Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Indeterminable PRTL>> L 0.48 D 0.11 F 0.09 K 0.09 G 0.07 Y 0.05 C 0.05 I 0.01 C Shift Assignments>> C :: 169.781 CA :: 43.151 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 3.772(D) HA3 :: 3.772(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 1.L2 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.65 C 0.3 G 0.02 A 0.01 C Shift Assignments>> C :: 177.323 CA :: 55.569 CB :: 42.598 CG :: 26.926 CD1 :: 23.608 CD2 :: 24.626 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 :: 8.469(D) HA :: 4.291(D) HB2 :: 1.524(D) HB3 :: 1.524(D) HG :: 1.527(D) HD11 :: 0.802(D) HD12 :: 0.802(D) HD13 :: 0.802(D) HD21 :: 0.839(D) HD22 :: 0.839(D) HD23 :: 0.839(D) 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 :: 121.784(D) Ave N Shift Values>> N :: 121.86(3.9) 1.I3 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.67 C 0.32 C Shift Assignments>> C :: 176.124 CA :: 61.078 CB :: 38.485 CG1 :: 27.322 CG2 :: 17.344 CD1 :: 12.642 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 :: 8.173(D) HA :: 4.094(D) HB :: 1.772(D) HG12 :: 1.119(D) HG13 :: 1.409(D) HG21 :: 0.820(D) HG22 :: 0.820(D) HG23 :: 0.820(D) HD11 :: 0.777(D) HD12 :: 0.777(D) HD13 :: 0.777(D) 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 :: 121.967(D) Ave N Shift Values>> N :: 121.46(4.28) 1.E4 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.34 C 0.28 Q 0.14 K 0.11 M 0.09 I 0.01 C Shift Assignments>> C :: 176.124 CA :: 56.472 CB :: 30.043 CG :: 35.591 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 :: 8.430(D) HA :: 4.250(D) HB2 :: 1.866(D) HB3 :: 1.976(D) HG2 :: 2.212(D) HG3 :: 2.212(D) 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 :: 125.313(D) Ave N Shift Values>> N :: 120.67(3.48) 1.S5 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 174.195 CA :: 58.215 CB :: 63.800 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.230(D) HA :: 4.377(D) HB2 :: 3.764(D) HB3 :: 3.764(D) 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 :: 117.155(D) Ave N Shift Values>> N :: 116.28(3.52) 1.I6 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.68 C 0.31 C Shift Assignments>> C :: 175.751 CA :: 61.144 CB :: 38.864 CG1 :: 27.084 CG2 :: 17.495 CD1 :: 13.029 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 :: 8.054(D) HA :: 4.130(D) HB :: 1.803(D) HG12 :: 1.108(D) HG13 :: 1.383(D) HG21 :: 0.847(D) HG22 :: 0.847(D) HG23 :: 0.847(D) HD11 :: 0.784(D) HD12 :: 0.784(D) HD13 :: 0.784(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 122.530(D) Ave N Shift Values>> N :: 121.46(4.28) 1.A7 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.89 M 0.08 C 0.01 C Shift Assignments>> C :: 176.569 CA :: 52.089 CB :: 19.111 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.288(D) HA :: 4.363(D) HB1 :: 1.310(D) HB2 :: 1.310(D) HB3 :: 1.310(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 128.324(D) Ave N Shift Values>> N :: 123.23(3.54) 1.C8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.33 D 0.29 K 0.18 F 0.07 C 0.05 Y 0.05 C Shift Assignments>> C :: 173.374 CA :: 54.218 CB :: 42.154 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.877(D) HA :: 4.720(D) HB2 :: 2.861(D) HB3 :: 3.130(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 115.591(D) Ave N Shift Values>> N :: 120.17(4.64) 1.M9 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.43 M 0.36 C 0.2 C Shift Assignments>> C :: 176.934 CA :: 53.866 CB :: 34.470 CG :: 32.007 CE :: 18.298 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 :: 9.109(D) HA :: 4.882(D) HB2 :: 1.955(D) HB3 :: 2.288(D) HG2 :: 2.613(D) HG3 :: 3.035(D) HE1 :: 2.068(D) HE2 :: 2.068(D) HE3 :: 2.068(D) 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 :: 117.859(D) Ave N Shift Values>> N :: 120.09(3.57) 1.Q10 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.55 C 0.37 E 0.07 C Shift Assignments>> C :: 172.974 CA :: 55.201 CB :: 29.807 CG :: 33.544 CD :: 180.259 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 :: 8.124(D) HA :: 4.327(D) HB2 :: 1.903(D) HB3 :: 2.318(D) HG2 :: 2.462(D) HG3 :: 2.517(D) HE21 :: 7.535(D) HE22 :: 6.808(D) 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 :: 123.943(D) NE2 :: 112.824(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.K11 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Unknown N Shifts: Duplicate PRTL>> C 0.53 K 0.46 C Shift Assignments>> C :: 177.296 CA :: 58.665 CB :: 32.942 CG :: 23.972 CD :: 29.779 CE :: 42.050 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 :: 8.267(D) HA :: 3.526(D) HB2 :: 1.496(D) HB3 :: 1.787(D) HG2 :: 1.078(D) HG3 :: 1.146(D) HD2 :: 1.568(D) HD3 :: 1.652(D) HE2 :: 2.961(D) HE3 :: 3.003(D) HZ1 :: 7.495(U) HZ2 :: 7.495(U) HZ3 :: 7.495(U) 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 :: 118.817(D) NZ :: 32.610 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.G12 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.77 L 0.15 C 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 173.552 CA :: 44.979 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.436(D) HA2 :: 3.619(D) HA3 :: 4.147(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 113.396(D) Ave N Shift Values>> N :: 109.67(3.87) 1.L13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.39 C 0.38 A 0.21 C Shift Assignments>> C :: 173.727 CA :: 52.748 CB :: 40.034 CG :: 28.301 CD1 :: 22.836 CD2 :: 25.528 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 :: 7.574(D) HA :: 4.864(D) HB2 :: 2.008(D) HB3 :: 1.692(D) HG :: 1.724(D) HD11 :: 0.878(D) HD12 :: 0.878(D) HD13 :: 0.878(D) HD21 :: 0.989(D) HD22 :: 0.989(D) HD23 :: 0.989(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 123.385(D) Ave N Shift Values>> N :: 121.86(3.9) 1.P14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Indeterminable PRTL>> P 0.67 C 0.32 C Shift Assignments>> C :: 174.875 CA :: 62.899 CB :: 32.786 CG :: 27.917 CD :: 51.038 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 :: 4.476(D) HB2 :: 1.622(D) HB3 :: 2.112(D) HG2 :: 1.915(D) HG3 :: 2.011(D) HD2 :: 3.599(D) HD3 :: 3.928(D) 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.C15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.75 C 0.14 L 0.09 C Shift Assignments>> C :: 172.360 CA :: 53.543 CB :: 47.719 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.766(D) HA :: 4.555(D) HB2 :: 2.976(D) HB3 :: 3.022(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 114.567(D) Ave N Shift Values>> N :: 120.17(4.64) 1.M16 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.49 C 0.4 A 0.09 C Shift Assignments>> C :: 175.754 CA :: 55.834 CB :: 34.827 CG :: 32.300 CE :: 16.684 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 :: 8.910(D) HA :: 4.509(D) HB2 :: 1.944(D) HB3 :: 1.911(D) HG2 :: 2.328(D) HG3 :: 2.446(D) HE1 :: 1.969(D) HE2 :: 1.969(D) HE3 :: 1.969(D) 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 :: 116.714(D) Ave N Shift Values>> N :: 120.09(3.57) 1.E17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.5 C 0.37 Q 0.07 E 0.04 C Shift Assignments>> C :: 175.396 CA :: 53.378 CB :: 33.047 CG :: 34.486 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 :: 7.994(D) HA :: 4.510(D) HB2 :: 1.609(D) HB3 :: 1.609(D) HG2 :: 2.168(D) HG3 :: 2.107(D) 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 :: 118.189(D) Ave N Shift Values>> N :: 120.67(3.48) 1.H18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.66 H 0.33 C Shift Assignments>> C :: 178.183 CA :: 60.510 CB :: 30.335 CD2 :: 118.592 CE1 :: 139.787 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 :: 7.917(D) HA :: 4.190(D) HB2 :: 2.926(D) HB3 :: 3.264(D) HD2 :: 7.108(D) HE1 :: 7.888(D) 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 :: 122.893(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.V19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.67 C 0.32 C Shift Assignments>> C :: 175.999 CA :: 63.040 CB :: 31.595 CG1 :: 20.014 CG2 :: 20.389 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 :: 7.487(D) HA :: 4.059(D) HB :: 2.208(D) HG11 :: 0.889(D) HG12 :: 0.889(D) HG13 :: 0.889(D) HG21 :: 0.898(D) HG22 :: 0.898(D) HG23 :: 0.898(D) 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 :: 109.681(D) Ave N Shift Values>> N :: 121.14(4.54) 1.D20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.25 L 0.24 D 0.17 F 0.14 Y 0.1 C 0.06 I 0.01 C Shift Assignments>> C :: 177.457 CA :: 56.242 CB :: 41.769 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.677(D) HA :: 4.354(D) HB2 :: 2.740(D) HB3 :: 2.966(D) 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 :: 120.154(D) Ave N Shift Values>> N :: 120.65(3.86) 1.C21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.38 F 0.16 L 0.16 Y 0.14 C 0.11 C Shift Assignments>> C :: 176.411 CA :: 54.252 CB :: 39.756 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.843(D) HA :: 5.070(D) HB2 :: 3.578(D) HB3 :: 2.709(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 116.632(D) Ave N Shift Values>> N :: 120.17(4.64) 1.C22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.29 F 0.23 C 0.21 I 0.07 E 0.06 D 0.05 L 0.03 M 0.02 C Shift Assignments>> C :: 176.512 CA :: 56.860 CB :: 38.289 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 9.733(D) HA :: 4.354(D) HB2 :: 2.314(D) HB3 :: 2.908(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 127.308(D) Ave N Shift Values>> N :: 120.17(4.64) 1.H23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.61 C 0.38 C Shift Assignments>> C :: 175.931 CA :: 54.650 CB :: 28.101 CD2 :: 119.450 CE1 :: 136.169 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 :: 9.143(D) HA :: 4.855(D) HB2 :: 2.786(D) HB3 :: 3.485(D) HD2 :: 7.290(D) HE1 :: 8.548(D) 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 :: 113.422(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.G24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.85 C 0.07 L 0.04 A 0.01 C Shift Assignments>> C :: 173.518 CA :: 47.148 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.420(D) HA2 :: 3.841(D) HA3 :: 3.844(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 103.912(D) Ave N Shift Values>> N :: 109.67(3.87) 1.V25 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.57 C 0.42 C Shift Assignments>> C :: 174.766 CA :: 61.625 CB :: 34.454 CG1 :: 22.165 CG2 :: 20.189 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 :: 7.744(D) HA :: 4.620(D) HB :: 2.032(D) HG11 :: 0.857(D) HG12 :: 0.857(D) HG13 :: 0.857(D) HG21 :: 0.923(D) HG22 :: 0.923(D) HG23 :: 0.923(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 116.860(D) Ave N Shift Values>> N :: 121.14(4.54) 1.C26 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Suspicious PRTL>> D 0.3 F 0.18 L 0.18 Y 0.16 C 0.09 K 0.03 I 0.01 C Shift Assignments>> C :: 173.219 CA :: 55.324 CB :: 40.279 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 12.660(A) HA :: 4.901(D) HB2 :: 2.587(D) HB3 :: 2.654(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 138.678(S) Ave N Shift Values>> N :: 120.17(4.64) 1.D27 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.78 L 0.15 C 0.03 D 0.01 C Shift Assignments>> C :: 174.619 CA :: 53.434 CB :: 45.213 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 :: 8.779(D) HA :: 4.935(D) HB2 :: 2.766(D) HB3 :: 2.315(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 129.144(D) Ave N Shift Values>> N :: 120.65(3.86) 1.S28 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 174.036 CA :: 58.879 CB :: 61.798 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.974(D) HA :: 3.848(D) HB2 :: 3.975(D) HB3 :: 3.975(D) 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 :: 121.156(D) Ave N Shift Values>> N :: 116.28(3.52) 1.L29 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Suspicious PRTL>> C 0.7 L 0.26 A 0.02 C Shift Assignments>> C :: 176.489 CA :: 56.989 CB :: 37.962 CG :: 26.800 CD1 :: 25.678 CD2 :: 22.563 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 :: 7.930(D) HA :: 3.717(D) HB2 :: 1.444(D) HB3 :: 1.923(D) HG :: 1.271(D) HD11 :: 0.781(D) HD12 :: 0.781(D) HD13 :: 0.781(D) HD21 :: 0.780(D) HD22 :: 0.780(D) HD23 :: 0.780(D) 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 :: 107.564(S) Ave N Shift Values>> N :: 121.86(3.9) 1.F30 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.52 G 0.31 C 0.16 C Shift Assignments>> C :: 177.461 CA :: 57.505 CB :: 43.952 CD1 :: 132.667 CD2 :: 132.667 CE1 :: 130.610 CE2 :: 130.610 CZ :: 129.351 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 :: 7.630(D) HA :: 5.087(D) HB2 :: 2.521(D) HB3 :: 2.614(D) HD1 :: 7.046(D) HD2 :: 7.046(D) HE1 :: 7.216(D) HE2 :: 7.216(D) HZ :: 7.174(D) 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 :: 116.360(D) Ave N Shift Values>> N :: 120.45(4.18) 1.C31 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.25 Y 0.22 F 0.17 E 0.15 D 0.06 M 0.05 I 0.03 L 0.02 C Shift Assignments>> C :: 176.647 CA :: 55.478 CB :: 37.679 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 9.089(D) HA :: 5.104(D) HB2 :: 3.049(D) HB3 :: 2.955(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 121.396(D) Ave N Shift Values>> N :: 120.17(4.64) 1.L32 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.38 C 0.36 G 0.24 C Shift Assignments>> C :: 174.689 CA :: 57.593 CB :: 44.237 CG :: 26.470 CD1 :: 25.947 CD2 :: 22.419 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 :: 8.212(D) HA :: 4.022(D) HB2 :: 1.168(D) HB3 :: 1.246(D) HG :: 0.600(D) HD11 :: 0.633(D) HD12 :: 0.633(D) HD13 :: 0.633(D) HD21 :: 0.763(D) HD22 :: 0.763(D) HD23 :: 0.763(D) 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 :: 131.050(D) Ave N Shift Values>> N :: 121.86(3.9) 1.Y33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.74 C 0.25 C Shift Assignments>> CA :: 56.654 CB :: 40.927 CD1 :: 132.758 CD2 :: 132.758 CE1 :: 118.040 CE2 :: 118.040 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.076(D) HA :: 4.499(D) HB2 :: 3.124(D) HB3 :: 2.535(D) HD1 :: 6.951(D) HD2 :: 6.951(D) HE1 :: 6.740(D) HE2 :: 6.740(D) 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 :: 118.258(D) Ave N Shift Values>> N :: 120.52(4.2) ########################################################################### Overall Results: #Consistent: 0 #Clerical: 31 #Suspicious: 1 #Anomalous: 1 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 33 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 0 Shift Relative Order (SRO) Results: #Consistent: 33 #Suspicious: 0 C Shift Results: #Consistent: 143 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 0 #Duplicate: 220 #Unknown: 3 #Suspicious: 0 #Anomalous: 1 N Shift Results: #Consistent: 1 #Duplicate: 30 #Unknown: 0 #Suspicious: 2 #Anomalous: 0 Error Summary: 1.G1 HA2 = 3.772(D), Expected = 3.97, Std = 0.3700, ChiSquare = 5.9256e-01 1.G1 HA3 = 3.772(D), Expected = 3.90, Std = 0.3700, ChiSquare = 7.2938e-01 1.L2 H = 8.469(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.1310e-01 1.L2 HA = 4.291(D), Expected = 4.32, Std = 0.4700, ChiSquare = 9.5080e-01 1.L2 HB2 = 1.524(D), Expected = 1.61, Std = 0.3400, ChiSquare = 8.0031e-01 1.L2 HB3 = 1.524(D), Expected = 1.52, Std = 0.3600, ChiSquare = 9.9113e-01 1.L2 HG = 1.527(D), Expected = 1.51, Std = 0.3300, ChiSquare = 9.5892e-01 1.L2 HD11 = 0.802(D), Expected = 0.75, Std = 0.2800, ChiSquare = 8.5267e-01 1.L2 HD12 = 0.802(D), Expected = 0.75, Std = 0.2800, ChiSquare = 8.5267e-01 1.L2 HD13 = 0.802(D), Expected = 0.75, Std = 0.2800, ChiSquare = 8.5267e-01 1.L2 HD21 = 0.839(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.0702e-01 1.L2 HD22 = 0.839(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.0702e-01 1.L2 HD23 = 0.839(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.0702e-01 1.L2 N = 121.784(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.8445e-01 1.I3 H = 8.173(D), Expected = 8.28, Std = 0.6800, ChiSquare = 8.7497e-01 1.I3 HA = 4.094(D), Expected = 4.18, Std = 0.5600, ChiSquare = 8.7795e-01 1.I3 HB = 1.772(D), Expected = 1.78, Std = 0.2900, ChiSquare = 9.7799e-01 1.I3 HG12 = 1.119(D), Expected = 1.28, Std = 0.4000, ChiSquare = 6.8732e-01 1.I3 HG13 = 1.409(D), Expected = 1.19, Std = 0.4100, ChiSquare = 5.9324e-01 1.I3 HG21 = 0.820(D), Expected = 0.77, Std = 0.2700, ChiSquare = 8.5308e-01 1.I3 HG22 = 0.820(D), Expected = 0.77, Std = 0.2700, ChiSquare = 8.5308e-01 1.I3 HG23 = 0.820(D), Expected = 0.77, Std = 0.2700, ChiSquare = 8.5308e-01 1.I3 HD11 = 0.777(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.3802e-01 1.I3 HD12 = 0.777(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.3802e-01 1.I3 HD13 = 0.777(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.3802e-01 1.I3 N = 121.967(D), Expected = 121.46, Std = 4.2800, ChiSquare = 9.0571e-01 1.E4 H = 8.430(D), Expected = 8.33, Std = 0.5900, ChiSquare = 8.6541e-01 1.E4 HA = 4.250(D), Expected = 4.25, Std = 0.4100, ChiSquare = 1.0000e+00 1.E4 HB2 = 1.866(D), Expected = 2.02, Std = 0.2100, ChiSquare = 4.6336e-01 1.E4 HB3 = 1.976(D), Expected = 1.99, Std = 0.2300, ChiSquare = 9.5146e-01 1.E4 HG2 = 2.212(D), Expected = 2.27, Std = 0.2100, ChiSquare = 7.8240e-01 1.E4 HG3 = 2.212(D), Expected = 2.25, Std = 0.2200, ChiSquare = 8.6287e-01 1.E4 N = 125.313(D), Expected = 120.67, Std = 3.4800, ChiSquare = 1.8214e-01 1.S5 H = 8.230(D), Expected = 8.28, Std = 0.5900, ChiSquare = 9.3246e-01 1.S5 HA = 4.377(D), Expected = 4.48, Std = 0.4000, ChiSquare = 7.9679e-01 1.S5 HB2 = 3.764(D), Expected = 3.88, Std = 0.2500, ChiSquare = 6.4265e-01 1.S5 HB3 = 3.764(D), Expected = 3.85, Std = 0.2700, ChiSquare = 7.5009e-01 1.S5 N = 117.155(D), Expected = 116.28, Std = 3.5200, ChiSquare = 8.0369e-01 1.I6 H = 8.054(D), Expected = 8.28, Std = 0.6800, ChiSquare = 7.3962e-01 1.I6 HA = 4.130(D), Expected = 4.18, Std = 0.5600, ChiSquare = 9.2886e-01 1.I6 HB = 1.803(D), Expected = 1.78, Std = 0.2900, ChiSquare = 9.3679e-01 1.I6 HG12 = 1.108(D), Expected = 1.28, Std = 0.4000, ChiSquare = 6.6720e-01 1.I6 HG13 = 1.383(D), Expected = 1.19, Std = 0.4100, ChiSquare = 6.3783e-01 1.I6 HG21 = 0.847(D), Expected = 0.77, Std = 0.2700, ChiSquare = 7.7550e-01 1.I6 HG22 = 0.847(D), Expected = 0.77, Std = 0.2700, ChiSquare = 7.7550e-01 1.I6 HG23 = 0.847(D), Expected = 0.77, Std = 0.2700, ChiSquare = 7.7550e-01 1.I6 HD11 = 0.784(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.1988e-01 1.I6 HD12 = 0.784(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.1988e-01 1.I6 HD13 = 0.784(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.1988e-01 1.I6 N = 122.530(D), Expected = 121.46, Std = 4.2800, ChiSquare = 8.0259e-01 1.A7 H = 8.288(D), Expected = 8.20, Std = 0.6000, ChiSquare = 8.8340e-01 1.A7 HA = 4.363(D), Expected = 4.26, Std = 0.4400, ChiSquare = 8.1491e-01 1.A7 HB1 = 1.310(D), Expected = 1.35, Std = 0.2600, ChiSquare = 8.7773e-01 1.A7 HB2 = 1.310(D), Expected = 1.35, Std = 0.2600, ChiSquare = 8.7773e-01 1.A7 HB3 = 1.310(D), Expected = 1.35, Std = 0.2600, ChiSquare = 8.7773e-01 1.A7 N = 128.324(D), Expected = 123.23, Std = 3.5400, ChiSquare = 1.5016e-01 1.C8 H = 7.877(D), Expected = 8.39, Std = 0.6700, ChiSquare = 4.4387e-01 1.C8 HA = 4.720(D), Expected = 4.66, Std = 0.5500, ChiSquare = 9.1313e-01 1.C8 HB2 = 2.861(D), Expected = 2.96, Std = 0.4400, ChiSquare = 8.2198e-01 1.C8 HB3 = 3.130(D), Expected = 2.89, Std = 0.4600, ChiSquare = 6.0185e-01 1.C8 N = 115.591(D), Expected = 120.17, Std = 4.6400, ChiSquare = 3.2371e-01 1.M9 H = 9.109(D), Expected = 8.26, Std = 0.6000, ChiSquare = 1.5707e-01 1.M9 HA = 4.882(D), Expected = 4.41, Std = 0.4800, ChiSquare = 3.2544e-01 1.M9 HB2 = 1.955(D), Expected = 2.03, Std = 0.3400, ChiSquare = 8.2541e-01 1.M9 HB3 = 2.288(D), Expected = 1.99, Std = 0.3400, ChiSquare = 3.8077e-01 1.M9 HG2 = 2.613(D), Expected = 2.42, Std = 0.3500, ChiSquare = 5.8134e-01 1.M9 HG3 = 3.035(D), Expected = 2.39, Std = 0.3800, ChiSquare = 8.9627e-02 1.M9 HE1 = 2.068(D), Expected = 1.89, Std = 0.4600, ChiSquare = 6.9879e-01 1.M9 HE2 = 2.068(D), Expected = 1.89, Std = 0.4600, ChiSquare = 6.9879e-01 1.M9 HE3 = 2.068(D), Expected = 1.89, Std = 0.4600, ChiSquare = 6.9879e-01 1.M9 N = 117.859(D), Expected = 120.09, Std = 3.5700, ChiSquare = 5.3202e-01 1.Q10 H = 8.124(D), Expected = 8.22, Std = 0.5900, ChiSquare = 8.7075e-01 1.Q10 HA = 4.327(D), Expected = 4.27, Std = 0.4400, ChiSquare = 8.9693e-01 1.Q10 HB2 = 1.903(D), Expected = 2.05, Std = 0.2500, ChiSquare = 5.5653e-01 1.Q10 HB3 = 2.318(D), Expected = 2.02, Std = 0.2800, ChiSquare = 2.8720e-01 1.Q10 HG2 = 2.462(D), Expected = 2.32, Std = 0.2700, ChiSquare = 5.9894e-01 1.Q10 HG3 = 2.517(D), Expected = 2.29, Std = 0.2900, ChiSquare = 4.3377e-01 1.Q10 HE21 = 7.535(D), Expected = 7.24, Std = 0.4500, ChiSquare = 5.1211e-01 1.Q10 HE22 = 6.808(D), Expected = 7.02, Std = 0.4400, ChiSquare = 6.2993e-01 1.Q10 N = 123.943(D), Expected = 119.89, Std = 3.6000, ChiSquare = 2.6024e-01 1.Q10 NE2 = 112.824(D), Expected = 111.87, Std = 1.7200, ChiSquare = 5.7913e-01 1.K11 H = 8.267(D), Expected = 8.19, Std = 0.6000, ChiSquare = 8.9789e-01 1.K11 HA = 3.526(D), Expected = 4.27, Std = 0.4400, ChiSquare = 9.0854e-02 1.K11 HB2 = 1.496(D), Expected = 1.78, Std = 0.2500, ChiSquare = 2.5596e-01 1.K11 HB3 = 1.787(D), Expected = 1.74, Std = 0.2700, ChiSquare = 8.6181e-01 1.K11 HG2 = 1.078(D), Expected = 1.37, Std = 0.2600, ChiSquare = 2.6140e-01 1.K11 HG3 = 1.146(D), Expected = 1.35, Std = 0.2800, ChiSquare = 4.6626e-01 1.K11 HD2 = 1.568(D), Expected = 1.61, Std = 0.2200, ChiSquare = 8.4860e-01 1.K11 HD3 = 1.652(D), Expected = 1.60, Std = 0.2200, ChiSquare = 8.1315e-01 1.K11 HE2 = 2.961(D), Expected = 2.92, Std = 0.1900, ChiSquare = 8.2915e-01 1.K11 HE3 = 3.003(D), Expected = 2.91, Std = 0.2000, ChiSquare = 6.4193e-01 1.K11 HZ1 = 7.495(U) 1.K11 HZ2 = 7.495(U) 1.K11 HZ3 = 7.495(U) 1.K11 N = 118.817(D), Expected = 121.05, Std = 3.7700, ChiSquare = 5.5364e-01 1.G12 H = 9.436(D), Expected = 8.33, Std = 0.6500, ChiSquare = 8.8842e-02 1.G12 HA2 = 3.619(D), Expected = 3.97, Std = 0.3700, ChiSquare = 3.4280e-01 1.G12 HA3 = 4.147(D), Expected = 3.90, Std = 0.3700, ChiSquare = 5.0441e-01 1.G12 N = 113.396(D), Expected = 109.67, Std = 3.8700, ChiSquare = 3.3565e-01 1.L13 H = 7.574(D), Expected = 8.23, Std = 0.6500, ChiSquare = 3.1286e-01 1.L13 HA = 4.864(D), Expected = 4.32, Std = 0.4700, ChiSquare = 2.4709e-01 1.L13 HB2 = 2.008(D), Expected = 1.61, Std = 0.3400, ChiSquare = 2.4176e-01 1.L13 HB3 = 1.692(D), Expected = 1.52, Std = 0.3600, ChiSquare = 6.3281e-01 1.L13 HG = 1.724(D), Expected = 1.51, Std = 0.3300, ChiSquare = 5.1667e-01 1.L13 HD11 = 0.878(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.4757e-01 1.L13 HD12 = 0.878(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.4757e-01 1.L13 HD13 = 0.878(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.4757e-01 1.L13 HD21 = 0.989(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.7180e-01 1.L13 HD22 = 0.989(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.7180e-01 1.L13 HD23 = 0.989(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.7180e-01 1.L13 N = 123.385(D), Expected = 121.86, Std = 3.9000, ChiSquare = 6.9578e-01 1.P14 HA = 4.476(D), Expected = 4.40, Std = 0.3300, ChiSquare = 8.1786e-01 1.P14 HB2 = 1.622(D), Expected = 2.08, Std = 0.3500, ChiSquare = 1.9068e-01 1.P14 HB3 = 2.112(D), Expected = 2.00, Std = 0.3600, ChiSquare = 7.5572e-01 1.P14 HG2 = 1.915(D), Expected = 1.93, Std = 0.3100, ChiSquare = 9.6141e-01 1.P14 HG3 = 2.011(D), Expected = 1.90, Std = 0.3300, ChiSquare = 7.3660e-01 1.P14 HD2 = 3.599(D), Expected = 3.65, Std = 0.3500, ChiSquare = 8.8415e-01 1.P14 HD3 = 3.928(D), Expected = 3.61, Std = 0.3900, ChiSquare = 4.1485e-01 1.C15 H = 7.766(D), Expected = 8.39, Std = 0.6700, ChiSquare = 3.5168e-01 1.C15 HA = 4.555(D), Expected = 4.66, Std = 0.5500, ChiSquare = 8.4860e-01 1.C15 HB2 = 2.976(D), Expected = 2.96, Std = 0.4400, ChiSquare = 9.7099e-01 1.C15 HB3 = 3.022(D), Expected = 2.89, Std = 0.4600, ChiSquare = 7.7415e-01 1.C15 N = 114.567(D), Expected = 120.17, Std = 4.6400, ChiSquare = 2.2722e-01 1.M16 H = 8.910(D), Expected = 8.26, Std = 0.6000, ChiSquare = 2.7866e-01 1.M16 HA = 4.509(D), Expected = 4.41, Std = 0.4800, ChiSquare = 8.3660e-01 1.M16 HB2 = 1.944(D), Expected = 2.03, Std = 0.3400, ChiSquare = 8.0031e-01 1.M16 HB3 = 1.911(D), Expected = 1.99, Std = 0.3400, ChiSquare = 8.1626e-01 1.M16 HG2 = 2.328(D), Expected = 2.42, Std = 0.3500, ChiSquare = 7.9266e-01 1.M16 HG3 = 2.446(D), Expected = 2.39, Std = 0.3800, ChiSquare = 8.8284e-01 1.M16 HE1 = 1.969(D), Expected = 1.89, Std = 0.4600, ChiSquare = 8.6364e-01 1.M16 HE2 = 1.969(D), Expected = 1.89, Std = 0.4600, ChiSquare = 8.6364e-01 1.M16 HE3 = 1.969(D), Expected = 1.89, Std = 0.4600, ChiSquare = 8.6364e-01 1.M16 N = 116.714(D), Expected = 120.09, Std = 3.5700, ChiSquare = 3.4432e-01 1.E17 H = 7.994(D), Expected = 8.33, Std = 0.5900, ChiSquare = 5.6902e-01 1.E17 HA = 4.510(D), Expected = 4.25, Std = 0.4100, ChiSquare = 5.2599e-01 1.E17 HB2 = 1.609(D), Expected = 2.02, Std = 0.2100, ChiSquare = 5.0331e-02 1.E17 HB3 = 1.609(D), Expected = 1.99, Std = 0.2300, ChiSquare = 9.7616e-02 1.E17 HG2 = 2.168(D), Expected = 2.27, Std = 0.2100, ChiSquare = 6.2717e-01 1.E17 HG3 = 2.107(D), Expected = 2.25, Std = 0.2200, ChiSquare = 5.1569e-01 1.E17 N = 118.189(D), Expected = 120.67, Std = 3.4800, ChiSquare = 4.7589e-01 1.H18 H = 7.917(D), Expected = 8.24, Std = 0.6800, ChiSquare = 6.3479e-01 1.H18 HA = 4.190(D), Expected = 4.61, Std = 0.4300, ChiSquare = 3.2870e-01 1.H18 HB2 = 2.926(D), Expected = 3.10, Std = 0.3600, ChiSquare = 6.2886e-01 1.H18 HB3 = 3.264(D), Expected = 3.04, Std = 0.3800, ChiSquare = 5.5554e-01 1.H18 HD2 = 7.108(D), Expected = 7.00, Std = 0.4300, ChiSquare = 8.0169e-01 1.H18 HE1 = 7.888(D), Expected = 7.95, Std = 0.4800, ChiSquare = 8.9723e-01 1.H18 N = 122.893(D), Expected = 119.69, Std = 4.0000, ChiSquare = 4.2328e-01 1.V19 H = 7.487(D), Expected = 8.29, Std = 0.6700, ChiSquare = 2.3072e-01 1.V19 HA = 4.059(D), Expected = 4.19, Std = 0.5800, ChiSquare = 8.2131e-01 1.V19 HB = 2.208(D), Expected = 1.98, Std = 0.3200, ChiSquare = 4.7616e-01 1.V19 HG11 = 0.889(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.2048e-01 1.V19 HG12 = 0.889(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.2048e-01 1.V19 HG13 = 0.889(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.2048e-01 1.V19 HG21 = 0.898(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.2634e-01 1.V19 HG22 = 0.898(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.2634e-01 1.V19 HG23 = 0.898(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.2634e-01 1.V19 N = 109.681(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.1603e-02 1.D20 H = 7.677(D), Expected = 8.31, Std = 0.5800, ChiSquare = 2.7511e-01 1.D20 HA = 4.354(D), Expected = 4.59, Std = 0.3200, ChiSquare = 4.6082e-01 1.D20 HB2 = 2.740(D), Expected = 2.72, Std = 0.2600, ChiSquare = 9.3868e-01 1.D20 HB3 = 2.966(D), Expected = 2.66, Std = 0.2800, ChiSquare = 2.7446e-01 1.D20 N = 120.154(D), Expected = 120.65, Std = 3.8600, ChiSquare = 8.9776e-01 1.C21 H = 7.843(D), Expected = 8.39, Std = 0.6700, ChiSquare = 4.1426e-01 1.C21 HA = 5.070(D), Expected = 4.66, Std = 0.5500, ChiSquare = 4.5600e-01 1.C21 HB2 = 3.578(D), Expected = 2.96, Std = 0.4400, ChiSquare = 1.6016e-01 1.C21 HB3 = 2.709(D), Expected = 2.89, Std = 0.4600, ChiSquare = 6.9397e-01 1.C21 N = 116.632(D), Expected = 120.17, Std = 4.6400, ChiSquare = 4.4576e-01 1.C22 H = 9.733(D), Expected = 8.39, Std = 0.6700, ChiSquare = 4.5019e-02 1.C22 HA = 4.354(D), Expected = 4.66, Std = 0.5500, ChiSquare = 5.7796e-01 1.C22 HB2 = 2.314(D), Expected = 2.96, Std = 0.4400, ChiSquare = 1.4205e-01 1.C22 HB3 = 2.908(D), Expected = 2.89, Std = 0.4600, ChiSquare = 9.6879e-01 1.C22 N = 127.308(D), Expected = 120.17, Std = 4.6400, ChiSquare = 1.2396e-01 1.H23 H = 9.143(D), Expected = 8.24, Std = 0.6800, ChiSquare = 1.8420e-01 1.H23 HA = 4.855(D), Expected = 4.61, Std = 0.4300, ChiSquare = 5.6884e-01 1.H23 HB2 = 2.786(D), Expected = 3.10, Std = 0.3600, ChiSquare = 3.8309e-01 1.H23 HB3 = 3.485(D), Expected = 3.04, Std = 0.3800, ChiSquare = 2.4158e-01 1.H23 HD2 = 7.290(D), Expected = 7.00, Std = 0.4300, ChiSquare = 5.0005e-01 1.H23 HE1 = 8.548(D), Expected = 7.95, Std = 0.4800, ChiSquare = 2.1283e-01 1.H23 N = 113.422(D), Expected = 119.69, Std = 4.0000, ChiSquare = 1.1711e-01 1.G24 H = 7.420(D), Expected = 8.33, Std = 0.6500, ChiSquare = 1.6151e-01 1.G24 HA2 = 3.841(D), Expected = 3.97, Std = 0.3700, ChiSquare = 7.2735e-01 1.G24 HA3 = 3.844(D), Expected = 3.90, Std = 0.3700, ChiSquare = 8.7970e-01 1.G24 N = 103.912(D), Expected = 109.67, Std = 3.8700, ChiSquare = 1.3679e-01 1.V25 H = 7.744(D), Expected = 8.29, Std = 0.6700, ChiSquare = 4.1512e-01 1.V25 HA = 4.620(D), Expected = 4.19, Std = 0.5800, ChiSquare = 4.5846e-01 1.V25 HB = 2.032(D), Expected = 1.98, Std = 0.3200, ChiSquare = 8.7091e-01 1.V25 HG11 = 0.857(D), Expected = 0.83, Std = 0.2600, ChiSquare = 9.1729e-01 1.V25 HG12 = 0.857(D), Expected = 0.83, Std = 0.2600, ChiSquare = 9.1729e-01 1.V25 HG13 = 0.857(D), Expected = 0.83, Std = 0.2600, ChiSquare = 9.1729e-01 1.V25 HG21 = 0.923(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.6045e-01 1.V25 HG22 = 0.923(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.6045e-01 1.V25 HG23 = 0.923(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.6045e-01 1.V25 N = 116.860(D), Expected = 121.14, Std = 4.5400, ChiSquare = 3.4582e-01 1.C26 H = 12.660(A), Expected = 8.39, Std = 0.6700, ChiSquare = 1.8520e-10 1.C26 HA = 4.901(D), Expected = 4.66, Std = 0.5500, ChiSquare = 6.6125e-01 1.C26 HB2 = 2.587(D), Expected = 2.96, Std = 0.4400, ChiSquare = 3.9659e-01 1.C26 HB3 = 2.654(D), Expected = 2.89, Std = 0.4600, ChiSquare = 6.0792e-01 1.C26 N = 138.678(S), Expected = 120.17, Std = 4.6400, ChiSquare = 6.6410e-05 1.D27 H = 8.779(D), Expected = 8.31, Std = 0.5800, ChiSquare = 4.1873e-01 1.D27 HA = 4.935(D), Expected = 4.59, Std = 0.3200, ChiSquare = 2.8098e-01 1.D27 HB2 = 2.766(D), Expected = 2.72, Std = 0.2600, ChiSquare = 8.5957e-01 1.D27 HB3 = 2.315(D), Expected = 2.66, Std = 0.2800, ChiSquare = 2.1790e-01 1.D27 N = 129.144(D), Expected = 120.65, Std = 3.8600, ChiSquare = 2.7770e-02 1.S28 H = 8.974(D), Expected = 8.28, Std = 0.5900, ChiSquare = 2.3949e-01 1.S28 HA = 3.848(D), Expected = 4.48, Std = 0.4000, ChiSquare = 1.1411e-01 1.S28 HB2 = 3.975(D), Expected = 3.88, Std = 0.2500, ChiSquare = 7.0395e-01 1.S28 HB3 = 3.975(D), Expected = 3.85, Std = 0.2700, ChiSquare = 6.4339e-01 1.S28 N = 121.156(D), Expected = 116.28, Std = 3.5200, ChiSquare = 1.6598e-01 1.L29 H = 7.930(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.4441e-01 1.L29 HA = 3.717(D), Expected = 4.32, Std = 0.4700, ChiSquare = 1.9950e-01 1.L29 HB2 = 1.444(D), Expected = 1.61, Std = 0.3400, ChiSquare = 6.2538e-01 1.L29 HB3 = 1.923(D), Expected = 1.52, Std = 0.3600, ChiSquare = 2.6295e-01 1.L29 HG = 1.271(D), Expected = 1.51, Std = 0.3300, ChiSquare = 4.6892e-01 1.L29 HD11 = 0.781(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.1184e-01 1.L29 HD12 = 0.781(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.1184e-01 1.L29 HD13 = 0.781(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.1184e-01 1.L29 HD21 = 0.780(D), Expected = 0.73, Std = 0.2900, ChiSquare = 8.6311e-01 1.L29 HD22 = 0.780(D), Expected = 0.73, Std = 0.2900, ChiSquare = 8.6311e-01 1.L29 HD23 = 0.780(D), Expected = 0.73, Std = 0.2900, ChiSquare = 8.6311e-01 1.L29 N = 107.564(S), Expected = 121.86, Std = 3.9000, ChiSquare = 2.4672e-04 1.F30 H = 7.630(D), Expected = 8.36, Std = 0.7200, ChiSquare = 3.1064e-01 1.F30 HA = 5.087(D), Expected = 4.63, Std = 0.5700, ChiSquare = 4.2270e-01 1.F30 HB2 = 2.521(D), Expected = 3.00, Std = 0.3700, ChiSquare = 1.9546e-01 1.F30 HB3 = 2.614(D), Expected = 2.93, Std = 0.4000, ChiSquare = 4.2953e-01 1.F30 HD1 = 7.046(D), Expected = 7.06, Std = 0.3100, ChiSquare = 9.6398e-01 1.F30 HD2 = 7.046(D), Expected = 7.06, Std = 0.3100, ChiSquare = 9.6398e-01 1.F30 HE1 = 7.216(D), Expected = 7.08, Std = 0.3100, ChiSquare = 6.6087e-01 1.F30 HE2 = 7.216(D), Expected = 7.08, Std = 0.3200, ChiSquare = 6.7084e-01 1.F30 HZ = 7.174(D), Expected = 7.00, Std = 0.4200, ChiSquare = 6.7866e-01 1.F30 N = 116.360(D), Expected = 120.45, Std = 4.1800, ChiSquare = 3.2784e-01 1.C31 H = 9.089(D), Expected = 8.39, Std = 0.6700, ChiSquare = 2.9682e-01 1.C31 HA = 5.104(D), Expected = 4.66, Std = 0.5500, ChiSquare = 4.1951e-01 1.C31 HB2 = 3.049(D), Expected = 2.96, Std = 0.4400, ChiSquare = 8.3970e-01 1.C31 HB3 = 2.955(D), Expected = 2.89, Std = 0.4600, ChiSquare = 8.8763e-01 1.C31 N = 121.396(D), Expected = 120.17, Std = 4.6400, ChiSquare = 7.9161e-01 1.L32 H = 8.212(D), Expected = 8.23, Std = 0.6500, ChiSquare = 9.7791e-01 1.L32 HA = 4.022(D), Expected = 4.32, Std = 0.4700, ChiSquare = 5.2605e-01 1.L32 HB2 = 1.168(D), Expected = 1.61, Std = 0.3400, ChiSquare = 1.9360e-01 1.L32 HB3 = 1.246(D), Expected = 1.52, Std = 0.3600, ChiSquare = 4.4659e-01 1.L32 HG = 0.600(D), Expected = 1.51, Std = 0.3300, ChiSquare = 5.8232e-03 1.L32 HD11 = 0.633(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.7605e-01 1.L32 HD12 = 0.633(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.7605e-01 1.L32 HD13 = 0.633(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.7605e-01 1.L32 HD21 = 0.763(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.0940e-01 1.L32 HD22 = 0.763(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.0940e-01 1.L32 HD23 = 0.763(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.0940e-01 1.L32 N = 131.050(D), Expected = 121.86, Std = 3.9000, ChiSquare = 1.8453e-02 1.Y33 H = 7.076(D), Expected = 8.32, Std = 0.7300, ChiSquare = 8.8361e-02 1.Y33 HA = 4.499(D), Expected = 4.63, Std = 0.5600, ChiSquare = 8.1504e-01 1.Y33 HB2 = 3.124(D), Expected = 2.91, Std = 0.3700, ChiSquare = 5.6301e-01 1.Y33 HB3 = 2.535(D), Expected = 2.84, Std = 0.3900, ChiSquare = 4.3418e-01 1.Y33 HD1 = 6.951(D), Expected = 6.93, Std = 0.3000, ChiSquare = 9.4419e-01 1.Y33 HD2 = 6.951(D), Expected = 6.93, Std = 0.3000, ChiSquare = 9.4419e-01 1.Y33 HE1 = 6.740(D), Expected = 6.70, Std = 0.2300, ChiSquare = 8.6193e-01 1.Y33 HE2 = 6.740(D), Expected = 6.71, Std = 0.2300, ChiSquare = 8.9622e-01 1.Y33 N = 118.258(D), Expected = 120.52, Std = 4.2000, ChiSquare = 5.9018e-01