Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G4 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S5 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S6 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> G 0.89 L 0.08 C Shift Assignments>> C :: 172.619 CA :: 45.633 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 4.165 HA3 :: 4.089 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 1.V8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 175.752 CA :: 61.112 CB :: 33.976 CG1 :: 21.355 CG2 :: 21.956 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.822 HA :: 4.896 HB :: 1.870 HG11 :: 0.882 HG12 :: 0.882 HG13 :: 0.882 HG21 :: 0.628 HG22 :: 0.628 HG23 :: 0.628 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 120.717 Ave N Shift Values>> N :: 121.14(4.54) 1.R9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.64 R 0.26 K 0.09 C Shift Assignments>> C :: 173.893 CA :: 53.971 CB :: 35.202 CG :: 27.450 CD :: 43.720 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.074 HA :: 5.124 HB2 :: 1.969 HB3 :: 1.437 HG2 :: 1.723 HG3 :: 1.829 HD2 :: 3.352 HD3 :: 3.134 HE :: 8.581 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 123.896 NE :: 86.365 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.Y10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.78 G 0.21 C Shift Assignments>> C :: 174.670 CA :: 56.319 CB :: 43.270 CD1 :: 132.322 CD2 :: 132.322 CE1 :: 118.956 CE2 :: 118.956 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.850 HA :: 5.420 HB2 :: 2.802 HB3 :: 2.273 HD1 :: 6.610 HD2 :: 6.610 HE1 :: 6.419 HE2 :: 6.419 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 117.934 Ave N Shift Values>> N :: 120.52(4.2) 1.F11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.82 G 0.17 C Shift Assignments>> C :: 174.688 CA :: 56.028 CB :: 43.402 CD1 :: 131.981 CD2 :: 131.981 CE1 :: 130.353 CE2 :: 130.353 CZ :: 128.526 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 9.057 HA :: 5.403 HB2 :: 2.629 HB3 :: 2.532 HD1 :: 6.985 HD2 :: 6.985 HE1 :: 6.993 HE2 :: 6.993 HZ :: 6.943 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 119.094 Ave N Shift Values>> N :: 120.45(4.18) 1.I12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.98 A 0.01 C Shift Assignments>> C :: 174.850 CA :: 58.683 CB :: 38.287 CG1 :: 27.171 CG2 :: 16.507 CD1 :: 11.854 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.618 HA :: 4.905 HB :: 1.994 HG12 :: 1.527 HG13 :: 1.270 HG21 :: 0.908 HG22 :: 0.908 HG23 :: 0.908 HD11 :: 0.758 HD12 :: 0.758 HD13 :: 0.758 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 121.395 Ave N Shift Values>> N :: 121.46(4.28) 1.M13 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.81 M 0.18 HN Overlap>> 1.V53 1.V53 C Shift Assignments>> C :: 175.466 CA :: 52.168 CB :: 35.308 CG :: 33.009 CE :: 18.753 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.939 HA :: 5.223 HB2 :: 1.718 HB3 :: 0.802(S) HG2 :: 1.786 HE1 :: 2.133 HE2 :: 2.133 HE3 :: 2.133 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 125.032 Ave N Shift Values>> N :: 120.09(3.57) 1.K14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.84 R 0.11 A 0.03 G 0.01 C Shift Assignments>> C :: 176.883 CA :: 52.633 CB :: 33.891 CG :: 24.296 CD :: 28.106 CE :: 41.754 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.676 HA :: 5.710 HB2 :: 1.892 HB3 :: 1.803 HG2 :: 1.717 HG3 :: 1.418 HD2 :: 1.839 HD3 :: 1.839 HE2 :: 3.079 HE3 :: 3.037 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 121.068 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.S15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 1.S24 1.S24 C Shift Assignments>> C :: 175.628 CA :: 55.478 CB :: 65.353 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.254 HA :: 5.314 HB2 :: 4.074 HB3 :: 3.873 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 113.539 Ave N Shift Values>> N :: 116.28(3.52) 1.S16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> C :: 174.258 CA :: 60.649 CB :: 63.247 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.298 HA :: 4.459 HB2 :: 4.035 HB3 :: 4.035 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) 1.N17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.39 N 0.26 L 0.17 F 0.06 Y 0.04 K 0.04 C Shift Assignments>> C :: 175.195 CA :: 52.617 CB :: 40.814 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.625 HA :: 4.863 HB2 :: 3.044 HB3 :: 3.110 HD21 :: 6.573 HD22 :: 7.471 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 113.822 ND2 :: 112.230 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.L18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.92 R 0.05 G 0.02 C Shift Assignments>> C :: 178.475 CA :: 57.387 CB :: 42.356 CG :: 27.157 CD1 :: 24.631 CD2 :: 24.109 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.630 HA :: 4.180 HB2 :: 1.707 HB3 :: 1.631 HG :: 1.647 HD11 :: 0.890 HD12 :: 0.890 HD13 :: 0.890 HD21 :: 0.943 HD22 :: 0.943 HD23 :: 0.943 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) 1.R19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.63 K 0.2 L 0.08 G 0.07 C Shift Assignments>> C :: 178.481 CA :: 58.793 CB :: 28.915 CG :: 26.753 CD :: 43.054 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.339 HA :: 4.127 HB2 :: 1.914 HB3 :: 1.784 HG2 :: 1.698 HG3 :: 1.652 HD2 :: 3.342 HD3 :: 3.150 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 122.731 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.N20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.27 Y 0.22 F 0.15 N 0.13 M 0.08 I 0.04 D 0.03 K 0.02 L 0.01 C Shift Assignments>> C :: 178.355 CA :: 56.091 CB :: 37.222 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.688 HA :: 4.704 HB2 :: 3.059 HB3 :: 2.912 HD21 :: 7.047 HD22 :: 7.109 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 116.012 ND2 :: 108.804 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.L21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.91 R 0.06 C Shift Assignments>> C :: 178.290 CA :: 57.294 CB :: 41.044 CG :: 27.566 CD1 :: 26.347 CD2 :: 24.555 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.256 HA :: 4.197 HB2 :: 1.894 HB3 :: 1.574 HG :: 1.696 HD11 :: 0.857 HD12 :: 0.857 HD13 :: 0.857 HD21 :: 0.725 HD22 :: 0.725 HD23 :: 0.725 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.428 Ave N Shift Values>> N :: 121.86(3.9) 1.E22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.48 I 0.38 K 0.08 Q 0.03 M 0.01 C Shift Assignments>> C :: 179.959 CA :: 59.852 CB :: 29.248 CG :: 36.489 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.989 HA :: 3.706 HB2 :: 2.257 HB3 :: 2.012 HG2 :: 2.303 HG3 :: 2.034 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 121.172 Ave N Shift Values>> N :: 120.67(3.48) 1.I23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 178.247 CA :: 65.153 CB :: 38.059 CG1 :: 28.757 CG2 :: 17.323 CD1 :: 13.508 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.305 HA :: 3.687 HB :: 2.040 HG12 :: 1.026 HG13 :: 1.748 HG21 :: 0.554 HG22 :: 0.554 HG23 :: 0.554 HD11 :: 0.809 HD12 :: 0.809 HD13 :: 0.809 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.142 Ave N Shift Values>> N :: 121.46(4.28) 1.S24 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> S 0.98 T 0.01 HN Overlap>> 1.S15 1.S15 C Shift Assignments>> C :: 178.932 CA :: 61.942 CB :: 64.366 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.233 HA :: 4.674 HB2 :: 4.951(S) HB3 :: 4.431 HG :: 5.261 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 113.572 Ave N Shift Values>> N :: 116.28(3.52) 1.Q25 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> R 0.41 K 0.3 Q 0.24 M 0.01 C Shift Assignments>> C :: 178.032 CA :: 58.050 CB :: 26.637 CG :: 32.786 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.166 HA :: 3.132 HB2 :: 1.708 HB3 :: 1.188 HG2 :: 1.339(S) HG3 :: -0.391(S) HE21 :: 3.867(S) HE22 :: 6.618 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 116.624 NE2 :: 106.992 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.Q26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.39 K 0.38 E 0.08 M 0.06 R 0.05 I 0.01 C Shift Assignments>> C :: 178.228 CA :: 58.230 CB :: 29.281 CG :: 33.632 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.980 HA :: 4.138 HB2 :: 2.157 HB3 :: 2.110 HG2 :: 2.491 HG3 :: 2.290 HE21 :: 6.731 HE22 :: 7.415 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 119.230 NE2 :: 110.992 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.K27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.53 R 0.45 C Shift Assignments>> C :: 177.135 CA :: 56.917 CB :: 34.998 CG :: 26.249 CD :: 29.371 CE :: 41.988 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.601 HA :: 4.459 HB2 :: 1.881 HB3 :: 1.689 HG2 :: 1.542 HG3 :: 1.351 HD2 :: 1.515 HD3 :: 1.459 HE2 :: 2.848 HE3 :: 2.848 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 114.951 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.G28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.65 P 0.16 A 0.09 L 0.03 N 0.03 C Shift Assignments>> C :: 175.423 CA :: 47.898 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.845 HA2 :: 4.217 HA3 :: 4.147 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 112.335 Ave N Shift Values>> N :: 109.67(3.87) 1.I29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.96 I 0.01 A 0.01 C Shift Assignments>> C :: 175.797 CA :: 58.911 CB :: 44.876 CG1 :: 24.652 CG2 :: 18.424 CD1 :: 13.520 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.069 HA :: 5.752 HB :: 1.863 HG12 :: 1.535 HG13 :: 1.532 HG21 :: 0.833 HG22 :: 0.833 HG23 :: 0.833 HD11 :: 0.569 HD12 :: 0.569 HD13 :: 0.569 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 109.837 Ave N Shift Values>> N :: 121.46(4.28) 1.W30 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> W 0.99 C Shift Assignments>> C :: 170.722 CA :: 55.376 CB :: 33.037 CD1 :: 126.218 CE3 :: 122.645 CZ2 :: 114.631 CZ3 :: 120.896 CH2 :: 123.959 Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 9.092 HA :: 4.965 HB2 :: 2.855 HB3 :: 1.787(S) HD1 :: 6.966 HE1 :: 10.838 HE3 :: 7.972 HZ2 :: 7.630 HZ3 :: 6.974 HH2 :: 7.319 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 122.375 NE1 :: 132.775 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.S31 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Indeterminable PRTL>> S 0.65 T 0.34 C Shift Assignments>> C :: 171.154 CA :: 58.179 CB :: 66.834 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> HA :: 4.535 HB2 :: 3.233 HB3 :: 2.863(S) HG :: 5.755 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) 1.T32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.82 T 0.17 C Shift Assignments>> C :: 173.194 CA :: 58.229 CB :: 71.697 CG2 :: 18.365 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 9.967 HA :: 4.887 HB :: 4.157 HG1 :: 6.570 HG21 :: 1.299 HG22 :: 1.299 HG23 :: 1.299 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 119.756 Ave N Shift Values>> N :: 115.42(4.75) 1.T33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.195 CA :: 60.149 CB :: 68.640 CG2 :: 22.672 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.446 HA :: 4.581 HB :: 4.514 HG1 :: 3.832 HG21 :: 1.372 HG22 :: 1.372 HG23 :: 1.372 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 114.610 Ave N Shift Values>> N :: 115.42(4.75) 1.P34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> CA :: 65.917 CB :: 32.014 CG :: 28.051 CD :: 51.042 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.241 HB2 :: 1.977 HB3 :: 2.431 HG2 :: 1.829 HG3 :: 2.173 HD2 :: 3.847 HD3 :: 3.847 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.S35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> C :: 175.985 CA :: 60.867 CB :: 62.493 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> HA :: 4.232 HB2 :: 3.959 HB3 :: 3.919 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) 1.N36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.43 D 0.27 F 0.09 L 0.09 Y 0.08 HN Overlap>> 1.L137 1.L137 C Shift Assignments>> C :: 175.940 CA :: 53.510 CB :: 39.482 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.900 HA :: 4.876 HB2 :: 2.946 HB3 :: 2.534 HD21 :: 5.805 HD22 :: 6.975 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.719 ND2 :: 110.674 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.56 E 0.38 K 0.03 M 0.01 C Shift Assignments>> C :: 177.334 CA :: 60.243 CB :: 29.517 CG :: 37.208 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.858 HA :: 3.508 HB2 :: 2.149 HB3 :: 1.886 HG2 :: 2.536 HG3 :: 2.089 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.342 Ave N Shift Values>> N :: 120.67(3.48) 1.R38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.74 G 0.2 K 0.02 L 0.01 C Shift Assignments>> C :: 179.312 CA :: 59.744 CB :: 29.365 CG :: 27.585 CD :: 43.559 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.192 HA :: 4.014 HG2 :: 1.796 HG3 :: 1.652 HD2 :: 3.253 HD3 :: 3.253 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 117.908 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.K39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.9 R 0.08 G 0.01 C Shift Assignments>> C :: 178.768 CA :: 58.749 CB :: 32.051 CG :: 24.207 CD :: 30.048 CE :: 42.015 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.064 HA :: 4.081 HB2 :: 1.935 HB3 :: 1.750 HG2 :: 1.435 HG3 :: 1.350 HD2 :: 1.877 HD3 :: 1.877 HE2 :: 3.087 HE3 :: 3.087 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 118.460 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.88 R 0.06 A 0.04 C Shift Assignments>> C :: 178.002 CA :: 57.486 CB :: 41.255 CG :: 27.675 CD1 :: 25.316 CD2 :: 21.753 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.538 HA :: 3.485 HB2 :: 1.266 HB3 :: 0.803 HG :: 1.105 HD11 :: 0.286 HD12 :: 0.286 HD13 :: 0.286 HD21 :: -0.219 HD22 :: -0.219 HD23 :: -0.219 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.566 Ave N Shift Values>> N :: 121.86(3.9) 1.N41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.27 N 0.23 Y 0.15 M 0.11 F 0.1 D 0.02 K 0.02 I 0.02 C Shift Assignments>> C :: 177.005 CA :: 55.154 CB :: 36.924 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.279 HA :: 4.200 HB2 :: 2.595 HB3 :: 1.929 HD21 :: 6.854 HD22 :: 7.308 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 118.281 ND2 :: 107.620 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.R42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.76 G 0.18 K 0.03 L 0.01 C Shift Assignments>> C :: 178.235 CA :: 59.543 CB :: 29.455 CG :: 27.585 CD :: 43.513 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.595 HA :: 4.126 HB2 :: 1.891 HG2 :: 1.817 HG3 :: 1.662 HD2 :: 3.260 HD3 :: 3.260 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 116.506 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.A43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.54 A 0.39 I 0.04 C Shift Assignments>> C :: 178.991 CA :: 55.431 CB :: 18.400 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.619 HA :: 4.077 HB1 :: 1.508 HB2 :: 1.508 HB3 :: 1.508 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 118.897 Ave N Shift Values>> N :: 123.23(3.54) 1.F44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.99 C Shift Assignments>> C :: 177.799 CA :: 61.762 CB :: 38.211 CD1 :: 130.954 CD2 :: 130.954 CE1 :: 131.058 CE2 :: 131.058 CZ :: 128.604 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.703 HA :: 3.773 HB2 :: 3.416 HB3 :: 2.772 HD1 :: 6.387 HD2 :: 6.387 HE1 :: 6.806 HE2 :: 6.806 HZ :: 6.911 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 120.009 Ave N Shift Values>> N :: 120.45(4.18) 1.W45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.99 C Shift Assignments>> C :: 178.589 CA :: 58.675 CB :: 29.603 CD1 :: 126.446 CE3 :: 121.264 CZ2 :: 114.422 CZ3 :: 121.569 CH2 :: 124.364 Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 8.172 HA :: 4.483 HB2 :: 3.323 HB3 :: 3.323 HD1 :: 7.411 HE1 :: 10.397 HE3 :: 7.626 HZ2 :: 7.411 HZ3 :: 7.117 HH2 :: 7.246 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 116.279 NE1 :: 128.382 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.E46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.64 M 0.26 Q 0.03 I 0.03 K 0.02 C Shift Assignments>> C :: 176.857 CA :: 56.981 CB :: 31.165 CG :: 36.617 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.025 HA :: 4.423 HB2 :: 2.139 HB3 :: 2.061 HG2 :: 2.583 HG3 :: 2.362 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 115.918 Ave N Shift Values>> N :: 120.67(3.48) 1.S47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.127 CA :: 58.047 CB :: 64.194 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.596 HA :: 4.767 HB2 :: 3.867 HB3 :: 3.435 HG :: 5.278 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 114.555 Ave N Shift Values>> N :: 116.28(3.52) 1.S48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.996 CA :: 61.023 CB :: 62.867 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.839 HA :: 4.136 HB2 :: 3.822 HB3 :: 3.788 HG :: 6.161 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 120.925 Ave N Shift Values>> N :: 116.28(3.52) 1.I49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.93 G 0.06 C Shift Assignments>> C :: 172.716 CA :: 61.205 CB :: 42.513 CG1 :: 27.522 CG2 :: 16.447 CD1 :: 13.873 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.095 HA :: 3.905 HB :: 1.311 HG12 :: 1.270 HG13 :: 0.598 HG21 :: 0.002 HG22 :: 0.002 HG23 :: 0.002 HD11 :: 0.687 HD12 :: 0.687 HD13 :: 0.687 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.712 Ave N Shift Values>> N :: 121.46(4.28) 1.V50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 175.081 CA :: 60.879 CB :: 33.493 CG1 :: 21.762 CG2 :: 21.925 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.452 HA :: 4.397 HB :: 1.973 HG11 :: 0.799 HG12 :: 0.799 HG13 :: 0.799 HG21 :: 0.834 HG22 :: 0.834 HG23 :: 0.834 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 125.947 Ave N Shift Values>> N :: 121.14(4.54) 1.Y51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.99 C Shift Assignments>> C :: 174.669 CA :: 57.573 CB :: 40.948 CD1 :: 132.930 CD2 :: 132.930 CE1 :: 117.513 CE2 :: 117.513 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 9.030 HA :: 5.319 HB2 :: 2.607 HB3 :: 2.506 HD1 :: 6.559 HD2 :: 6.559 HE1 :: 6.561 HE2 :: 6.561 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 125.865 Ave N Shift Values>> N :: 120.52(4.2) 1.L52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.77 G 0.1 R 0.09 A 0.02 C Shift Assignments>> C :: 174.668 CA :: 52.242 CB :: 42.934 CG :: 26.850 CD1 :: 26.557 CD2 :: 24.165 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.948 HA :: 5.170 HB2 :: 1.529 HB3 :: 0.504 HG :: 1.446 HD11 :: 0.874 HD12 :: 0.874 HD13 :: 0.874 HD21 :: 0.808 HD22 :: 0.808 HD23 :: 0.808 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.986 Ave N Shift Values>> N :: 121.86(3.9) 1.V53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> 1.M13 1.M13 C Shift Assignments>> C :: 174.935 CA :: 60.988 CB :: 32.763 CG1 :: 22.085 CG2 :: 20.062 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.982 HA :: 4.423 HB :: 1.861 HG11 :: 0.897 HG12 :: 0.897 HG13 :: 0.897 HG21 :: 0.612 HG22 :: 0.612 HG23 :: 0.612 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 125.021 Ave N Shift Values>> N :: 121.14(4.54) 1.F54 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> F 0.81 G 0.18 C Shift Assignments>> C :: 177.567 CA :: 57.886 CB :: 43.384 CD1 :: 131.608 CD2 :: 131.608 CE1 :: 130.095 CE2 :: 130.095 CZ :: 127.511 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.451 HA :: 5.598 HB2 :: 2.940 HB3 :: 2.655 HD1 :: 6.367 HD2 :: 6.367 HE1 :: 5.236(S) HE2 :: 5.236(S) HZ :: 5.818 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 125.537 Ave N Shift Values>> N :: 120.45(4.18) SRO Rule Breaks>> (HE1 > HA : 0.9973) (HE2 > HA : 0.9969) 1.S55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.97 T 0.02 C Shift Assignments>> C :: 174.940 CA :: 56.906 CB :: 65.731 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.696 HA :: 5.650 HB2 :: 4.197 HB3 :: 3.544 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 112.125 Ave N Shift Values>> N :: 116.28(3.52) 1.V56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 177.345 CA :: 61.698 CB :: 32.009 CG1 :: 20.585 CG2 :: 22.787 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.562 HA :: 4.607 HB :: 1.810 HG11 :: 0.886 HG12 :: 0.886 HG13 :: 0.886 HG21 :: 0.936 HG22 :: 0.936 HG23 :: 0.936 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 130.254 Ave N Shift Values>> N :: 121.14(4.54) 1.Q57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.39 Q 0.33 R 0.14 M 0.08 E 0.02 C Shift Assignments>> C :: 173.593 CA :: 57.451 CB :: 28.729 CG :: 32.905 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 9.041 HA :: 4.403 HB2 :: 2.218 HB3 :: 2.151 HG2 :: 2.559 HG3 :: 2.471 HE21 :: 7.033 HE22 :: 7.695 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 131.564 NE2 :: 112.583 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.G58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> G 0.43 L 0.27 R 0.18 F 0.03 D 0.03 Y 0.02 C Shift Assignments>> C :: 173.862 CA :: 44.324 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.175 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 1.S59 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 :: 174.906 CA :: 59.645 CB :: 65.008 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.153 HA :: 4.427 HB2 :: 3.961 HB3 :: 3.628 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 113.750 Ave N Shift Values>> N :: 116.28(3.52) 1.G60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.91 L 0.07 C Shift Assignments>> C :: 172.378 CA :: 46.033 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.598 HA2 :: 3.988 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.254 Ave N Shift Values>> N :: 109.67(3.87) 1.H61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.67 F 0.2 H 0.09 Y 0.02 C Shift Assignments>> C :: 174.239 CA :: 55.242 CB :: 33.822 CD2 :: 130.227 CE1 :: 139.557 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 6.930 HA :: 4.499 HB2 :: 2.348 HB3 :: 2.781 HD2 :: 6.168 HE1 :: 7.670 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 116.247 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.F62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.99 C Shift Assignments>> C :: 176.869 CA :: 57.903 CB :: 41.578 CD1 :: 132.789 CD2 :: 132.789 CE1 :: 130.693 CE2 :: 130.693 CZ :: 128.745 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.958 HA :: 5.530 HB2 :: 3.789 HB3 :: 3.394 HD1 :: 7.385 HD2 :: 7.385 HE1 :: 7.053 HE2 :: 7.053 HZ :: 6.688 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 117.638 Ave N Shift Values>> N :: 120.45(4.18) 1.Q63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.37 E 0.19 K 0.16 R 0.13 I 0.13 C Shift Assignments>> CA :: 58.252 CB :: 27.032 CG :: 34.770 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.643 HA :: 4.569 HB2 :: 2.018 HB3 :: 2.144 HG2 :: 2.341 HG3 :: 2.341 HE21 :: 7.615 HE22 :: 7.095 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 126.686 NE2 :: 109.886 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.G64 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.4 L 0.28 R 0.2 F 0.03 D 0.03 Y 0.02 C Shift Assignments>> C :: 171.438 CA :: 44.266 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.387 HA2 :: 5.190(S) HA3 :: 3.550 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 101.245 Ave N Shift Values>> N :: 109.67(3.87) 1.F65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.53 Y 0.39 G 0.06 C Shift Assignments>> C :: 173.243 CA :: 55.764 CB :: 42.797 CZ :: 129.544 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.347 HA :: 5.581 HB2 :: 2.804 HB3 :: 2.607 HD1 :: 6.899 HD2 :: 6.899 HE1 :: 6.692 HE2 :: 6.801 HZ :: 7.106 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 109.557 Ave N Shift Values>> N :: 120.45(4.18) 1.S66 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> T 0.94 S 0.05 C Shift Assignments>> C :: 171.895 CA :: 56.155 CB :: 68.532 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.474 HA :: 5.048 HB2 :: 2.948(S) HB3 :: 2.259(S) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 115.289 Ave N Shift Values>> N :: 116.28(3.52) 1.R67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.57 G 0.31 K 0.11 C Shift Assignments>> C :: 176.436 CA :: 53.754 CB :: 33.598 CG :: 27.415 CD :: 43.587 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.755 HA :: 5.378 HB2 :: 1.714 HB3 :: 1.617 HG2 :: 1.447 HG3 :: 1.447 HD2 :: 3.197 HD3 :: 3.064 HE :: 7.124 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 118.755 NE :: 83.111 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.M68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.97 A 0.01 C Shift Assignments>> C :: 175.830 CA :: 58.252 CB :: 33.476 CG :: 32.347 CE :: 16.849 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.844 HA :: 4.367 HB2 :: 2.185 HB3 :: 1.637 HG2 :: 2.628 HG3 :: 2.384 HE1 :: 1.206 HE2 :: 1.206 HE3 :: 1.206 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 126.402 Ave N Shift Values>> N :: 120.09(3.57) 1.S69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.151 CA :: 58.502 CB :: 64.711 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.268 HA :: 4.995 HB2 :: 3.801 HB3 :: 3.583 HG :: 3.802 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 122.659 Ave N Shift Values>> N :: 116.28(3.52) 1.S70 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.69 S 0.3 C Shift Assignments>> C :: 181.737(S) CA :: 57.652 CB :: 67.521 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.638 HA :: 4.249 HB2 :: 4.213 HB3 :: 3.691 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 117.508 Ave N Shift Values>> N :: 116.28(3.52) 1.E71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.37 K 0.26 E 0.24 M 0.09 R 0.01 C Shift Assignments>> C :: 176.159 CA :: 54.214 CB :: 29.454 CG :: 34.871 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.952 HA :: 3.667 HB2 :: 2.158 HB3 :: 1.903 HG2 :: 2.230 HG3 :: 2.050 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 113.394 Ave N Shift Values>> N :: 120.67(3.48) 1.I72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 177.147 CA :: 63.391 CB :: 37.419 CG1 :: 27.597 CG2 :: 17.635 CD1 :: 14.283 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.591 HA :: 3.833 HB :: 1.549 HG12 :: 0.443 HG13 :: 0.915 HG21 :: 0.859 HG22 :: 0.859 HG23 :: 0.859 HD11 :: 0.355 HD12 :: 0.355 HD13 :: 0.355 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 123.842 Ave N Shift Values>> N :: 121.46(4.28) 1.G73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.77 L 0.15 R 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 173.420 CA :: 44.991 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.970 HA2 :: 4.458 HA3 :: 3.958 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 117.618 Ave N Shift Values>> N :: 109.67(3.87) 1.R74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.79 K 0.11 G 0.08 HN Overlap>> 1.K96 1.K96 C Shift Assignments>> C :: 177.251 CA :: 56.020 CB :: 31.036 CG :: 27.100 CD :: 43.226 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.469 HA :: 4.324 HB2 :: 1.950 HB3 :: 1.744 HG2 :: 1.666 HG3 :: 1.666 HD2 :: 3.213 HD3 :: 3.213 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 117.945 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.E75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.63 M 0.12 K 0.09 Q 0.07 I 0.05 C Shift Assignments>> C :: 175.846 CA :: 56.924 CB :: 30.150 CG :: 36.350 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.260 HA :: 4.235 HB2 :: 2.007 HB3 :: 2.007 HG2 :: 2.281 HG3 :: 2.285 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.609 Ave N Shift Values>> N :: 120.67(3.48) 1.K76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.77 R 0.2 G 0.02 C Shift Assignments>> C :: 176.660 CA :: 55.489 CB :: 33.545 CG :: 24.991 CD :: 29.044 CE :: 42.381 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.581 HA :: 4.481 HB2 :: 1.851 HB3 :: 1.670 HG2 :: 1.483 HG3 :: 1.363 HD2 :: 1.657 HD3 :: 1.657 HE2 :: 3.009 HE3 :: 3.009 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.297 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.S77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.152 CA :: 57.217 CB :: 64.166 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.553 HA :: 4.396 HB2 :: 3.733 HB3 :: 3.525 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 115.503 Ave N Shift Values>> N :: 116.28(3.52) 1.Q78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.4 K 0.37 M 0.11 R 0.05 E 0.05 C Shift Assignments>> C :: 176.172 CA :: 55.655 CB :: 29.374 CG :: 33.432 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> HA :: 4.317 HB2 :: 1.933 HB3 :: 1.767 HG2 :: 1.949 HG3 :: 1.949 HE21 :: 7.357 HE22 :: 6.805 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> NE2 :: 112.949 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.D79 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> D 0.25 L 0.22 F 0.16 K 0.13 Y 0.13 N 0.05 R 0.01 I 0.01 C Shift Assignments>> C :: 176.089 CA :: 55.666 CB :: 41.008 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.127 HA :: 4.305 HB2 :: 2.209 HB3 :: 1.737(S) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 119.906 Ave N Shift Values>> N :: 120.65(3.86) 1.W80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.99 C Shift Assignments>> C :: 177.032 CA :: 56.392 CB :: 29.960 CD1 :: 127.865 CE3 :: 120.123 CZ2 :: 113.472 CZ3 :: 122.004 CH2 :: 124.084 Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 7.620 HA :: 4.702 HB2 :: 3.250 HB3 :: 3.023 HD1 :: 7.172 HE1 :: 9.589 HE3 :: 7.352 HZ2 :: 6.964 HZ3 :: 7.233 HH2 :: 7.026 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 118.678 NE1 :: 126.726 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.G81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.91 L 0.07 C Shift Assignments>> C :: 174.503 CA :: 46.037 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.208 HA2 :: 4.281 HA3 :: 3.907 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.321 Ave N Shift Values>> N :: 109.67(3.87) 1.S82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> CA :: 57.770 CB :: 64.247 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> HA :: 4.586 HB2 :: 3.803 HB3 :: 3.803 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) 1.A83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> A 0.88 M 0.1 C Shift Assignments>> CA :: 52.694 CB :: 19.282 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> HA :: 4.431 HB1 :: 1.410 HB2 :: 1.410 HB3 :: 1.410 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) 1.G84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> G 0.9 L 0.07 C Shift Assignments>> C :: 174.178 CA :: 45.736 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.201 HA2 :: 3.902 HA3 :: 3.902 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 1.L85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.74 A 0.14 G 0.05 R 0.05 C Shift Assignments>> C :: 177.652 CA :: 54.033 CB :: 42.892 CG :: 26.695 CD1 :: 25.301 CD2 :: 22.364 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.676 HA :: 4.404 HB2 :: 1.645 HB3 :: 1.222 HG :: 1.331 HD11 :: 0.448 HD12 :: 0.448 HD13 :: 0.448 HD21 :: 0.484 HD22 :: 0.484 HD23 :: 0.484 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.403 Ave N Shift Values>> N :: 121.86(3.9) 1.G86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.32 L 0.31 G 0.2 D 0.05 F 0.04 Y 0.02 K 0.01 C Shift Assignments>> C :: 174.286 CA :: 43.870 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.572 HA2 :: 4.264 HA3 :: 4.117 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.617 Ave N Shift Values>> N :: 109.67(3.87) 1.G87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.56 L 0.24 R 0.12 F 0.03 D 0.02 Y 0.01 C Shift Assignments>> C :: 174.396 CA :: 44.539 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.957 HA2 :: 4.097 HA3 :: 3.756 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.898 Ave N Shift Values>> N :: 109.67(3.87) 1.V88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 175.709 CA :: 61.639 CB :: 33.551 CG1 :: 21.752 CG2 :: 22.592 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.456 HA :: 4.755 HB :: 1.890 HG11 :: 0.896 HG12 :: 0.896 HG13 :: 0.896 HG21 :: 1.006 HG22 :: 1.006 HG23 :: 1.006 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 120.659 Ave N Shift Values>> N :: 121.14(4.54) 1.F89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.98 F 0.01 C Shift Assignments>> C :: 172.601 CA :: 54.498 CB :: 42.328 CD1 :: 135.198 CD2 :: 135.198 CE1 :: 129.402 CE2 :: 129.402 CZ :: 128.296 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 9.015 HA :: 4.899 HB2 :: 2.659 HB3 :: 2.823 HD1 :: 7.205 HD2 :: 7.205 HE1 :: 6.964 HE2 :: 6.964 HZ :: 7.017 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 123.707 Ave N Shift Values>> N :: 120.45(4.18) 1.K90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.83 R 0.15 G 0.01 C Shift Assignments>> C :: 176.528 CA :: 55.379 CB :: 33.975 CG :: 25.054 CD :: 28.896 CE :: 42.000 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.369 HA :: 4.996 HB2 :: 1.834 HB3 :: 1.524 HG2 :: 1.613 HG3 :: 1.455 HD2 :: 1.718 HD3 :: 1.718 HE2 :: 3.036 HE3 :: 3.036 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 119.081 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.84 A 0.12 V 0.02 C Shift Assignments>> C :: 174.160 CA :: 58.477 CB :: 35.451 CG1 :: 24.763 CG2 :: 17.778 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.852 HA :: 4.953 HB :: 1.514 HG11 :: 0.691 HG12 :: 0.691 HG13 :: 0.691 HG21 :: 0.341 HG22 :: 0.341 HG23 :: 0.341 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 112.008 Ave N Shift Values>> N :: 121.14(4.54) 1.E92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.44 E 0.33 Q 0.16 K 0.04 C Shift Assignments>> C :: 176.413 CA :: 53.419 CB :: 31.020 CG :: 35.541 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.638 HA :: 4.724 HB2 :: 1.993 HB3 :: 1.827 HG2 :: 2.255 HG3 :: 2.083 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 121.621 Ave N Shift Values>> N :: 120.67(3.48) 1.W93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.99 C Shift Assignments>> C :: 176.017 CA :: 60.382 CB :: 28.396 CD1 :: 125.757 CE3 :: 120.390 CZ2 :: 113.711 CZ3 :: 120.540 CH2 :: 125.411 Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 9.316 HA :: 3.679 HB2 :: 3.035 HB3 :: 2.694 HD1 :: 7.251 HE1 :: 9.482 HE3 :: 7.358 HZ2 :: 6.223 HZ3 :: 6.979 HH2 :: 5.984 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 127.852 NE1 :: 129.729 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.I94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 176.024 CA :: 61.966 CB :: 37.974 CG1 :: 27.112 CG2 :: 18.015 CD1 :: 12.286 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.654 HA :: 4.063 HB :: 1.070 HG12 :: 1.694 HG13 :: 1.302 HG21 :: 0.833 HG22 :: 0.833 HG23 :: 0.833 HD11 :: 0.950 HD12 :: 0.950 HD13 :: 0.950 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 125.867 Ave N Shift Values>> N :: 121.46(4.28) 1.R95 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.8 R 0.18 C Shift Assignments>> C :: 175.706 CA :: 52.588 CB :: 31.754 CG :: 28.162 CD :: 41.194 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 6.567 HA :: 4.726 HB2 :: 1.824 HB3 :: 0.537(S) HG2 :: 1.287 HG3 :: 0.953 HD2 :: 3.386 HD3 :: 3.344 HE :: 8.776 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 115.223 NE :: 85.402 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.K96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.68 R 0.3 HN Overlap>> 1.R74 1.R74 C Shift Assignments>> C :: 176.106 CA :: 55.551 CB :: 33.811 CG :: 26.055 CD :: 29.382 CE :: 41.768 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.529 HA :: 4.651 HB2 :: 1.796 HB3 :: 1.420 HG2 :: 1.183 HG3 :: 0.857 HD2 :: 1.270 HD3 :: 1.270 HE2 :: 2.782 HE3 :: 2.485 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 117.928 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.66 I 0.11 M 0.1 K 0.06 Q 0.04 C Shift Assignments>> C :: 176.385 CA :: 58.370 CB :: 30.354 CG :: 36.487 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.956 HA :: 4.278 HB2 :: 2.238 HB3 :: 2.146 HG2 :: 2.711 HG3 :: 2.384 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.321 Ave N Shift Values>> N :: 120.67(3.48) 1.S98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 172.839 CA :: 58.431 CB :: 63.928 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.558 HA :: 5.257 HB2 :: 3.731 HB3 :: 3.568 HG :: 5.231 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 117.050 Ave N Shift Values>> N :: 116.28(3.52) 1.L99 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.87 L 0.12 C Shift Assignments>> C :: 173.911 CA :: 51.163 CB :: 45.236 CG :: 26.330 CD1 :: 25.195 CD2 :: 26.097 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.433 HA :: 4.689 HB2 :: 1.701 HB3 :: 0.321(S) HG :: 1.149 HD11 :: 0.139 HD12 :: 0.139 HD13 :: 0.139 HD21 :: 0.116 HD22 :: 0.116 HD23 :: 0.116 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 127.597 Ave N Shift Values>> N :: 121.86(3.9) 1.P100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> CA :: 62.697 CB :: 32.307 CG :: 27.353 CD :: 51.214 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 3.800 HB2 :: 2.056 HB3 :: 1.603 HG2 :: 1.928 HG3 :: 1.718 HD2 :: 3.985 HD3 :: 3.145 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.F101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.87 W 0.07 H 0.05 C Shift Assignments>> CA :: 56.811 CB :: 36.355 CD1 :: 128.507 CD2 :: 128.507 CE1 :: 131.617 CE2 :: 131.617 CZ :: 129.490 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.795 HA :: 4.329 HB2 :: 3.077 HB3 :: 2.787 HD1 :: 6.713 HD2 :: 6.713 HE1 :: 6.327 HE2 :: 6.327 HZ :: 6.878 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 121.197 Ave N Shift Values>> N :: 120.45(4.18) 1.Q102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.35 K 0.31 R 0.22 E 0.03 I 0.03 M 0.02 P 0.01 C Shift Assignments>> C :: 178.057 CA :: 58.976 CB :: 27.680 CG :: 33.393 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.907 HA :: 3.657 HB2 :: 1.999 HB3 :: 1.822 HG2 :: 2.236 HG3 :: 2.236 HE21 :: 6.710 HE22 :: 7.400 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> NE2 :: 111.892 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.F103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.99 HN Overlap>> 1.Q136 1.Q136 C Shift Assignments>> C :: 175.185 CA :: 58.797 CB :: 38.219 CD1 :: 130.137 CD2 :: 130.137 CE1 :: 131.636 CE2 :: 131.636 CZ :: 130.425 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.677 HA :: 4.562 HB2 :: 3.215 HB3 :: 3.123 HD1 :: 7.208 HD2 :: 7.208 HE1 :: 7.347 HE2 :: 7.347 HZ :: 7.343 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 116.613 Ave N Shift Values>> N :: 120.45(4.18) 1.A104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.96 M 0.02 L 0.01 C Shift Assignments>> C :: 178.294 CA :: 50.770 CB :: 20.024 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.059 HA :: 4.607 HB1 :: 1.311 HB2 :: 1.311 HB3 :: 1.311 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 118.203 Ave N Shift Values>> N :: 123.23(3.54) 1.H105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.55 H 0.44 C Shift Assignments>> C :: 173.548 CA :: 59.338 CB :: 31.414 CD2 :: 120.986 CE1 :: 138.662 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 7.455 HA :: 4.168 HB2 :: 3.306 HB3 :: 3.172 HD2 :: 7.095 HE1 :: 7.729 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 121.054 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.H106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.55 W 0.44 C Shift Assignments>> C :: 175.195 CA :: 55.866 CB :: 30.337 CD2 :: 118.280 CE1 :: 139.123 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 8.755 HA :: 4.375 HB2 :: 3.119 HB3 :: 2.692 HD2 :: 6.895 HE1 :: 8.051 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 112.902 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.L107 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.93 A 0.05 R 0.01 C Shift Assignments>> C :: 173.505 CA :: 54.035 CB :: 41.422 CG :: 25.906 CD1 :: 26.071 CD2 :: 23.487 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.256 HA :: 4.151 HB2 :: 1.680 HB3 :: 0.781 HG :: 0.383(S) HD11 :: 0.608 HD12 :: 0.608 HD13 :: 0.608 HD21 :: 0.514 HD22 :: 0.514 HD23 :: 0.514 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.773 Ave N Shift Values>> N :: 121.86(3.9) 1.L108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.67 A 0.31 G 0.01 C Shift Assignments>> C :: 176.123 CA :: 52.487 CB :: 41.882 CG :: 26.784 CD1 :: 24.624 CD2 :: 21.915 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.117 HA :: 4.311 HB2 :: 1.409 HB3 :: 0.895 HG :: 1.519 HD11 :: 0.806 HD12 :: 0.806 HD13 :: 0.806 HD21 :: 0.599 HD22 :: 0.599 HD23 :: 0.599 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 124.652 Ave N Shift Values>> N :: 121.86(3.9) 1.N109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.48 N 0.32 D 0.13 L 0.02 F 0.01 C Shift Assignments>> C :: 174.503 CA :: 48.365 CB :: 40.067 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.239 HA :: 5.200 HB2 :: 2.357 HB3 :: 3.132 HD21 :: 7.434 HD22 :: 8.684 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 115.485 ND2 :: 113.225 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.P110 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> CA :: 64.544 CB :: 32.185 CG :: 27.272 CD :: 51.994 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.462 HB2 :: 2.493 HB3 :: 2.018 HG2 :: 1.740 HG3 :: 2.061 HD2 :: 3.843 HD3 :: 4.274 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.W111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.99 C Shift Assignments>> CA :: 55.027 CB :: 27.968 CD1 :: 123.573 CE3 :: 120.019 CZ2 :: 114.609 CZ3 :: 121.762 CH2 :: 125.698 Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 6.988 HA :: 5.134 HB2 :: 3.121 HB3 :: 3.511 HD1 :: 6.899 HE1 :: 10.423 HE3 :: 7.071 HZ2 :: 7.689 HZ3 :: 6.994 HH2 :: 7.384 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 115.823 NE1 :: 129.034 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.N112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.69 D 0.16 F 0.04 Y 0.04 L 0.03 C Shift Assignments>> CA :: 51.801 CB :: 38.758 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.900 HA :: 5.178 HB2 :: 2.292 HB3 :: 2.827 HD21 :: 7.089 HD22 :: 7.665 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.482 ND2 :: 112.160 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.D113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.23 D 0.22 Y 0.22 L 0.13 N 0.13 I 0.02 K 0.01 C Shift Assignments>> C :: 174.171 CA :: 55.861 CB :: 39.771 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.873 HA :: 4.293 HB2 :: 2.948 HB3 :: 2.494 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 116.901 Ave N Shift Values>> N :: 120.65(3.86) 1.N114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.43 Y 0.13 E 0.13 F 0.1 M 0.07 D 0.06 L 0.01 I 0.01 K 0.01 C Shift Assignments>> C :: 173.997 CA :: 54.343 CB :: 37.355 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.696 HA :: 3.743 HB2 :: 3.007 HB3 :: 2.770 HD21 :: 6.646 HD22 :: 7.459 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 109.785 ND2 :: 111.613 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.K115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.58 K 0.38 G 0.02 C Shift Assignments>> C :: 179.004 CA :: 56.359 CB :: 33.912 CG :: 26.605 CD :: 29.387 CE :: 42.634 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.251 HA :: 4.358 HB2 :: 1.783 HB3 :: 2.052 HG2 :: 1.557 HG3 :: 1.454 HD2 :: 1.638 HD3 :: 1.638 HE2 :: 2.964 HE3 :: 2.964 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 116.333 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.83 R 0.16 C Shift Assignments>> CA :: 57.581 CB :: 33.012 CG :: 25.268 CD :: 29.758 CE :: 41.605 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.805 HA :: 4.416 HB2 :: 1.399 HB3 :: 2.220 HG2 :: 1.441 HG3 :: 1.441 HD2 :: 1.512 HD3 :: 1.445 HE2 :: 2.840 HE3 :: 2.840 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 124.846 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> CA :: 65.288 CB :: 31.850 CG1 :: 22.852 CG2 :: 21.291 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.442 HA :: 3.730 HB :: 1.906 HG11 :: 0.781 HG12 :: 0.781 HG13 :: 0.781 HG21 :: 0.919 HG22 :: 0.919 HG23 :: 0.919 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 118.519 Ave N Shift Values>> N :: 121.14(4.54) 1.Q118 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.52 R 0.26 Q 0.17 C Shift Assignments>> C :: 175.549 CA :: 57.671 CB :: 25.935 CG :: 33.007 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.778 HA :: 3.545 HB2 :: 0.278(S) HB3 :: 0.947(S) HG2 :: 1.568 HG3 :: 1.568 HE21 :: 6.867 HE22 :: 7.637 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 116.586 NE2 :: 112.733 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.I119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 174.144 CA :: 60.367 CB :: 35.870 CG1 :: 27.053 CG2 :: 18.074 CD1 :: 13.390 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.750 HA :: 4.230 HB :: 2.186 HG12 :: 1.320 HG13 :: 1.133 HG21 :: 0.881 HG22 :: 0.881 HG23 :: 0.881 HD11 :: 0.875 HD12 :: 0.875 HD13 :: 0.875 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 121.593 Ave N Shift Values>> N :: 121.46(4.28) 1.S120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.68 S 0.31 C Shift Assignments>> C :: 172.898 CA :: 59.232 CB :: 67.197 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.319 HA :: 4.548 HB2 :: 3.844 HB3 :: 3.684 HG :: 5.675 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 117.838 Ave N Shift Values>> N :: 116.28(3.52) 1.R121 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.74 G 0.16 K 0.08 C Shift Assignments>> C :: 175.289 CA :: 54.618 CB :: 31.752 CG :: 27.395 CD :: 43.570 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 9.034 HA :: 4.515 HB2 :: 1.966 HB3 :: 1.828 HG2 :: 1.764 HG3 :: 1.701 HD2 :: 3.272 HD3 :: 3.272 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 122.913 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.D122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.23 K 0.22 R 0.21 F 0.12 D 0.09 Y 0.08 I 0.01 C Shift Assignments>> C :: 177.750 CA :: 56.996 CB :: 42.488 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.575 HA :: 4.363 HB2 :: 2.795 HB3 :: 2.671 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 117.767 Ave N Shift Values>> N :: 120.65(3.86) 1.G123 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.88 L 0.08 C Shift Assignments>> C :: 173.256 CA :: 45.454 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.858 HA2 :: 4.195 HA3 :: 3.298 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 118.741 Ave N Shift Values>> N :: 109.67(3.87) 1.Q124 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> M 0.38 Q 0.37 K 0.19 E 0.03 C Shift Assignments>> C :: 175.062 CA :: 56.244 CB :: 30.762 CG :: 33.121 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.993 HA :: 4.030 HB2 :: 2.532 HB3 :: 2.013 HG2 :: 2.464 HG3 :: 2.022 HE21 :: 6.873 HE22 :: 8.821(S) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 121.599 NE2 :: 117.217 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.69 M 0.16 K 0.05 I 0.04 Q 0.03 C Shift Assignments>> C :: 177.517 CA :: 55.935 CB :: 30.403 CG :: 36.799 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.052 HA :: 4.624 HB2 :: 1.997 HB3 :: 1.961 HG2 :: 2.386 HG3 :: 1.795 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 129.303 Ave N Shift Values>> N :: 120.67(3.48) 1.L126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.86 R 0.06 G 0.04 A 0.01 C Shift Assignments>> C :: 173.262 CA :: 53.181 CB :: 42.728 CG :: 26.832 CD1 :: 25.712 CD2 :: 24.290 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.532 HA :: 4.200 HB2 :: 0.808 HB3 :: 1.235 HG :: 1.291 HD11 :: 0.475 HD12 :: 0.475 HD13 :: 0.475 HD21 :: 0.518 HD22 :: 0.518 HD23 :: 0.518 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 126.269 Ave N Shift Values>> N :: 121.86(3.9) 1.E127 Overall: Anomalous Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> E 0.5 M 0.18 Q 0.16 K 0.12 I 0.01 C Shift Assignments>> CA :: 54.764 CB :: 30.172 CG :: 35.805 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 6.122(S) HA :: 1.823(S) HB2 :: 0.053(A) HB3 :: 1.661 HG2 :: 1.900 HG3 :: 1.636 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 127.660 Ave N Shift Values>> N :: 120.67(3.48) SRO Rule Breaks>> (HA > HG2 : 1.0000) 1.P128 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.97 S 0.02 C Shift Assignments>> C :: 178.148 CA :: 65.882 CB :: 31.831 CG :: 27.752 CD :: 52.343 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 3.900 HB2 :: 2.041 HB3 :: 2.572 HG2 :: 2.086 HG3 :: 2.348 HD2 :: 3.392 HD3 :: 3.350 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.Q129 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.26 Q 0.24 K 0.23 I 0.2 R 0.04 C Shift Assignments>> C :: 179.413 CA :: 59.532 CB :: 28.103 CG :: 34.985 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.536 HA :: 4.009 HB2 :: 2.354 HB3 :: 2.098 HG2 :: 2.468 HG3 :: 2.209 HE21 :: 6.784 HE22 :: 7.719 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 118.694 NE2 :: 112.072 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.V130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 177.339 CA :: 65.476 CB :: 31.137 CG1 :: 23.548 CG2 :: 21.307 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.579 HA :: 3.599 HB :: 1.923 HG11 :: 0.991 HG12 :: 0.991 HG13 :: 0.991 HG21 :: 0.644 HG22 :: 0.644 HG23 :: 0.644 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 121.363 Ave N Shift Values>> N :: 121.14(4.54) 1.G131 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.92 L 0.06 C Shift Assignments>> C :: 173.916 CA :: 46.526 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.054 HA2 :: 2.668(S) HA3 :: 1.628(S) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.195 Ave N Shift Values>> N :: 109.67(3.87) 1.E132 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.54 I 0.2 K 0.12 Q 0.08 M 0.03 C Shift Assignments>> C :: 179.267 CA :: 59.412 CB :: 29.622 CG :: 35.980 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.649 HA :: 3.560 HB2 :: 2.077 HB3 :: 2.077 HG2 :: 2.275 HG3 :: 2.126 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.077 Ave N Shift Values>> N :: 120.67(3.48) 1.Q133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.34 Q 0.28 K 0.24 M 0.06 I 0.05 C Shift Assignments>> C :: 178.435 CA :: 58.633 CB :: 29.620 CG :: 34.901 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.268 HA :: 3.827 HB2 :: 2.073 HB3 :: 1.948 HG2 :: 2.576 HG3 :: 2.280 HE21 :: 7.122 HE22 :: 6.738 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 116.959 NE2 :: 110.646 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L134 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.65 R 0.29 K 0.02 A 0.01 C Shift Assignments>> C :: 178.094 CA :: 57.749 CB :: 41.426 CG :: 27.192 CD1 :: 22.911 CD2 :: 27.390 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.245 HA :: 3.828 HB2 :: 0.998 HB3 :: 1.947 HG :: 1.341 HD11 :: 0.496 HD12 :: 0.496 HD13 :: 0.496 HD21 :: 0.324 HD22 :: 0.324 HD23 :: 0.324 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.496 Ave N Shift Values>> N :: 121.86(3.9) 1.L135 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.91 A 0.08 C Shift Assignments>> C :: 181.690 CA :: 58.331 CB :: 39.441 CG :: 26.146 CD1 :: 21.533 CD2 :: 23.751 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.692 HA :: 3.781 HB2 :: 1.365 HB3 :: 0.806 HG :: 0.763 HD11 :: -0.653(S) HD12 :: -0.653(S) HD13 :: -0.653(S) HD21 :: -0.219 HD22 :: -0.219 HD23 :: -0.219 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 115.607 Ave N Shift Values>> N :: 121.86(3.9) 1.Q136 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.36 K 0.32 E 0.16 R 0.07 I 0.04 M 0.01 HN Overlap>> 1.R140 1.F103 1.R140 1.F103 C Shift Assignments>> C :: 178.716 CA :: 58.165 CB :: 28.260 CG :: 34.384 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.606 HA :: 4.072 HB2 :: 2.132 HB3 :: 2.114 HG2 :: 2.487 HG3 :: 2.576 HE21 :: 6.738 HE22 :: 7.546 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 116.646 NE2 :: 111.499 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L137 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.7 R 0.26 A 0.01 G 0.01 HN Overlap>> 1.N36 1.N36 C Shift Assignments>> C :: 179.237 CA :: 57.769 CB :: 41.688 CG :: 26.121 CD1 :: 27.507 CD2 :: 22.670 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.867 HA :: 4.043 HB2 :: 2.142 HB3 :: 1.218 HG :: 2.298 HD11 :: 0.914 HD12 :: 0.914 HD13 :: 0.914 HD21 :: 0.977 HD22 :: 0.977 HD23 :: 0.977 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.670 Ave N Shift Values>> N :: 121.86(3.9) 1.W138 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.99 C Shift Assignments>> C :: 178.064 CA :: 64.135 CB :: 29.814 CD1 :: 127.454 CE3 :: 124.084 CZ2 :: 113.113 CZ3 :: 122.435 CH2 :: 123.438 Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 7.851 HA :: 4.059 HB2 :: 3.513 HB3 :: 3.353 HD1 :: 7.352 HE1 :: 10.642 HE3 :: 8.160 HZ2 :: 7.339 HZ3 :: 6.536 HH2 :: 6.692 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 117.812 NE1 :: 127.678 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.E139 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.61 I 0.19 K 0.11 Q 0.04 M 0.02 C Shift Assignments>> C :: 177.567 CA :: 57.751 CB :: 29.183 CG :: 36.668 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.933 HA :: 4.389 HB2 :: 2.305 HB3 :: 2.209 HG2 :: 2.425 HG3 :: 2.542 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 116.686 Ave N Shift Values>> N :: 120.67(3.48) 1.R140 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.8 G 0.12 K 0.05 HN Overlap>> 1.Q136 1.Q136 C Shift Assignments>> C :: 175.700 CA :: 55.775 CB :: 30.478 CG :: 27.054 CD :: 43.453 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.508 HA :: 4.410 HB2 :: 1.838 HB3 :: 2.047 HG2 :: 1.691 HG3 :: 1.691 HD2 :: 3.104 HD3 :: 3.104 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 116.615 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.L141 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.6 R 0.27 G 0.1 A 0.01 C Shift Assignments>> C :: 175.613 CA :: 56.792 CB :: 43.217 CG :: 26.857 CD1 :: 23.117 CD2 :: 26.334 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.201 HA :: 4.134 HB2 :: 1.758 HB3 :: 1.554 HG :: 1.526 HD11 :: 0.764 HD12 :: 0.764 HD13 :: 0.764 HD21 :: 0.737 HD22 :: 0.737 HD23 :: 0.737 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 125.916 Ave N Shift Values>> N :: 121.86(3.9) ########################################################################### Overall Results: #Consistent: 123 #Clerical: 0 #Suspicious: 17 #Anomalous: 1 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 135 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 6 Shift Relative Order (SRO) Results: #Consistent: 139 #Suspicious: 2 C Shift Results: #Consistent: 614 #Duplicate: 0 #Unknown: 0 #Suspicious: 1 #Anomalous: 0 H Shift Results: #Consistent: 963 #Duplicate: 0 #Unknown: 0 #Suspicious: 26 #Anomalous: 1 N Shift Results: #Consistent: 147 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.M13 HB3 = 0.802(S), Expected = 1.99, Std = 0.3400, ChiSquare = 4.7563e-04 1.S24 HB2 = 4.951(S), Expected = 3.88, Std = 0.2500, ChiSquare = 1.8356e-05 1.Q25 HG2 = 1.339(S), Expected = 2.32, Std = 0.2700, ChiSquare = 2.7978e-04 1.Q25 HG3 = -0.391(S), Expected = 2.29, Std = 0.2900, ChiSquare = 2.3562e-20 1.Q25 HE21 = 3.867(S), Expected = 7.24, Std = 0.4500, ChiSquare = 6.6018e-14 1.W30 HB3 = 1.787(S), Expected = 3.12, Std = 0.3600, ChiSquare = 2.1325e-04 1.S31 HB3 = 2.863(S), Expected = 3.85, Std = 0.2700, ChiSquare = 2.5663e-04 1.F54 HE1 = 5.236(S), Expected = 7.08, Std = 0.3100, ChiSquare = 2.7080e-09 1.F54 HE2 = 5.236(S), Expected = 7.08, Std = 0.3200, ChiSquare = 8.2877e-09 1.F54 SRO Rule Break>> HE1 > HA : 0.997334754797441 1.F54 SRO Rule Break>> HE2 > HA : 0.996867167919799 1.G64 HA2 = 5.190(S), Expected = 3.97, Std = 0.3700, ChiSquare = 9.7620e-04 1.S66 HB2 = 2.948(S), Expected = 3.88, Std = 0.2500, ChiSquare = 1.9301e-04 1.S66 HB3 = 2.259(S), Expected = 3.85, Std = 0.2700, ChiSquare = 3.8018e-09 1.S70 C = 181.737(S), Expected = 174.62, Std = 1.7200, ChiSquare = 3.5067e-05 1.D79 HB3 = 1.737(S), Expected = 2.66, Std = 0.2800, ChiSquare = 9.7923e-04 1.R95 HB3 = 0.537(S), Expected = 1.76, Std = 0.2800, ChiSquare = 1.2547e-05 1.L99 HB3 = 0.321(S), Expected = 1.52, Std = 0.3600, ChiSquare = 8.6673e-04 1.L107 HG = 0.383(S), Expected = 1.51, Std = 0.3300, ChiSquare = 6.3747e-04 1.Q118 HB2 = 0.278(S), Expected = 2.05, Std = 0.2500, ChiSquare = 1.3606e-12 1.Q118 HB3 = 0.947(S), Expected = 2.02, Std = 0.2800, ChiSquare = 1.2703e-04 1.Q124 HE22 = 8.821(S), Expected = 7.02, Std = 0.4400, ChiSquare = 4.2549e-05 1.E127 H = 6.122(S), Expected = 8.33, Std = 0.5900, ChiSquare = 1.8229e-04 1.E127 HA = 1.823(S), Expected = 4.25, Std = 0.4100, ChiSquare = 3.2290e-09 1.E127 HB2 = 0.053(A), Expected = 2.02, Std = 0.2100, ChiSquare = 7.4859e-21 1.E127 SRO Rule Break>> HA > HG2 : 1 1.G131 HA2 = 2.668(S), Expected = 3.97, Std = 0.3700, ChiSquare = 4.3331e-04 1.G131 HA3 = 1.628(S), Expected = 3.90, Std = 0.3700, ChiSquare = 8.2241e-10 1.L135 HD11 = -0.653(S), Expected = 0.75, Std = 0.2800, ChiSquare = 5.4228e-07 1.L135 HD12 = -0.653(S), Expected = 0.75, Std = 0.2800, ChiSquare = 5.4228e-07 1.L135 HD13 = -0.653(S), Expected = 0.75, Std = 0.2800, ChiSquare = 5.4228e-07