Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.R1 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.49 C 0.39 G 0.1 C Shift Assignments>> C :: 172.121(D) CA :: 55.630(D) CB :: 31.485(D) CG :: 26.494(D) CD :: 43.596(D) 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>> HA :: 4.461(D) HB2 :: 2.028(D) HB3 :: 2.028(D) HG2 :: 1.786(D) HG3 :: 1.786(D) HD2 :: 3.273(D) HD3 :: 3.273(D) HE :: 7.458(D) 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>> NE :: 84.655(D) 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.W2 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.52 C 0.47 C Shift Assignments>> C :: 175.437(D) CA :: 56.922(D) CB :: 31.441(D) CD1 :: 126.281(D) CE3 :: 120.594(D) CZ2 :: 114.573(D) CZ3 :: 122.074(D) CH2 :: 124.076(D) 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 :: 9.388(D) HA :: 5.289(D) HB2 :: 2.984(D) HB3 :: 2.748(D) HD1 :: 7.297(D) HE1 :: 10.266(D) HE3 :: 7.501(D) HZ2 :: 7.542(D) HZ3 :: 7.085(D) HH2 :: 7.138(D) 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 :: 127.405(D) NE1 :: 129.464(D) Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.C3 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.67 G 0.25 L 0.06 C Shift Assignments>> C :: 172.685(D) CA :: 55.809(D) CB :: 49.000(D) Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.316(D) HA :: 5.778(D) HB2 :: 2.433(D) HB3 :: 2.379(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 :: 119.199(D) Ave N Shift Values>> N :: 120.17(4.64) 1.V4 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.72 V 0.26 I 0.01 C Shift Assignments>> C :: 172.841(D) CA :: 59.431(D) CB :: 35.543(D) CG1 :: 21.191(D) 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 :: 9.143(D) HA :: 5.495(D) HB :: 2.192(D) HG11 :: 1.190(D) HG12 :: 1.190(D) HG13 :: 1.190(D) HG21 :: 1.190(D) HG22 :: 1.190(D) HG23 :: 1.190(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 :: 118.724(D) Ave N Shift Values>> N :: 121.14(4.54) 1.Y5 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.73 C 0.24 G 0.01 C Shift Assignments>> C :: 174.209(D) CA :: 56.773(D) CB :: 42.109(D) CD1 :: 132.707(D) CE1 :: 117.778(D) 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 :: 8.683(D) HA :: 5.420(D) HB2 :: 3.262(D) HB3 :: 3.161(D) HD1 :: 7.178(D) HD2 :: 7.178(D) HE1 :: 6.738(D) HE2 :: 6.738(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 :: 124.831(D) Ave N Shift Values>> N :: 120.52(4.2) 1.A6 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Suspicious N Shifts: Duplicate PRTL>> A 0.54 L 0.29 C 0.15 C Shift Assignments>> C :: 175.258(D) CA :: 50.147(D) CB :: 22.593(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.504(D) HA :: 6.156(S) HB1 :: 1.506(D) HB2 :: 1.506(D) HB3 :: 1.506(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 126.070(D) Ave N Shift Values>> N :: 123.23(3.54) 1.Y7 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.73 C 0.25 G 0.01 C Shift Assignments>> C :: 174.002(D) CA :: 57.630(D) CB :: 42.039(D) CD1 :: 132.514(D) CE1 :: 117.971(D) 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 :: 8.937(D) HA :: 5.275(D) HB2 :: 3.103(D) HB3 :: 2.867(D) HD1 :: 7.072(D) HD2 :: 7.072(D) HE1 :: 6.809(D) HE2 :: 6.809(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 :: 123.241(D) Ave N Shift Values>> N :: 120.52(4.2) 1.V8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.58 V 0.41 C Shift Assignments>> C :: 173.969(D) CA :: 60.223(D) CB :: 35.587(D) CG1 :: 21.335(D) CG2 :: 21.005 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 :: 9.001(D) HA :: 5.304(D) HB :: 2.103(D) HG11 :: 1.116(D) HG12 :: 1.116(D) HG13 :: 1.116(D) HG21 :: 1.116(D) HG22 :: 1.116(D) HG23 :: 1.116(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 :: 125.612(D) Ave N Shift Values>> N :: 121.14(4.54) 1.R9 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.51 G 0.25 R 0.23 C Shift Assignments>> C :: 174.466(D) CA :: 54.917(D) CB :: 33.838(D) CG :: 28.310(D) CD :: 43.937(D) 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 :: 9.110(D) HA :: 5.640(D) HB2 :: 1.695(D) HB3 :: 2.079(D) HG2 :: 1.563(D) HG3 :: 1.563(D) HD2 :: 3.342(D) HD3 :: 3.140(D) HE :: 7.851(D) 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 :: 127.742(D) NE :: 84.502(D) 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.I10 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.52 C 0.46 C Shift Assignments>> C :: 174.343(D) CA :: 59.961(D) CB :: 41.630(D) CG1 :: 27.622(D) CG2 :: 17.972(D) CD1 :: 14.222(D) 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 :: 8.545(D) HA :: 4.346 HB :: 1.930(D) HG12 :: 1.667(D) HG13 :: 1.238(D) HG21 :: 1.055(D) HG22 :: 1.055(D) HG23 :: 1.055(D) HD11 :: 0.945(D) HD12 :: 0.945(D) HD13 :: 0.945(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 :: 124.114(D) Ave N Shift Values>> N :: 121.46(4.28) 1.R11 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.46 R 0.38 G 0.1 L 0.04 C Shift Assignments>> C :: 175.827(D) CA :: 57.463(D) CB :: 28.492(D) CG :: 28.248(D) CD :: 43.537(D) 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 :: 9.293(D) HA :: 3.952(D) HB2 :: 2.249(D) HB3 :: 1.998(D) HG2 :: 1.810(D) HG3 :: 1.810(D) HD2 :: 3.315(D) HD3 :: 3.315(D) HE :: 7.714(D) HH11 :: 7.030 HH22 :: 7.030 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 :: 123.309(D) NE :: 84.688(D) 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.G12 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.88 L 0.07 C 0.03 C Shift Assignments>> C :: 174.013(D) CA :: 45.763(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.572(D) HA2 :: 4.134(D) HA3 :: 3.822(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.195(D) Ave N Shift Values>> N :: 109.67(3.87) 1.V13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.66 C 0.33 C Shift Assignments>> C :: 173.517(D) CA :: 62.214(D) CB :: 33.183(D) CG1 :: 21.523(D) CG2 :: 21.463(D) 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 :: 8.357(D) HA :: 4.263(D) HB :: 2.347(D) HG11 :: 1.038(D) HG12 :: 1.038(D) HG13 :: 1.038(D) HG21 :: 0.965(D) HG22 :: 0.965(D) HG23 :: 0.965(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 :: 122.841(D) Ave N Shift Values>> N :: 121.14(4.54) 1.L14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.37 G 0.33 C 0.19 R 0.07 A 0.02 C Shift Assignments>> C :: 175.688 CA :: 53.835(D) CB :: 44.485(D) CG :: 27.875(D) CD1 :: 26.026(D) CD2 :: 23.699(D) 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 :: 8.370(D) HA :: 5.275(D) HB2 :: 1.948(D) HB3 :: 1.376(D) HG :: 1.425(D) HD11 :: 1.008(D) HD12 :: 1.008(D) HD13 :: 1.008(D) HD21 :: 0.807(D) HD22 :: 0.807(D) HD23 :: 0.807(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 :: 128.569(D) Ave N Shift Values>> N :: 121.86(3.9) 1.V15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.6 C 0.39 C Shift Assignments>> C :: 173.377(D) CA :: 61.664(D) CB :: 34.579(D) CG1 :: 21.146(D) CG2 :: 21.080 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 :: 9.521(D) HA :: 4.389(D) HB :: 2.055(D) HG11 :: 0.964(D) HG12 :: 0.964(D) HG13 :: 0.964(D) HG21 :: 0.964(D) HG22 :: 0.964(D) HG23 :: 0.964(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 :: 127.701(D) Ave N Shift Values>> N :: 121.14(4.54) 1.R16 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.36 G 0.36 R 0.26 C Shift Assignments>> C :: 174.929(D) CA :: 54.181(D) CB :: 32.788(D) CG :: 26.732(D) CD :: 44.355(D) 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 :: 8.398(D) HA :: 5.346(D) HB2 :: 1.893(D) HB3 :: 1.893(D) HG2 :: 1.716(D) HG3 :: 1.716(D) HD2 :: 3.396(D) HD3 :: 3.396(D) HE :: 7.590(D) 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 :: 125.034(D) NE :: 84.502(D) 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.Y17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.59 C 0.25 G 0.14 C Shift Assignments>> C :: 172.657(D) CA :: 58.115(D) CB :: 43.225(D) CD1 :: 132.152(D) CE1 :: 118.140(D) 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 :: 9.024(D) HA :: 4.845(D) HB2 :: 2.884(D) HB3 :: 2.699(D) HD1 :: 6.990(D) HD2 :: 6.990(D) HE1 :: 6.778(D) HE2 :: 6.778(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 :: 124.435(D) Ave N Shift Values>> N :: 120.52(4.2) 1.R18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.39 G 0.31 R 0.29 C Shift Assignments>> C :: 174.226(D) CA :: 53.998(D) CB :: 33.180(D) CG :: 26.421(D) CD :: 44.058(D) 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 :: 7.611(D) HA :: 5.301(D) HB2 :: 1.641(D) HB3 :: 1.586(D) HG2 :: 1.467(D) HG3 :: 1.424(D) HD2 :: 3.134(D) HD3 :: 3.134(D) HE :: 7.513(D) 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 :: 125.570(D) NE :: 85.045(D) 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.R19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.63 R 0.28 G 0.08 C Shift Assignments>> C :: 173.969(D) CA :: 55.906(D) CB :: 34.572(D) CG :: 27.499(D) CD :: 43.113(D) 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 :: 8.391(D) HA :: 4.280(D) HB2 :: 1.646(D) HB3 :: 1.459(D) HG2 :: 1.372(D) HG3 :: 1.235(D) HD2 :: 3.149(D) HD3 :: 3.075(D) HE :: 7.204(D) 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 :: 123.948(D) NE :: 85.606(D) 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.C20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.46 C 0.42 L 0.1 C Shift Assignments>> C :: 173.221(D) CA :: 55.959(D) CB :: 48.313(D) Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.407(D) HA :: 5.911(D) HB2 :: 3.055(D) HB3 :: 2.915(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 :: 121.154(D) Ave N Shift Values>> N :: 120.17(4.64) 1.W21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.52 C 0.47 C Shift Assignments>> CA :: 60.715(D) CB :: 32.157(D) CD1 :: 126.703(D) CE3 :: 120.210(D) CZ2 :: 114.094(D) CZ3 :: 121.531(D) CH2 :: 123.409(D) 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 :: 9.540(D) HA :: 4.633(D) HB2 :: 3.450(D) HB3 :: 3.271(D) HD1 :: 7.343(D) HE1 :: 9.950(D) HE3 :: 7.613(D) HZ2 :: 7.184(D) HZ3 :: 6.974(D) HH2 :: 7.012(D) 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 :: 129.492(D) NE1 :: 128.258(D) Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) ########################################################################### Overall Results: #Consistent: 0 #Clerical: 20 #Suspicious: 1 #Anomalous: 0 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 21 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 0 Shift Relative Order (SRO) Results: #Consistent: 21 #Suspicious: 0 C Shift Results: #Consistent: 3 #Duplicate: 99 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 3 #Duplicate: 169 #Unknown: 0 #Suspicious: 1 #Anomalous: 0 N Shift Results: #Consistent: 0 #Duplicate: 28 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.R1 C = 172.121(D), Expected = 176.41, Std = 2.0300, ChiSquare = 3.4617e-02 1.R1 CA = 55.630(D), Expected = 56.77, Std = 2.3100, ChiSquare = 6.2165e-01 1.R1 CB = 31.485(D), Expected = 30.70, Std = 1.8300, ChiSquare = 6.6795e-01 1.R1 CG = 26.494(D), Expected = 27.21, Std = 1.2000, ChiSquare = 5.5073e-01 1.R1 CD = 43.596(D), Expected = 43.16, Std = 0.8800, ChiSquare = 6.2028e-01 1.R1 HA = 4.461(D), Expected = 4.30, Std = 0.4600, ChiSquare = 7.2634e-01 1.R1 HB2 = 2.028(D), Expected = 1.79, Std = 0.2700, ChiSquare = 3.7806e-01 1.R1 HB3 = 2.028(D), Expected = 1.76, Std = 0.2800, ChiSquare = 3.3850e-01 1.R1 HG2 = 1.786(D), Expected = 1.57, Std = 0.2700, ChiSquare = 4.2371e-01 1.R1 HG3 = 1.786(D), Expected = 1.54, Std = 0.2900, ChiSquare = 3.9628e-01 1.R1 HD2 = 3.273(D), Expected = 3.12, Std = 0.2400, ChiSquare = 5.2380e-01 1.R1 HD3 = 3.273(D), Expected = 3.10, Std = 0.2600, ChiSquare = 5.0580e-01 1.R1 HE = 7.458(D), Expected = 7.40, Std = 0.6300, ChiSquare = 9.2665e-01 1.R1 NE = 84.655(D), Expected = 84.63, Std = 1.6800, ChiSquare = 9.8813e-01 1.W2 C = 175.437(D), Expected = 176.12, Std = 2.0100, ChiSquare = 7.3401e-01 1.W2 CA = 56.922(D), Expected = 57.66, Std = 2.5800, ChiSquare = 7.7484e-01 1.W2 CB = 31.441(D), Expected = 30.01, Std = 2.0100, ChiSquare = 4.7650e-01 1.W2 CD1 = 126.281(D), Expected = 126.51, Std = 1.8300, ChiSquare = 9.0042e-01 1.W2 CE3 = 120.594(D), Expected = 120.43, Std = 1.7900, ChiSquare = 9.2700e-01 1.W2 CZ2 = 114.573(D), Expected = 114.26, Std = 1.1200, ChiSquare = 7.7989e-01 1.W2 CZ3 = 122.074(D), Expected = 121.35, Std = 1.5300, ChiSquare = 6.3607e-01 1.W2 CH2 = 124.076(D), Expected = 123.86, Std = 1.4200, ChiSquare = 8.7910e-01 1.W2 H = 9.388(D), Expected = 8.29, Std = 0.7900, ChiSquare = 1.6457e-01 1.W2 HA = 5.289(D), Expected = 4.68, Std = 0.5300, ChiSquare = 2.5053e-01 1.W2 HB2 = 2.984(D), Expected = 3.19, Std = 0.3500, ChiSquare = 5.5615e-01 1.W2 HB3 = 2.748(D), Expected = 3.12, Std = 0.3600, ChiSquare = 3.0145e-01 1.W2 HD1 = 7.297(D), Expected = 7.14, Std = 0.3600, ChiSquare = 6.6276e-01 1.W2 HE1 = 10.266(D), Expected = 10.08, Std = 0.6600, ChiSquare = 7.7808e-01 1.W2 HE3 = 7.501(D), Expected = 7.31, Std = 0.4100, ChiSquare = 6.4132e-01 1.W2 HZ2 = 7.542(D), Expected = 7.28, Std = 0.3300, ChiSquare = 4.2723e-01 1.W2 HZ3 = 7.085(D), Expected = 6.86, Std = 0.4000, ChiSquare = 5.7378e-01 1.W2 HH2 = 7.138(D), Expected = 6.98, Std = 0.3900, ChiSquare = 6.8538e-01 1.W2 N = 127.405(D), Expected = 121.68, Std = 4.1800, ChiSquare = 1.7081e-01 1.W2 NE1 = 129.464(D), Expected = 129.32, Std = 2.1100, ChiSquare = 9.4559e-01 1.C3 C = 172.685(D), Expected = 174.95, Std = 2.0700, ChiSquare = 2.7387e-01 1.C3 CA = 55.809(D), Expected = 58.30, Std = 3.3300, ChiSquare = 4.5443e-01 1.C3 CB = 49.000(D), Expected = 32.49, Std = 6.0100, ChiSquare = 6.0127e-03 1.C3 H = 8.316(D), Expected = 8.39, Std = 0.6700, ChiSquare = 9.1205e-01 1.C3 HA = 5.778(D), Expected = 4.66, Std = 0.5500, ChiSquare = 4.2080e-02 1.C3 HB2 = 2.433(D), Expected = 2.96, Std = 0.4400, ChiSquare = 2.3102e-01 1.C3 HB3 = 2.379(D), Expected = 2.89, Std = 0.4600, ChiSquare = 2.6662e-01 1.C3 N = 119.199(D), Expected = 120.17, Std = 4.6400, ChiSquare = 8.3424e-01 1.V4 C = 172.841(D), Expected = 175.62, Std = 1.9000, ChiSquare = 1.4357e-01 1.V4 CA = 59.431(D), Expected = 62.49, Std = 2.8600, ChiSquare = 2.8481e-01 1.V4 CB = 35.543(D), Expected = 32.73, Std = 1.7900, ChiSquare = 1.1606e-01 1.V4 CG1 = 21.191(D), Expected = 21.49, Std = 1.3600, ChiSquare = 8.2599e-01 1.V4 H = 9.143(D), Expected = 8.29, Std = 0.6700, ChiSquare = 2.0297e-01 1.V4 HA = 5.495(D), Expected = 4.19, Std = 0.5800, ChiSquare = 2.4449e-02 1.V4 HB = 2.192(D), Expected = 1.98, Std = 0.3200, ChiSquare = 5.0765e-01 1.V4 HG11 = 1.190(D), Expected = 0.83, Std = 0.2600, ChiSquare = 1.6617e-01 1.V4 HG12 = 1.190(D), Expected = 0.83, Std = 0.2600, ChiSquare = 1.6617e-01 1.V4 HG13 = 1.190(D), Expected = 0.83, Std = 0.2600, ChiSquare = 1.6617e-01 1.V4 HG21 = 1.190(D), Expected = 0.80, Std = 0.2800, ChiSquare = 1.6366e-01 1.V4 HG22 = 1.190(D), Expected = 0.80, Std = 0.2800, ChiSquare = 1.6366e-01 1.V4 HG23 = 1.190(D), Expected = 0.80, Std = 0.2800, ChiSquare = 1.6366e-01 1.V4 N = 118.724(D), Expected = 121.14, Std = 4.5400, ChiSquare = 5.9462e-01 1.Y5 C = 174.209(D), Expected = 175.40, Std = 1.9900, ChiSquare = 5.4951e-01 1.Y5 CA = 56.773(D), Expected = 58.13, Std = 2.5100, ChiSquare = 5.8876e-01 1.Y5 CB = 42.109(D), Expected = 39.32, Std = 2.1600, ChiSquare = 1.9663e-01 1.Y5 CD1 = 132.707(D), Expected = 132.77, Std = 1.1700, ChiSquare = 9.5706e-01 1.Y5 CE1 = 117.778(D), Expected = 117.93, Std = 1.1900, ChiSquare = 8.9836e-01 1.Y5 H = 8.683(D), Expected = 8.32, Std = 0.7300, ChiSquare = 6.1901e-01 1.Y5 HA = 5.420(D), Expected = 4.63, Std = 0.5600, ChiSquare = 1.5833e-01 1.Y5 HB2 = 3.262(D), Expected = 2.91, Std = 0.3700, ChiSquare = 3.4143e-01 1.Y5 HB3 = 3.161(D), Expected = 2.84, Std = 0.3900, ChiSquare = 4.1046e-01 1.Y5 HD1 = 7.178(D), Expected = 6.93, Std = 0.3000, ChiSquare = 4.0843e-01 1.Y5 HD2 = 7.178(D), Expected = 6.93, Std = 0.3000, ChiSquare = 4.0843e-01 1.Y5 HE1 = 6.738(D), Expected = 6.70, Std = 0.2300, ChiSquare = 8.6877e-01 1.Y5 HE2 = 6.738(D), Expected = 6.71, Std = 0.2300, ChiSquare = 9.0311e-01 1.Y5 N = 124.831(D), Expected = 120.52, Std = 4.2000, ChiSquare = 3.0469e-01 1.A6 C = 175.258(D), Expected = 177.74, Std = 2.1300, ChiSquare = 2.4391e-01 1.A6 CA = 50.147(D), Expected = 53.14, Std = 1.9800, ChiSquare = 1.3063e-01 1.A6 CB = 22.593(D), Expected = 19.01, Std = 1.8300, ChiSquare = 5.0239e-02 1.A6 H = 9.504(D), Expected = 8.20, Std = 0.6000, ChiSquare = 2.9755e-02 1.A6 HA = 6.156(S), Expected = 4.26, Std = 0.4400, ChiSquare = 1.6393e-05 1.A6 HB1 = 1.506(D), Expected = 1.35, Std = 0.2600, ChiSquare = 5.4851e-01 1.A6 HB2 = 1.506(D), Expected = 1.35, Std = 0.2600, ChiSquare = 5.4851e-01 1.A6 HB3 = 1.506(D), Expected = 1.35, Std = 0.2600, ChiSquare = 5.4851e-01 1.A6 N = 126.070(D), Expected = 123.23, Std = 3.5400, ChiSquare = 4.2240e-01 1.Y7 C = 174.002(D), Expected = 175.40, Std = 1.9900, ChiSquare = 4.8236e-01 1.Y7 CA = 57.630(D), Expected = 58.13, Std = 2.5100, ChiSquare = 8.4210e-01 1.Y7 CB = 42.039(D), Expected = 39.32, Std = 2.1600, ChiSquare = 2.0810e-01 1.Y7 CD1 = 132.514(D), Expected = 132.77, Std = 1.1700, ChiSquare = 8.2680e-01 1.Y7 CE1 = 117.971(D), Expected = 117.93, Std = 1.1900, ChiSquare = 9.7252e-01 1.Y7 H = 8.937(D), Expected = 8.32, Std = 0.7300, ChiSquare = 3.9800e-01 1.Y7 HA = 5.275(D), Expected = 4.63, Std = 0.5600, ChiSquare = 2.4941e-01 1.Y7 HB2 = 3.103(D), Expected = 2.91, Std = 0.3700, ChiSquare = 6.0193e-01 1.Y7 HB3 = 2.867(D), Expected = 2.84, Std = 0.3900, ChiSquare = 9.4481e-01 1.Y7 HD1 = 7.072(D), Expected = 6.93, Std = 0.3000, ChiSquare = 6.3598e-01 1.Y7 HD2 = 7.072(D), Expected = 6.93, Std = 0.3000, ChiSquare = 6.3598e-01 1.Y7 HE1 = 6.809(D), Expected = 6.70, Std = 0.2300, ChiSquare = 6.3556e-01 1.Y7 HE2 = 6.809(D), Expected = 6.71, Std = 0.2300, ChiSquare = 6.6688e-01 1.Y7 N = 123.241(D), Expected = 120.52, Std = 4.2000, ChiSquare = 5.1708e-01 1.V8 C = 173.969(D), Expected = 175.62, Std = 1.9000, ChiSquare = 3.8488e-01 1.V8 CA = 60.223(D), Expected = 62.49, Std = 2.8600, ChiSquare = 4.2798e-01 1.V8 CB = 35.587(D), Expected = 32.73, Std = 1.7900, ChiSquare = 1.1047e-01 1.V8 CG1 = 21.335(D), Expected = 21.49, Std = 1.3600, ChiSquare = 9.0926e-01 1.V8 H = 9.001(D), Expected = 8.29, Std = 0.6700, ChiSquare = 2.8860e-01 1.V8 HA = 5.304(D), Expected = 4.19, Std = 0.5800, ChiSquare = 5.4771e-02 1.V8 HB = 2.103(D), Expected = 1.98, Std = 0.3200, ChiSquare = 7.0070e-01 1.V8 HG11 = 1.116(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.7133e-01 1.V8 HG12 = 1.116(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.7133e-01 1.V8 HG13 = 1.116(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.7133e-01 1.V8 HG21 = 1.116(D), Expected = 0.80, Std = 0.2800, ChiSquare = 2.5908e-01 1.V8 HG22 = 1.116(D), Expected = 0.80, Std = 0.2800, ChiSquare = 2.5908e-01 1.V8 HG23 = 1.116(D), Expected = 0.80, Std = 0.2800, ChiSquare = 2.5908e-01 1.V8 N = 125.612(D), Expected = 121.14, Std = 4.5400, ChiSquare = 3.2461e-01 1.R9 C = 174.466(D), Expected = 176.41, Std = 2.0300, ChiSquare = 3.3825e-01 1.R9 CA = 54.917(D), Expected = 56.77, Std = 2.3100, ChiSquare = 4.2246e-01 1.R9 CB = 33.838(D), Expected = 30.70, Std = 1.8300, ChiSquare = 8.6390e-02 1.R9 CG = 28.310(D), Expected = 27.21, Std = 1.2000, ChiSquare = 3.5932e-01 1.R9 CD = 43.937(D), Expected = 43.16, Std = 0.8800, ChiSquare = 3.7726e-01 1.R9 H = 9.110(D), Expected = 8.24, Std = 0.6100, ChiSquare = 1.5380e-01 1.R9 HA = 5.640(D), Expected = 4.30, Std = 0.4600, ChiSquare = 3.5792e-03 1.R9 HB2 = 1.695(D), Expected = 1.79, Std = 0.2700, ChiSquare = 7.2495e-01 1.R9 HB3 = 2.079(D), Expected = 1.76, Std = 0.2800, ChiSquare = 2.5458e-01 1.R9 HG2 = 1.563(D), Expected = 1.57, Std = 0.2700, ChiSquare = 9.7932e-01 1.R9 HG3 = 1.563(D), Expected = 1.54, Std = 0.2900, ChiSquare = 9.3679e-01 1.R9 HD2 = 3.342(D), Expected = 3.12, Std = 0.2400, ChiSquare = 3.5497e-01 1.R9 HD3 = 3.140(D), Expected = 3.10, Std = 0.2600, ChiSquare = 8.7773e-01 1.R9 HE = 7.851(D), Expected = 7.40, Std = 0.6300, ChiSquare = 4.7407e-01 1.R9 N = 127.742(D), Expected = 120.80, Std = 3.6800, ChiSquare = 5.9240e-02 1.R9 NE = 84.502(D), Expected = 84.63, Std = 1.6800, ChiSquare = 9.3927e-01 1.I10 C = 174.343(D), Expected = 175.85, Std = 1.9200, ChiSquare = 4.3251e-01 1.I10 CA = 59.961(D), Expected = 61.61, Std = 2.6800, ChiSquare = 5.3836e-01 1.I10 CB = 41.630(D), Expected = 38.63, Std = 2.0200, ChiSquare = 1.3750e-01 1.I10 CG1 = 27.622(D), Expected = 27.71, Std = 1.6800, ChiSquare = 9.5823e-01 1.I10 CG2 = 17.972(D), Expected = 17.53, Std = 1.3600, ChiSquare = 7.4518e-01 1.I10 CD1 = 14.222(D), Expected = 13.43, Std = 1.6700, ChiSquare = 6.3532e-01 1.I10 H = 8.545(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.9675e-01 1.I10 HB = 1.930(D), Expected = 1.78, Std = 0.2900, ChiSquare = 6.0499e-01 1.I10 HG12 = 1.667(D), Expected = 1.28, Std = 0.4000, ChiSquare = 3.3329e-01 1.I10 HG13 = 1.238(D), Expected = 1.19, Std = 0.4100, ChiSquare = 9.0680e-01 1.I10 HG21 = 1.055(D), Expected = 0.77, Std = 0.2700, ChiSquare = 2.9117e-01 1.I10 HG22 = 1.055(D), Expected = 0.77, Std = 0.2700, ChiSquare = 2.9117e-01 1.I10 HG23 = 1.055(D), Expected = 0.77, Std = 0.2700, ChiSquare = 2.9117e-01 1.I10 HD11 = 0.945(D), Expected = 0.68, Std = 0.2900, ChiSquare = 3.6083e-01 1.I10 HD12 = 0.945(D), Expected = 0.68, Std = 0.2900, ChiSquare = 3.6083e-01 1.I10 HD13 = 0.945(D), Expected = 0.68, Std = 0.2900, ChiSquare = 3.6083e-01 1.I10 N = 124.114(D), Expected = 121.46, Std = 4.2800, ChiSquare = 5.3520e-01 1.R11 C = 175.827(D), Expected = 176.41, Std = 2.0300, ChiSquare = 7.7397e-01 1.R11 CA = 57.463(D), Expected = 56.77, Std = 2.3100, ChiSquare = 7.6418e-01 1.R11 CB = 28.492(D), Expected = 30.70, Std = 1.8300, ChiSquare = 2.2760e-01 1.R11 CG = 28.248(D), Expected = 27.21, Std = 1.2000, ChiSquare = 3.8704e-01 1.R11 CD = 43.537(D), Expected = 43.16, Std = 0.8800, ChiSquare = 6.6835e-01 1.R11 H = 9.293(D), Expected = 8.24, Std = 0.6100, ChiSquare = 8.4306e-02 1.R11 HA = 3.952(D), Expected = 4.30, Std = 0.4600, ChiSquare = 4.4934e-01 1.R11 HB2 = 2.249(D), Expected = 1.79, Std = 0.2700, ChiSquare = 8.9131e-02 1.R11 HB3 = 1.998(D), Expected = 1.76, Std = 0.2800, ChiSquare = 3.9533e-01 1.R11 HG2 = 1.810(D), Expected = 1.57, Std = 0.2700, ChiSquare = 3.7406e-01 1.R11 HG3 = 1.810(D), Expected = 1.54, Std = 0.2900, ChiSquare = 3.5184e-01 1.R11 HD2 = 3.315(D), Expected = 3.12, Std = 0.2400, ChiSquare = 4.1651e-01 1.R11 HD3 = 3.315(D), Expected = 3.10, Std = 0.2600, ChiSquare = 4.0828e-01 1.R11 HE = 7.714(D), Expected = 7.40, Std = 0.6300, ChiSquare = 6.1819e-01 1.R11 N = 123.309(D), Expected = 120.80, Std = 3.6800, ChiSquare = 4.9537e-01 1.R11 NE = 84.688(D), Expected = 84.63, Std = 1.6800, ChiSquare = 9.7246e-01 1.G12 C = 174.013(D), Expected = 173.87, Std = 1.8800, ChiSquare = 9.3937e-01 1.G12 CA = 45.763(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.5792e-01 1.G12 H = 8.572(D), Expected = 8.33, Std = 0.6500, ChiSquare = 7.0966e-01 1.G12 HA2 = 4.134(D), Expected = 3.97, Std = 0.3700, ChiSquare = 6.5759e-01 1.G12 HA3 = 3.822(D), Expected = 3.90, Std = 0.3700, ChiSquare = 8.3303e-01 1.G12 N = 106.195(D), Expected = 109.67, Std = 3.8700, ChiSquare = 3.6922e-01 1.V13 C = 173.517(D), Expected = 175.62, Std = 1.9000, ChiSquare = 2.6836e-01 1.V13 CA = 62.214(D), Expected = 62.49, Std = 2.8600, ChiSquare = 9.2312e-01 1.V13 CB = 33.183(D), Expected = 32.73, Std = 1.7900, ChiSquare = 8.0021e-01 1.V13 CG1 = 21.523(D), Expected = 21.49, Std = 1.3600, ChiSquare = 9.8064e-01 1.V13 CG2 = 21.463(D), Expected = 21.26, Std = 1.5600, ChiSquare = 8.9647e-01 1.V13 H = 8.357(D), Expected = 8.29, Std = 0.6700, ChiSquare = 9.2034e-01 1.V13 HA = 4.263(D), Expected = 4.19, Std = 0.5800, ChiSquare = 8.9984e-01 1.V13 HB = 2.347(D), Expected = 1.98, Std = 0.3200, ChiSquare = 2.5143e-01 1.V13 HG11 = 1.038(D), Expected = 0.83, Std = 0.2600, ChiSquare = 4.2371e-01 1.V13 HG12 = 1.038(D), Expected = 0.83, Std = 0.2600, ChiSquare = 4.2371e-01 1.V13 HG13 = 1.038(D), Expected = 0.83, Std = 0.2600, ChiSquare = 4.2371e-01 1.V13 HG21 = 0.965(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.5567e-01 1.V13 HG22 = 0.965(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.5567e-01 1.V13 HG23 = 0.965(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.5567e-01 1.V13 N = 122.841(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.0791e-01 1.L14 CA = 53.835(D), Expected = 55.62, Std = 2.1300, ChiSquare = 4.0202e-01 1.L14 CB = 44.485(D), Expected = 42.31, Std = 1.8800, ChiSquare = 2.4731e-01 1.L14 CG = 27.875(D), Expected = 26.78, Std = 1.1000, ChiSquare = 3.1952e-01 1.L14 CD1 = 26.026(D), Expected = 24.72, Std = 1.5900, ChiSquare = 4.1143e-01 1.L14 CD2 = 23.699(D), Expected = 24.05, Std = 1.7000, ChiSquare = 8.3642e-01 1.L14 H = 8.370(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.2947e-01 1.L14 HA = 5.275(D), Expected = 4.32, Std = 0.4700, ChiSquare = 4.2162e-02 1.L14 HB2 = 1.948(D), Expected = 1.61, Std = 0.3400, ChiSquare = 3.2017e-01 1.L14 HB3 = 1.376(D), Expected = 1.52, Std = 0.3600, ChiSquare = 6.8916e-01 1.L14 HG = 1.425(D), Expected = 1.51, Std = 0.3300, ChiSquare = 7.9673e-01 1.L14 HD11 = 1.008(D), Expected = 0.75, Std = 0.2800, ChiSquare = 3.5683e-01 1.L14 HD12 = 1.008(D), Expected = 0.75, Std = 0.2800, ChiSquare = 3.5683e-01 1.L14 HD13 = 1.008(D), Expected = 0.75, Std = 0.2800, ChiSquare = 3.5683e-01 1.L14 HD21 = 0.807(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.9061e-01 1.L14 HD22 = 0.807(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.9061e-01 1.L14 HD23 = 0.807(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.9061e-01 1.L14 N = 128.569(D), Expected = 121.86, Std = 3.9000, ChiSquare = 8.5386e-02 1.V15 C = 173.377(D), Expected = 175.62, Std = 1.9000, ChiSquare = 2.3779e-01 1.V15 CA = 61.664(D), Expected = 62.49, Std = 2.8600, ChiSquare = 7.7273e-01 1.V15 CB = 34.579(D), Expected = 32.73, Std = 1.7900, ChiSquare = 3.0162e-01 1.V15 CG1 = 21.146(D), Expected = 21.49, Std = 1.3600, ChiSquare = 8.0031e-01 1.V15 H = 9.521(D), Expected = 8.29, Std = 0.6700, ChiSquare = 6.6164e-02 1.V15 HA = 4.389(D), Expected = 4.19, Std = 0.5800, ChiSquare = 7.3152e-01 1.V15 HB = 2.055(D), Expected = 1.98, Std = 0.3200, ChiSquare = 8.1469e-01 1.V15 HG11 = 0.964(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.0628e-01 1.V15 HG12 = 0.964(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.0628e-01 1.V15 HG13 = 0.964(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.0628e-01 1.V15 HG21 = 0.964(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.5807e-01 1.V15 HG22 = 0.964(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.5807e-01 1.V15 HG23 = 0.964(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.5807e-01 1.V15 N = 127.701(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.4841e-01 1.R16 C = 174.929(D), Expected = 176.41, Std = 2.0300, ChiSquare = 4.6566e-01 1.R16 CA = 54.181(D), Expected = 56.77, Std = 2.3100, ChiSquare = 2.6238e-01 1.R16 CB = 32.788(D), Expected = 30.70, Std = 1.8300, ChiSquare = 2.5388e-01 1.R16 CG = 26.732(D), Expected = 27.21, Std = 1.2000, ChiSquare = 6.9038e-01 1.R16 CD = 44.355(D), Expected = 43.16, Std = 0.8800, ChiSquare = 1.7448e-01 1.R16 H = 8.398(D), Expected = 8.24, Std = 0.6100, ChiSquare = 7.9562e-01 1.R16 HA = 5.346(D), Expected = 4.30, Std = 0.4600, ChiSquare = 2.2971e-02 1.R16 HB2 = 1.893(D), Expected = 1.79, Std = 0.2700, ChiSquare = 7.0285e-01 1.R16 HB3 = 1.893(D), Expected = 1.76, Std = 0.2800, ChiSquare = 6.3479e-01 1.R16 HG2 = 1.716(D), Expected = 1.57, Std = 0.2700, ChiSquare = 5.8869e-01 1.R16 HG3 = 1.716(D), Expected = 1.54, Std = 0.2900, ChiSquare = 5.4392e-01 1.R16 HD2 = 3.396(D), Expected = 3.12, Std = 0.2400, ChiSquare = 2.5014e-01 1.R16 HD3 = 3.396(D), Expected = 3.10, Std = 0.2600, ChiSquare = 2.5493e-01 1.R16 HE = 7.590(D), Expected = 7.40, Std = 0.6300, ChiSquare = 7.6297e-01 1.R16 N = 125.034(D), Expected = 120.80, Std = 3.6800, ChiSquare = 2.4992e-01 1.R16 NE = 84.502(D), Expected = 84.63, Std = 1.6800, ChiSquare = 9.3927e-01 1.Y17 C = 172.657(D), Expected = 175.40, Std = 1.9900, ChiSquare = 1.6808e-01 1.Y17 CA = 58.115(D), Expected = 58.13, Std = 2.5100, ChiSquare = 9.9523e-01 1.Y17 CB = 43.225(D), Expected = 39.32, Std = 2.1600, ChiSquare = 7.0627e-02 1.Y17 CD1 = 132.152(D), Expected = 132.77, Std = 1.1700, ChiSquare = 5.9736e-01 1.Y17 CE1 = 118.140(D), Expected = 117.93, Std = 1.1900, ChiSquare = 8.5992e-01 1.Y17 H = 9.024(D), Expected = 8.32, Std = 0.7300, ChiSquare = 3.3485e-01 1.Y17 HA = 4.845(D), Expected = 4.63, Std = 0.5600, ChiSquare = 7.0103e-01 1.Y17 HB2 = 2.884(D), Expected = 2.91, Std = 0.3700, ChiSquare = 9.4398e-01 1.Y17 HB3 = 2.699(D), Expected = 2.84, Std = 0.3900, ChiSquare = 7.1770e-01 1.Y17 HD1 = 6.990(D), Expected = 6.93, Std = 0.3000, ChiSquare = 8.4148e-01 1.Y17 HD2 = 6.990(D), Expected = 6.93, Std = 0.3000, ChiSquare = 8.4148e-01 1.Y17 HE1 = 6.778(D), Expected = 6.70, Std = 0.2300, ChiSquare = 7.3451e-01 1.Y17 HE2 = 6.778(D), Expected = 6.71, Std = 0.2300, ChiSquare = 7.6750e-01 1.Y17 N = 124.435(D), Expected = 120.52, Std = 4.2000, ChiSquare = 3.5126e-01 1.R18 C = 174.226(D), Expected = 176.41, Std = 2.0300, ChiSquare = 2.8199e-01 1.R18 CA = 53.998(D), Expected = 56.77, Std = 2.3100, ChiSquare = 2.3014e-01 1.R18 CB = 33.180(D), Expected = 30.70, Std = 1.8300, ChiSquare = 1.7536e-01 1.R18 CG = 26.421(D), Expected = 27.21, Std = 1.2000, ChiSquare = 5.1086e-01 1.R18 CD = 44.058(D), Expected = 43.16, Std = 0.8800, ChiSquare = 3.0751e-01 1.R18 H = 7.611(D), Expected = 8.24, Std = 0.6100, ChiSquare = 3.0247e-01 1.R18 HA = 5.301(D), Expected = 4.30, Std = 0.4600, ChiSquare = 2.9549e-02 1.R18 HB2 = 1.641(D), Expected = 1.79, Std = 0.2700, ChiSquare = 5.8105e-01 1.R18 HB3 = 1.586(D), Expected = 1.76, Std = 0.2800, ChiSquare = 5.3432e-01 1.R18 HG2 = 1.467(D), Expected = 1.57, Std = 0.2700, ChiSquare = 7.0285e-01 1.R18 HG3 = 1.424(D), Expected = 1.54, Std = 0.2900, ChiSquare = 6.8916e-01 1.R18 HD2 = 3.134(D), Expected = 3.12, Std = 0.2400, ChiSquare = 9.5348e-01 1.R18 HD3 = 3.134(D), Expected = 3.10, Std = 0.2600, ChiSquare = 8.9596e-01 1.R18 HE = 7.513(D), Expected = 7.40, Std = 0.6300, ChiSquare = 8.5765e-01 1.R18 N = 125.570(D), Expected = 120.80, Std = 3.6800, ChiSquare = 1.9491e-01 1.R18 NE = 85.045(D), Expected = 84.63, Std = 1.6800, ChiSquare = 8.0489e-01 1.R19 C = 173.969(D), Expected = 176.41, Std = 2.0300, ChiSquare = 2.2918e-01 1.R19 CA = 55.906(D), Expected = 56.77, Std = 2.3100, ChiSquare = 7.0838e-01 1.R19 CB = 34.572(D), Expected = 30.70, Std = 1.8300, ChiSquare = 3.4358e-02 1.R19 CG = 27.499(D), Expected = 27.21, Std = 1.2000, ChiSquare = 8.0968e-01 1.R19 CD = 43.113(D), Expected = 43.16, Std = 0.8800, ChiSquare = 9.5741e-01 1.R19 H = 8.391(D), Expected = 8.24, Std = 0.6100, ChiSquare = 8.0449e-01 1.R19 HA = 4.280(D), Expected = 4.30, Std = 0.4600, ChiSquare = 9.6532e-01 1.R19 HB2 = 1.646(D), Expected = 1.79, Std = 0.2700, ChiSquare = 5.9380e-01 1.R19 HB3 = 1.459(D), Expected = 1.76, Std = 0.2800, ChiSquare = 2.8237e-01 1.R19 HG2 = 1.372(D), Expected = 1.57, Std = 0.2700, ChiSquare = 4.6336e-01 1.R19 HG3 = 1.235(D), Expected = 1.54, Std = 0.2900, ChiSquare = 2.9293e-01 1.R19 HD2 = 3.149(D), Expected = 3.12, Std = 0.2400, ChiSquare = 9.0382e-01 1.R19 HD3 = 3.075(D), Expected = 3.10, Std = 0.2600, ChiSquare = 9.2340e-01 1.R19 HE = 7.204(D), Expected = 7.40, Std = 0.6300, ChiSquare = 7.5572e-01 1.R19 N = 123.948(D), Expected = 120.80, Std = 3.6800, ChiSquare = 3.9231e-01 1.R19 NE = 85.606(D), Expected = 84.63, Std = 1.6800, ChiSquare = 5.6127e-01 1.C20 C = 173.221(D), Expected = 174.95, Std = 2.0700, ChiSquare = 4.0357e-01 1.C20 CA = 55.959(D), Expected = 58.30, Std = 3.3300, ChiSquare = 4.8205e-01 1.C20 CB = 48.313(D), Expected = 32.49, Std = 6.0100, ChiSquare = 8.4690e-03 1.C20 H = 8.407(D), Expected = 8.39, Std = 0.6700, ChiSquare = 9.7976e-01 1.C20 HA = 5.911(D), Expected = 4.66, Std = 0.5500, ChiSquare = 2.2933e-02 1.C20 HB2 = 3.055(D), Expected = 2.96, Std = 0.4400, ChiSquare = 8.2906e-01 1.C20 HB3 = 2.915(D), Expected = 2.89, Std = 0.4600, ChiSquare = 9.5666e-01 1.C20 N = 121.154(D), Expected = 120.17, Std = 4.6400, ChiSquare = 8.3205e-01 1.W21 CA = 60.715(D), Expected = 57.66, Std = 2.5800, ChiSquare = 2.3637e-01 1.W21 CB = 32.157(D), Expected = 30.01, Std = 2.0100, ChiSquare = 2.8545e-01 1.W21 CD1 = 126.703(D), Expected = 126.51, Std = 1.8300, ChiSquare = 9.1601e-01 1.W21 CE3 = 120.210(D), Expected = 120.43, Std = 1.7900, ChiSquare = 9.0218e-01 1.W21 CZ2 = 114.094(D), Expected = 114.26, Std = 1.1200, ChiSquare = 8.8217e-01 1.W21 CZ3 = 121.531(D), Expected = 121.35, Std = 1.5300, ChiSquare = 9.0583e-01 1.W21 CH2 = 123.409(D), Expected = 123.86, Std = 1.4200, ChiSquare = 7.5078e-01 1.W21 H = 9.540(D), Expected = 8.29, Std = 0.7900, ChiSquare = 1.1359e-01 1.W21 HA = 4.633(D), Expected = 4.68, Std = 0.5300, ChiSquare = 9.2934e-01 1.W21 HB2 = 3.450(D), Expected = 3.19, Std = 0.3500, ChiSquare = 4.5757e-01 1.W21 HB3 = 3.271(D), Expected = 3.12, Std = 0.3600, ChiSquare = 6.7489e-01 1.W21 HD1 = 7.343(D), Expected = 7.14, Std = 0.3600, ChiSquare = 5.7283e-01 1.W21 HE1 = 9.950(D), Expected = 10.08, Std = 0.6600, ChiSquare = 8.4385e-01 1.W21 HE3 = 7.613(D), Expected = 7.31, Std = 0.4100, ChiSquare = 4.5989e-01 1.W21 HZ2 = 7.184(D), Expected = 7.28, Std = 0.3300, ChiSquare = 7.7112e-01 1.W21 HZ3 = 6.974(D), Expected = 6.86, Std = 0.4000, ChiSquare = 7.7564e-01 1.W21 HH2 = 7.012(D), Expected = 6.98, Std = 0.3900, ChiSquare = 9.3461e-01 1.W21 N = 129.492(D), Expected = 121.68, Std = 4.1800, ChiSquare = 6.1637e-02 1.W21 NE1 = 128.258(D), Expected = 129.32, Std = 2.1100, ChiSquare = 6.1474e-01