284 CA :: 57.094 CB :: 41.319 CG :: 27.105 CD1 :: 25.933 CD2 :: 23.044 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 :: 8.044 HA :: 3.790 HB2 :: 1.706 HB3 :: 1.492 HG :: 1.701 HD11 :: 0.807 HD12 :: 0.807 HD13 :: 0.807 HD21 :: 0.759 HD22 :: 0.759 HD23 :: 0.759 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 :: 116.469 Ave N Shift Values>> N :: 121.98(4.07) 1.N151 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.48 D 0.19 C 0.15 Y 0.06 F 0.05 L 0.03 C Shift Assignments>> C :: 174.886 CA :: 52.512 CB :: 38.896 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 :: 7.943 HA :: 4.931 HB2 :: 2.672 HB3 :: 2.994 HD21 :: 7.618 HD22 :: 7.014 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 :: 111.037 ND2 :: 113.600 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.F152 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.53 F 0.46 HN Overlap>> 1.D137 1.T26 1.D137 1.T26 C Shift Assignments>> C :: 173.328 CA :: 59.743 CB :: 36.216 CD1 :: 131.955 CD2 :: 131.955 CE1 :: 130.939 CE2 :: 130.939 CZ :: 128.760 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 7.920 HA :: 3.364 HB2 :: 2.901 HB3 :: 2.586 HD1 :: 6.329 HD2 :: 6.329 HE1 :: 6.878 HE2 :: 6.878 HZ :: 7.231 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 117.860 Ave N Shift Values>> N :: 120.69(4.18) 1.Q153 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.38 C 0.31 Q 0.15 E 0.11 K 0.03 HN Overlap>> 1.N45 1.N45 C Shift Assignments>> C :: 175.659 CA :: 54.449 CB :: 31.976 CG :: 34.283 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.695 HA :: 5.051 HB2 :: 1.722 HB3 :: 1.782 HG2 :: 2.087 HG3 :: 2.254 HE21 :: 7.344 HE22 :: 6.792 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 :: 114.927 NE2 :: 111.021 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.V154 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.73 C 0.26 C Shift Assignments>> C :: 173.646 CA :: 62.502 CB :: 32.729 CG1 :: 22.942 CG2 :: 21.363 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 :: 8.999 HA :: 4.274 HB :: 2.134 HG11 :: 1.285 HG12 :: 1.285 HG13 :: 1.285 HG21 :: 0.923 HG22 :: 0.923 HG23 :: 0.923 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 :: 126.006 Ave N Shift Values>> N :: 121.02(4.96) 1.R155 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.44 G 0.37 R 0.13 K 0.03 C Shift Assignments>> CA :: 53.239 CB :: 33.938 CG :: 26.489 CD :: 44.124 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 :: 9.104 HA :: 5.173 HB2 :: 1.928 HB3 :: 1.575 HG2 :: 1.759 HG3 :: 1.462 HD2 :: 3.242 HE :: 8.932 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 :: 127.601 NE :: 85.326 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.P156 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.63 C 0.36 C Shift Assignments>> CA :: 61.431 CB :: 31.685 CG :: 27.396 CD :: 49.891 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 5.280 HB2 :: 1.019 HB3 :: 1.681 HG2 :: 1.241 HG3 :: 1.609 HD2 :: 3.540 HD3 :: 3.419 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.T157 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.73 C 0.26 C Shift Assignments>> CA :: 60.483 CB :: 69.003 CG2 :: 23.302 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 :: 7.851 HA :: 3.805 HB :: 4.629 HG21 :: 1.049 HG22 :: 1.049 HG23 :: 1.049 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 :: 110.738 Ave N Shift Values>> N :: 115.7(5.05) 1.P158 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.82 C 0.17 C Shift Assignments>> CA :: 66.111 CB :: 31.865 CG :: 28.076 CD :: 50.142 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 :: 4.200 HB2 :: 2.466 HB3 :: 2.466 HG2 :: 2.380 HG3 :: 2.070 HD2 :: 3.826 HD3 :: 3.254 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.H159 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.48 W 0.38 H 0.13 C Shift Assignments>> C :: 179.057 CA :: 59.753 CB :: 32.521 CD2 :: 123.353 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 :: 8.487 HA :: 4.305 HB2 :: 3.569 HB3 :: 2.939 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 :: 113.209 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.F160 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.67 C 0.32 C Shift Assignments>> C :: 175.438 CA :: 63.007 CB :: 39.058 CD1 :: 132.279 CD2 :: 132.279 CE1 :: 132.009 CE2 :: 132.009 CZ :: 130.427 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 7.696 HA :: 3.633 HB2 :: 3.389 HB3 :: 2.955 HD1 :: 7.425 HD2 :: 7.425 HE1 :: 7.629 HE2 :: 7.629 HZ :: 7.638 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 :: 121.221 Ave N Shift Values>> N :: 120.69(4.18) 1.L161 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.47 C 0.29 R 0.13 G 0.09 C Shift Assignments>> C :: 179.191 CA :: 57.015 CB :: 43.453 CG :: 27.250 CD1 :: 25.400 CD2 :: 24.968 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 :: 7.809 HA :: 4.268 HB2 :: 1.538 HB3 :: 1.603 HG :: 1.509 HD11 :: 0.854 HD12 :: 0.854 HD13 :: 0.854 HD21 :: 0.960 HD22 :: 0.960 HD23 :: 0.960 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 :: 116.468 Ave N Shift Values>> N :: 121.98(4.07) 1.E162 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.34 C 0.33 M 0.13 K 0.07 Q 0.06 I 0.04 C Shift Assignments>> C :: 176.027 CA :: 57.024 CB :: 30.659 CG :: 35.962 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 :: 7.195 HA :: 4.106 HB2 :: 1.993 HB3 :: 2.141 HG2 :: 2.297 HG3 :: 2.381 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 :: 113.016 Ave N Shift Values>> N :: 120.68(3.68) 1.N163 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.31 R 0.19 D 0.14 C 0.12 G 0.11 K 0.04 F 0.02 Y 0.02 N 0.01 C Shift Assignments>> C :: 174.300 CA :: 53.312 CB :: 43.400 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 :: 7.371 HA :: 4.988 HB2 :: 2.637 HB3 :: 2.173 HD21 :: 7.985 HD22 :: 6.787 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 :: 117.424 ND2 :: 113.144 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.E164 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 E 0.3 I 0.28 K 0.04 M 0.01 Q 0.01 C Shift Assignments>> C :: 178.966 CA :: 60.197 CB :: 29.592 CG :: 36.499 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 :: 9.328 HA :: 4.034 HB2 :: 2.082 HB3 :: 2.042 HG2 :: 2.350 HG3 :: 2.378 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 :: 127.459 Ave N Shift Values>> N :: 120.68(3.68) 1.D165 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.25 Y 0.23 C 0.18 D 0.09 L 0.08 I 0.06 K 0.04 N 0.02 C Shift Assignments>> C :: 180.914 CA :: 57.455 CB :: 39.999 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 :: 7.975 HA :: 4.665 HB2 :: 2.977 HB3 :: 2.712 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 :: 120.461 Ave N Shift Values>> N :: 120.73(4.2) 1.R166 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.32 C 0.14 W 0.12 V 0.11 P 0.1 E 0.05 R 0.04 K 0.03 H 0.03 Q 0.02 C Shift Assignments>> CA :: 61.927 CB :: 29.493 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 :: 8.415 HA :: 3.944 HB2 :: 2.203 HB3 :: 1.069 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 :: 122.250 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.M167 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.57 M 0.37 A 0.04 C Shift Assignments>> C :: 180.465 CA :: 55.908 CB :: 29.373 CG :: 32.449 CE :: 15.440 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 :: 8.490 HA :: 5.149 HB2 :: 2.249 HB3 :: 2.153 HG2 :: 2.713 HG3 :: 3.049 HE1 :: 1.865 HE2 :: 1.865 HE3 :: 1.865 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 :: 119.925 Ave N Shift Values>> N :: 120.1(3.88) 1.E168 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 E 0.31 I 0.22 K 0.07 Q 0.03 M 0.01 C Shift Assignments>> C :: 179.729 CA :: 59.803 CB :: 29.318 CG :: 36.149 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 :: 8.199 HA :: 4.310 HB2 :: 2.264 HB3 :: 2.264 HG2 :: 2.358 HG3 :: 2.497 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 122.487 Ave N Shift Values>> N :: 120.68(3.68) 1.L169 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.42 C 0.35 R 0.18 K 0.02 C Shift Assignments>> C :: 179.110 CA :: 58.208 CB :: 41.884 CG :: 27.727 CD1 :: 26.256 CD2 :: 24.094 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 :: 7.611 HA :: 4.360 HB2 :: 2.393 HB3 :: 1.851 HG :: 1.794 HD11 :: 1.244 HD12 :: 1.244 HD13 :: 1.244 HD21 :: 1.125 HD22 :: 1.125 HD23 :: 1.125 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 122.717 Ave N Shift Values>> N :: 121.98(4.07) 1.Y170 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.43 C 0.28 F 0.27 C Shift Assignments>> C :: 177.778 CA :: 61.792 CB :: 39.323 CD2 :: 133.258 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 :: 9.107 HA :: 4.096 HB2 :: 3.869 HB3 :: 3.412 HD1 :: 6.870 HD2 :: 6.870 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 121.252 Ave N Shift Values>> N :: 120.79(4.69) 1.Q171 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 Q 0.23 K 0.23 E 0.13 R 0.05 M 0.03 I 0.02 HN Overlap>> 1.I28 1.I28 C Shift Assignments>> C :: 179.781 CA :: 58.629 CB :: 28.876 CG :: 34.002 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.338 HA :: 4.010 HB2 :: 2.278 HB3 :: 2.345 HG2 :: 2.706 HG3 :: 2.749 HE21 :: 7.322 HE22 :: 6.917 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 :: 116.433 NE2 :: 110.338 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.T172 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.98 C 0.01 HN Overlap>> 1.I28 1.I28 C Shift Assignments>> CA :: 66.060 CB :: 69.040 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 :: 8.479 HA :: 4.006 HB :: 4.357 HG21 :: 1.316 HG22 :: 1.316 HG23 :: 1.316 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 :: 116.414 Ave N Shift Values>> N :: 115.7(5.05) 1.R173 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L174 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.59 C 0.34 R 0.04 HN Overlap>> 1.Y91 1.Y91 C Shift Assignments>> CA :: 57.518 CB :: 41.549 CG :: 26.838 CD1 :: 25.093 CD2 :: 23.845 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 :: 7.501 HA :: 3.560 HB2 :: 1.500 HB3 :: 1.214 HG :: 1.298 HD11 :: 0.507 HD12 :: 0.507 HD13 :: 0.507 HD21 :: 0.485 HD22 :: 0.485 HD23 :: 0.485 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 :: 119.320 Ave N Shift Values>> N :: 121.98(4.07) 1.S175 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 60.180 CB :: 63.022 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.630 HA :: 4.190 HB2 :: 3.877 HB3 :: 3.877 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 :: 114.260 Ave N Shift Values>> N :: 116.3(3.95) 1.K176 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.38 C 0.37 R 0.2 M 0.02 G 0.01 C Shift Assignments>> CA :: 56.600 CB :: 33.005 CG :: 24.877 CD :: 28.937 CE :: 42.317 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 :: 7.307 HA :: 4.205 HB2 :: 1.841 HB3 :: 1.841 HG2 :: 1.248 HG3 :: 1.320 HD2 :: 1.549 HD3 :: 1.549 HE2 :: 2.904 HE3 :: 2.871 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 119.618 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.K177 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.35 C 0.33 R 0.27 M 0.02 G 0.01 C Shift Assignments>> CA :: 56.498 CB :: 32.175 CG :: 24.640 CD :: 28.674 CE :: 42.378 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 :: 7.605 HA :: 4.081 HB2 :: 1.353 HB3 :: 1.353 HG2 :: 1.216 HG3 :: 1.216 HD2 :: 1.257 HD3 :: 1.300 HE2 :: 2.782 HE3 :: 2.699 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 :: 118.371 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.N178 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.44 C 0.2 D 0.11 Y 0.09 F 0.06 E 0.03 L 0.01 M 0.01 C Shift Assignments>> CA :: 53.468 CB :: 38.000 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 :: 8.083 HA :: 4.736 HB2 :: 2.916 HB3 :: 2.836 HD21 :: 7.544 HD22 :: 6.798 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 :: 116.843 ND2 :: 111.154 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.W179 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.5 W 0.48 HN Overlap>> 1.T108 1.T108 C Shift Assignments>> C :: 178.499 CA :: 58.798 CB :: 30.497 CD1 :: 124.301 CE3 :: 120.987 CZ2 :: 115.088 CZ3 :: 123.499 CH2 :: 124.201 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 :: 8.144 HA :: 4.837 HB2 :: 3.791 HB3 :: 3.455 HD1 :: 7.505 HE1 :: 10.510 HE3 :: 6.852 HZ2 :: 7.553 HZ3 :: 7.701 HH2 :: 6.912 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 :: 119.065 NE1 :: 129.115 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.Q180 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 Q 0.21 K 0.21 E 0.18 I 0.04 R 0.03 M 0.01 C Shift Assignments>> C :: 176.630 CA :: 57.604 CB :: 28.291 CG :: 34.737 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 9.408 HA :: 4.466 HB2 :: 2.212 HB3 :: 2.212 HG2 :: 2.453 HG3 :: 2.536 HE21 :: 6.845 HE22 :: 7.422 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 :: 117.650 NE2 :: 111.975 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.E181 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.37 C 0.35 I 0.11 K 0.07 M 0.04 Q 0.02 C Shift Assignments>> C :: 176.269 CA :: 57.907 CB :: 29.788 CG :: 36.538 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 :: 7.549 HA :: 4.042 HB2 :: 2.035 HB3 :: 2.035 HG2 :: 2.313 HG3 :: 2.245 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 :: 116.947 Ave N Shift Values>> N :: 120.68(3.68) 1.K182 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.38 C 0.37 R 0.19 M 0.03 C Shift Assignments>> C :: 176.817 CA :: 57.655 CB :: 32.495 CG :: 24.870 CD :: 29.185 CE :: 42.044 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 :: 7.140 HA :: 3.818 HB2 :: 0.819(S) HB3 :: 0.331(S) HG2 :: 0.484(S) HG3 :: 0.959 HD2 :: 1.219 HD3 :: 1.078 HE2 :: 2.686 HE3 :: 2.745 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 :: 118.487 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.W183 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.48 C 0.45 H 0.06 C Shift Assignments>> C :: 175.723 CA :: 57.770 CB :: 27.068 CD1 :: 125.004 CE3 :: 125.043 CZ2 :: 113.629 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 7.910 HA :: 4.753 HB2 :: 2.711 HB3 :: 2.952 HD1 :: 7.227 HE1 :: 9.774 HE3 :: 7.108 HZ2 :: 7.348 HZ3 :: 6.990 HH2 :: 7.692 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 :: 119.924 NE1 :: 127.206 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.K184 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.38 C 0.37 R 0.2 M 0.02 G 0.01 C Shift Assignments>> C :: 177.522 CA :: 58.237 CB :: 32.413 CG :: 24.832 CD :: 29.191 CE :: 42.187 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 :: 8.118 HA :: 4.382 HB2 :: 1.828 HB3 :: 1.716 HG2 :: 1.464 HG3 :: 1.367 HD2 :: 1.624 HD3 :: 1.624 HE2 :: 2.944 HE3 :: 3.018 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 :: 120.461 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.N185 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.36 C 0.3 E 0.08 M 0.07 Y 0.06 F 0.02 D 0.02 K 0.02 C Shift Assignments>> C :: 174.723 CA :: 52.953 CB :: 36.543 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 :: 8.781 HA :: 4.487 HB2 :: 2.497 HB3 :: 2.360 HD21 :: 7.082 HD22 :: 7.084 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 :: 114.046 ND2 :: 112.329 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.L186 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.31 L 0.3 G 0.22 R 0.08 K 0.06 C Shift Assignments>> C :: 177.129 CA :: 56.202 CB :: 44.301 CG :: 28.257 CD2 :: 24.402 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 :: 7.219 HA :: 4.369 HB2 :: 1.597 HB3 :: 0.849 HG :: 0.771 HD21 :: -0.118 HD22 :: -0.118 HD23 :: -0.118 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 :: 120.424 Ave N Shift Values>> N :: 121.98(4.07) 1.I187 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.61 C 0.37 C Shift Assignments>> C :: 174.538 CA :: 59.372 CB :: 40.730 CG1 :: 27.011 CG2 :: 17.900 CD1 :: 13.108 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 :: 8.318 HA :: 4.438 HB :: 1.824 HG12 :: 1.286 HG13 :: 1.579 HG21 :: 0.939 HG22 :: 0.939 HG23 :: 0.939 HD11 :: 0.896 HD12 :: 0.896 HD13 :: 0.896 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 :: 121.747 Ave N Shift Values>> N :: 121.6(4.72) 1.F188 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.58 C 0.41 C Shift Assignments>> C :: 176.207 CA :: 56.423 CB :: 39.794 CD1 :: 132.262 CD2 :: 132.262 CE1 :: 131.206 CE2 :: 131.206 CZ :: 129.406 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 :: 8.836 HA :: 5.206 HB2 :: 3.105 HB3 :: 3.055 HD1 :: 7.299 HD2 :: 7.299 HE1 :: 7.302 HE2 :: 7.302 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 :: 125.260 Ave N Shift Values>> N :: 120.69(4.18) 1.K189 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.44 K 0.27 R 0.25 G 0.01 HN Overlap>> 1.R124 1.R124 C Shift Assignments>> C :: 175.988 CA :: 54.604 CB :: 36.465 CG :: 25.080 CD :: 29.073 CE :: 42.224 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 :: 9.256 HA :: 4.842 HB2 :: 2.147 HB3 :: 1.958 HG2 :: 1.452 HG3 :: 1.452 HD2 :: 1.640 HD3 :: 1.680 HE2 :: 2.942 HE3 :: 2.942 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 :: 123.075 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.N190 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.36 D 0.24 C 0.14 Y 0.08 F 0.07 L 0.06 C Shift Assignments>> C :: 173.944 CA :: 53.414 CB :: 39.303 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 :: 4.860 HB2 :: 2.951 HB3 :: 2.793 HD21 :: 7.535 HD22 :: 6.833 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 :: 118.363 ND2 :: 111.458 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.T191 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>> CA :: 62.037 CB :: 71.580 CG2 :: 22.495 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 :: 7.302 HA :: 4.168 HB :: 4.281 HG21 :: 1.136 HG22 :: 1.136 HG23 :: 1.136 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 114.253 Ave N Shift Values>> N :: 115.7(5.05) ########################################################################### Overall Results: #Consistent: 168 #Clerical: 0 #Suspicious: 17 #Anomalous: 5 #Mistyped: 1 #Indeterminable: 0 Typing Results: #Consistent: 188 #Suspicious: 0 #Mistyped: 1 #Indeterminable: 2 Shift Relative Order (SRO) Results: #Consistent: 189 #Suspicious: 2 C Shift Results: #Consistent: 832 #Duplicate: 0 #Unknown: 0 #Suspicious: 2 #Anomalous: 0 H Shift Results: #Consistent:1351 #Duplicate: 0 #Unknown: 0 #Suspicious: 38 #Anomalous: 4 N Shift Results: #Consistent: 207 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 1 Error Summary: 1.D20 HB2 = 1.241(A), Expected = 2.74, Std = 0.2900, ChiSquare = 2.3539e-07 1.D20 HB3 = 1.241(S), Expected = 2.70, Std = 0.2900, ChiSquare = 4.8784e-07 1.L33 HD11 = -0.136(S), Expected = 0.77, Std = 0.2700, ChiSquare = 7.9206e-04 1.L33 HD12 = -0.136(S), Expected = 0.77, Std = 0.2700, ChiSquare = 7.9206e-04 1.L33 HD13 = -0.136(S), Expected = 0.77, Std = 0.2700, ChiSquare = 7.9206e-04 1.L33 HD21 = -0.241(S), Expected = 0.76, Std = 0.2800, ChiSquare = 3.5023e-04 1.L33 HD22 = -0.241(S), Expected = 0.76, Std = 0.2800, ChiSquare = 3.5023e-04 1.L33 HD23 = -0.241(S), Expected = 0.76, Std = 0.2800, ChiSquare = 3.5023e-04 1.S36 HA = 5.954(S), Expected = 4.51, Std = 0.4300, ChiSquare = 7.8469e-04 1.A39 Typing: Mistyped 1.A39 CB = 26.069(S), Expected = 18.90, Std = 1.8500, ChiSquare = 1.0657e-04 1.R44 HG2 = 0.232(S), Expected = 1.58, Std = 0.2700, ChiSquare = 5.9574e-07 1.R44 HG3 = -1.298(A), Expected = 1.58, Std = 0.2700, ChiSquare = 1.5785e-26 1.R44 HD2 = 1.862(S), Expected = 3.13, Std = 0.2300, ChiSquare = 3.5268e-08 1.R44 HD3 = 1.814(S), Expected = 3.13, Std = 0.2200, ChiSquare = 2.2066e-09 1.W48 HB2 = 1.457(S), Expected = 3.22, Std = 0.3600, ChiSquare = 9.7201e-07 1.W48 HD1 = 5.631(A), Expected = 7.16, Std = 0.3400, ChiSquare = 6.8900e-06 1.P56 HB3 = 0.512(S), Expected = 2.05, Std = 0.3900, ChiSquare = 8.0271e-05 1.D87 HB3 = 1.723(S), Expected = 2.70, Std = 0.2900, ChiSquare = 7.5451e-04 1.Q90 HG2 = 1.223(S), Expected = 2.32, Std = 0.2900, ChiSquare = 1.5510e-04 1.V99 HB = 0.689(S), Expected = 1.99, Std = 0.3300, ChiSquare = 8.0662e-05 1.V99 HG11 = -0.264(S), Expected = 0.84, Std = 0.2700, ChiSquare = 4.3344e-05 1.V99 HG12 = -0.264(S), Expected = 0.84, Std = 0.2700, ChiSquare = 4.3344e-05 1.V99 HG13 = -0.264(S), Expected = 0.84, Std = 0.2700, ChiSquare = 4.3344e-05 1.S110 HA = 2.784(S), Expected = 4.51, Std = 0.4300, ChiSquare = 5.9710e-05 1.S113 HA = 2.727(S), Expected = 4.51, Std = 0.4300, ChiSquare = 3.3758e-05 1.R115 HG2 = -0.842(A), Expected = 1.58, Std = 0.2700, ChiSquare = 2.9552e-19 1.A117 HA = 2.366(S), Expected = 4.26, Std = 0.4200, ChiSquare = 6.4973e-06 1.M118 HE1 = 0.067(S), Expected = 1.86, Std = 0.4700, ChiSquare = 1.3624e-04 1.M118 HE2 = 0.067(S), Expected = 1.86, Std = 0.4700, ChiSquare = 1.3624e-04 1.M118 HE3 = 0.067(S), Expected = 1.86, Std = 0.4700, ChiSquare = 1.3624e-04 1.P122 HA = 2.956(S), Expected = 4.41, Std = 0.3600, ChiSquare = 5.3705e-05 1.E123 H = 6.246(S), Expected = 8.34, Std = 0.6100, ChiSquare = 5.9741e-04 1.E123 N = 106.670(A), Expected = 120.68, Std = 3.6800, ChiSquare = 1.4063e-04 1.R124 HG3 = 0.587(S), Expected = 1.58, Std = 0.2700, ChiSquare = 2.3527e-04 1.G129 HA2 = 5.344(S), Expected = 3.95, Std = 0.4000, ChiSquare = 4.9214e-04 1.L130 CB = 49.185(S), Expected = 42.37, Std = 1.8600, ChiSquare = 2.4833e-04 1.L130 HD11 = -0.307(S), Expected = 0.77, Std = 0.2700, ChiSquare = 6.6384e-05 1.L130 HD12 = -0.307(S), Expected = 0.77, Std = 0.2700, ChiSquare = 6.6384e-05 1.L130 HD13 = -0.307(S), Expected = 0.77, Std = 0.2700, ChiSquare = 6.6384e-05 1.R131 HD2 = 2.127(S), Expected = 3.13, Std = 0.2300, ChiSquare = 1.2955e-05 1.R131 HD3 = 1.318(S), Expected = 3.13, Std = 0.2200, ChiSquare = 1.7752e-16 1.R131 SRO Rule Break>> HD3 > HB2 : 0.994991652754591 1.R131 SRO Rule Break>> HD3 > HB3 : 0.995794785534062 1.P143 HD3 = 1.058(S), Expected = 3.63, Std = 0.4000, ChiSquare = 1.2760e-10 1.P143 SRO Rule Break>> HD3 > HG2 : 0.992802519118309 1.P143 SRO Rule Break>> HD3 > HG3 : 0.995296331138288 1.K182 HB2 = 0.819(S), Expected = 1.79, Std = 0.2500, ChiSquare = 1.0275e-04 1.K182 HB3 = 0.331(S), Expected = 1.78, Std = 0.2600, ChiSquare = 2.5028e-08 1.K182 HG2 = 0.484(S), Expected = 1.38, Std = 0.2700, ChiSquare = 9.0496e-04