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: Indeterminable PRTL>> R 0.77 K 0.12 G 0.09 C Shift Assignments>> CA :: 56.427(D) CB :: 30.801(D) CG :: 27.364(D) CD :: 43.302(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 :: 4.439(D) HB2 :: 1.842(D) HB3 :: 1.789(D) HG2 :: 1.626(D) HG3 :: 1.626(D) HD2 :: 3.203(D) HD3 :: 3.203(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) 1.T2 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> T 0.99 C Shift Assignments>> CA :: 61.739(D) CB :: 70.177(D) 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>> HA :: 4.352(D) HB :: 4.207(D) HG21 :: 1.157(D) HG22 :: 1.157(D) HG23 :: 1.157(D) 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) 1.H3 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> H 0.99 C Shift Assignments>> CA :: 57.052(D) CB :: 31.426(D) CD2 :: 119.991 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>> HA :: 4.668(D) HB2 :: 3.159(D) HB3 :: 3.072(D) HD2 :: 6.986(D) HE1 :: 7.727 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) 1.G4 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> G 0.88 L 0.08 C Shift Assignments>> CA :: 45.489(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 3.983(D) HA3 :: 3.983(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 1.T5 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> T 0.99 C Shift Assignments>> CA :: 61.427(D) CB :: 70.177(D) CG2 :: 21.426 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>> HA :: 4.425(D) HB :: 4.249(D) HG21 :: 1.155(D) HG22 :: 1.155(D) HG23 :: 1.155(D) 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) 1.F6 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> F 0.61 Y 0.38 C Shift Assignments>> CA :: 56.427(D) CB :: 40.802(D) CD1 :: 132.491 CE1 :: 130.616 CZ :: 128.741 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 :: 7.809 HA :: 4.555(D) HB2 :: 2.976(D) HB3 :: 2.939(D) HD1 :: 7.059(D) HD2 :: 7.059(D) HE1 :: 6.998(D) HE2 :: 6.998(D) HZ :: 6.912(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 :: 126.320 Ave N Shift Values>> N :: 120.45(4.18) 1.P7 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> CA :: 62.052(D) CB :: 31.114(D) CG :: 27.676(D) CD :: 50.177(D) 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 :: 4.391(D) HB2 :: 1.990(D) HB3 :: 1.391(D) HG2 :: 1.703(D) HG3 :: 1.470(D) HD2 :: 3.468(D) HD3 :: 2.401 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.M8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> M 0.92 A 0.06 C Shift Assignments>> CA :: 57.364(D) CB :: 31.739(D) CG :: 32.676(D) CE :: 17.364(D) 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>> HA :: 4.249(D) HB2 :: 2.176(D) HB3 :: 2.090(D) HG2 :: 2.769(D) HG3 :: 2.700(D) HE1 :: 2.132(D) HE2 :: 2.132(D) HE3 :: 2.132(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) 1.H9 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> H 0.99 C Shift Assignments>> CA :: 56.427(D) CB :: 31.114(D) CE1 :: 138.740 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>> HA :: 4.520(D) HB2 :: 2.962(D) HB3 :: 2.962(D) HD2 :: 6.801(D) HE1 :: 7.631(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) 1.Q10 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> K 0.48 Q 0.23 M 0.12 R 0.08 P 0.07 C Shift Assignments>> CB :: 29.239 CG :: 32.364 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 :: 4.555 HB2 :: 2.307 HB3 :: 1.602 HG2 :: 1.900(D) HG3 :: 1.900(D) HE21 :: 7.406 HE22 :: 6.750 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 :: 111.008 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L11 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> L 0.91 R 0.05 A 0.02 G 0.01 C Shift Assignments>> CA :: 55.177(D) CB :: 42.052(D) CG :: 27.364(D) CD1 :: 24.864(D) CD2 :: 23.614(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>> HA :: 4.311(D) HB2 :: 1.565(D) HB3 :: 1.499(D) HG :: 1.564(D) HD11 :: 0.902(D) HD12 :: 0.902(D) HD13 :: 0.902(D) HD21 :: 0.828(D) HD22 :: 0.828(D) HD23 :: 0.828(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) 1.G12 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> G 0.58 P 0.21 A 0.11 N 0.03 L 0.02 D 0.01 C Shift Assignments>> CA :: 47.989(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 3.697(D) HA3 :: 4.067(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 1.N13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> Y 0.26 F 0.22 N 0.21 D 0.11 E 0.06 L 0.04 I 0.04 M 0.02 C Shift Assignments>> CA :: 55.802(D) CB :: 38.301(D) 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>> HA :: 4.502(D) HB2 :: 2.935(D) HB3 :: 2.721(D) 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) 1.V14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> CA :: 66.427(D) CB :: 31.739(D) CG1 :: 23.614(D) CG2 :: 21.114(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 :: 8.039(D) HA :: 3.958(D) HB :: 2.196(D) HG11 :: 1.049(D) HG12 :: 1.049(D) HG13 :: 1.049(D) HG21 :: 0.746(D) HG22 :: 0.746(D) HG23 :: 0.746(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 :: 121.007 Ave N Shift Values>> N :: 121.14(4.54) 1.I15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.99 HN Overlap>> 1.I46 1.I46 1.N90 1.N90 C Shift Assignments>> CA :: 66.427(D) CB :: 37.364(D) CG1 :: 29.864(D) CG2 :: 17.989(D) CD1 :: 13.926(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 :: 8.592(D) HA :: 3.426(D) HB :: 2.002(D) HG12 :: 1.733(D) HG13 :: 0.995(D) HG21 :: 0.763(D) HG22 :: 0.763(D) HG23 :: 0.763(D) HD11 :: 0.752(D) HD12 :: 0.752(D) HD13 :: 0.752(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 :: 118.820 Ave N Shift Values>> N :: 121.46(4.28) 1.K16 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> K 0.59 R 0.38 G 0.02 C Shift Assignments>> CA :: 59.864(D) CB :: 31.739(D) CG :: 24.239(D) CD :: 28.301(D) CE :: 42.364(D) 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 :: 8.174(D) HA :: 3.196(D) HB2 :: 1.723(D) HB3 :: 1.723(D) HG2 :: 1.118(D) HD2 :: 1.601(D) HD3 :: 1.155(D) HE2 :: 2.932(D) HE3 :: 2.880(D) 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 :: 120.382 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.G17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.92 L 0.05 C Shift Assignments>> CA :: 47.052(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.605(D) HA2 :: 3.686(D) HA3 :: 3.932(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 103.508 Ave N Shift Values>> N :: 109.67(3.87) 1.I18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> CA :: 64.552(D) CB :: 37.676(D) CG2 :: 18.614(D) CD1 :: 13.301(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 :: 7.943(D) HA :: 3.759(D) HB :: 1.787(D) HG21 :: 0.778(D) HG22 :: 0.778(D) HG23 :: 0.778(D) HD11 :: 0.628(D) HD12 :: 0.628(D) HD13 :: 0.628(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 :: 120.382 Ave N Shift Values>> N :: 121.46(4.28) 1.V19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> CA :: 67.364(D) CB :: 31.114(D) CG1 :: 23.926(D) CG2 :: 22.051(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 :: 8.890(D) HA :: 3.163(D) HB :: 2.150(D) HG11 :: 0.766(D) HG12 :: 0.766(D) HG13 :: 0.766(D) HG21 :: 0.886(D) HG22 :: 0.886(D) HG23 :: 0.886(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 :: 123.507 Ave N Shift Values>> N :: 121.14(4.54) 1.D20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> F 0.27 Y 0.23 L 0.16 D 0.12 K 0.12 I 0.04 N 0.01 HN Overlap>> 1.L87 1.L87 C Shift Assignments>> CA :: 57.364(D) CB :: 40.802(D) 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 :: 7.911(D) HA :: 4.342(D) HB2 :: 2.759(D) HB3 :: 2.659(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 :: 117.882 Ave N Shift Values>> N :: 120.65(3.86) 1.Q21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> M 0.42 Q 0.31 E 0.19 K 0.06 C Shift Assignments>> CA :: 57.677(D) CB :: 31.426(D) CG :: 34.239(D) 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 :: 7.471(D) HA :: 4.367(D) HB2 :: 2.109(D) HB3 :: 2.109(D) HG2 :: 2.535(D) HG3 :: 2.492(D) HE21 :: 7.956 HE22 :: 6.787(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 :: 115.695 NE2 :: 112.570 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> M 0.58 E 0.35 Q 0.06 C Shift Assignments>> CA :: 55.489(D) CB :: 32.676(D) CG :: 35.801(D) 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 :: 8.877(D) HA :: 4.655(D) HB2 :: 2.343(D) HB3 :: 1.719(D) HG2 :: 2.302(D) HG3 :: 2.141(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 :: 114.445 Ave N Shift Values>> N :: 120.67(3.48) 1.G23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.31 R 0.3 G 0.23 D 0.04 F 0.04 Y 0.02 K 0.01 C Shift Assignments>> CA :: 43.927(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.137(D) HA2 :: 4.128(D) HA3 :: 4.849(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.070 Ave N Shift Values>> N :: 109.67(3.87) 1.V24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> CA :: 66.739(D) CB :: 31.739(D) CG1 :: 23.926(D) CG2 :: 22.989(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 :: 8.640(D) HA :: 3.555(D) HB :: 2.126(D) HG11 :: 1.181(D) HG12 :: 1.181(D) HG13 :: 1.181(D) HG21 :: 1.009(D) HG22 :: 1.009(D) HG23 :: 1.009(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 :: 117.257 Ave N Shift Values>> N :: 121.14(4.54) 1.A25 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> M 0.69 A 0.17 I 0.12 C Shift Assignments>> CA :: 56.427(D) CB :: 17.989(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.013(D) HA :: 3.931(D) HB1 :: 1.476(D) HB2 :: 1.476(D) HB3 :: 1.476(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.882 Ave N Shift Values>> N :: 123.23(3.54) 1.T26 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 66.739(D) CB :: 68.302(D) CG2 :: 22.051(D) 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 :: 8.369(D) HA :: 3.867(D) HB :: 3.726(D) HG21 :: 1.074(D) HG22 :: 1.074(D) HG23 :: 1.074(D) 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 :: 114.758 Ave N Shift Values>> N :: 115.42(4.75) 1.A27 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> A 0.49 L 0.18 M 0.16 V 0.09 T 0.04 I 0.01 HN Overlap>> 1.A58 1.A58 C Shift Assignments>> CA :: 55.802(D) CB :: 20.489(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.612(D) HA :: 3.746(D) HB1 :: 1.406(D) HB2 :: 1.406(D) HB3 :: 1.406(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.820 Ave N Shift Values>> N :: 123.23(3.54) 1.Y28 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> F 0.97 Y 0.02 C Shift Assignments>> CA :: 62.052(D) CB :: 37.989(D) CD1 :: 129.366 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 :: 9.004(D) HA :: 3.640(D) HB2 :: 3.261(D) HB3 :: 2.707(D) HD1 :: 6.816(D) HD2 :: 6.816(D) HE1 :: 6.676 HE2 :: 6.676 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 :: 119.445 Ave N Shift Values>> N :: 120.52(4.2) 1.T29 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 67.052(D) CB :: 68.614(D) CG2 :: 21.739(D) 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 :: 8.208(D) HA :: 3.578(D) HB :: 4.227(D) HG21 :: 1.253(D) HG22 :: 1.253(D) HG23 :: 1.253(D) 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 :: 116.945 Ave N Shift Values>> N :: 115.42(4.75) 1.L30 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.94 R 0.05 HN Overlap>> 1.E99 1.E99 C Shift Assignments>> CA :: 57.677(D) CB :: 41.427(D) CG :: 27.676(D) CD1 :: 25.176(D) CD2 :: 23.926(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 :: 8.363(D) HA :: 4.045(D) HB2 :: 1.683(D) HB3 :: 1.231(D) HG :: 1.662(D) HD11 :: 0.716(D) HD12 :: 0.716(D) HD13 :: 0.716(D) HD21 :: 0.694(D) HD22 :: 0.694(D) HD23 :: 0.694(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 :: 121.632 Ave N Shift Values>> N :: 121.86(3.9) 1.G31 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.89 L 0.04 A 0.02 P 0.01 C Shift Assignments>> CA :: 47.364(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.836(D) HA2 :: 3.312(D) HA3 :: 3.416(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.508 Ave N Shift Values>> N :: 109.67(3.87) 1.M32 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> M 0.56 I 0.36 A 0.04 V 0.03 C Shift Assignments>> CA :: 57.989(D) CE :: 17.989(D) 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 :: 8.622(D) HA :: 3.875(D) HB2 :: 2.066(D) HB3 :: 1.639(D) HE1 :: 2.069(D) HE2 :: 2.069(D) HE3 :: 2.069(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 :: 122.570 Ave N Shift Values>> N :: 120.09(3.57) 1.M33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> M 0.98 C Shift Assignments>> CA :: 59.552(D) CB :: 32.676(D) CG :: 31.739(D) CE :: 17.051(D) 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 :: 7.609(D) HA :: 4.044(D) HB2 :: 2.178(D) HB3 :: 2.141(D) HG2 :: 2.693(D) HG3 :: 2.349(D) HE1 :: 1.940(D) HE2 :: 1.940(D) HE3 :: 1.940(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 :: 120.382 Ave N Shift Values>> N :: 120.09(3.57) 1.L34 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.89 R 0.05 A 0.02 G 0.02 C Shift Assignments>> CA :: 57.052(D) CB :: 42.364(D) CG :: 26.426(D) CD1 :: 25.176(D) CD2 :: 22.364(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 :: 8.307(D) HA :: 3.873(D) HB2 :: 1.601 HB3 :: 1.380(D) HG :: 1.607(D) HD11 :: 0.240(D) HD12 :: 0.240(D) HD13 :: 0.240(D) HD21 :: 0.447(D) HD22 :: 0.447(D) HD23 :: 0.447(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 :: 117.257 Ave N Shift Values>> N :: 121.86(3.9) 1.S35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> S 0.95 T 0.04 C Shift Assignments>> CA :: 58.614(D) CB :: 65.802(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.631(D) HA :: 4.489(D) HB2 :: 4.217(D) HB3 :: 3.664(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 :: 108.820 Ave N Shift Values>> N :: 116.28(3.52) 1.G36 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.89 L 0.04 A 0.02 P 0.01 C Shift Assignments>> CA :: 47.364(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.559(D) HA2 :: 3.898(D) HA3 :: 3.898(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.008 Ave N Shift Values>> N :: 109.67(3.87) 1.Q37 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> K 0.84 R 0.07 Q 0.06 V 0.01 C Shift Assignments>> CA :: 55.802(D) CB :: 24.551(D) CG :: 32.989(D) 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 :: 9.192(D) HA :: 3.553(D) HB2 :: 2.457(D) HB3 :: 2.135(D) HG2 :: 2.311(D) HG3 :: 2.164(D) HE21 :: 7.570(D) HE22 :: 6.773(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 :: 112.883 NE2 :: 112.258 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.N38 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> N 0.81 M 0.04 D 0.03 Y 0.03 F 0.02 E 0.02 C Shift Assignments>> CA :: 50.941 CB :: 37.051(D) 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 :: 7.241(D) HA :: 4.216(D) HB2 :: 3.033(D) HB3 :: 2.661(D) HD21 :: 7.976 HD22 :: 6.949(D) 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 :: 118.195 ND2 :: 112.570 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.Y39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> Y 0.99 C Shift Assignments>> CA :: 62.364(D) CB :: 40.177(D) CD1 :: 132.491 CE1 :: 118.116 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 :: 7.909(D) HA :: 4.076(D) HB2 :: 3.179(D) HB3 :: 2.832(D) HD1 :: 7.069(D) HD2 :: 7.069(D) HE1 :: 6.758(D) HE2 :: 6.758(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 :: 125.070 Ave N Shift Values>> N :: 120.52(4.2) 1.Q40 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> Q 0.32 K 0.31 R 0.11 I 0.11 E 0.07 P 0.04 M 0.01 C Shift Assignments>> CA :: 60.177(D) CB :: 27.989(D) CG :: 33.926(D) 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 :: 9.295 HA :: 3.442(D) HB2 :: 2.155(D) HB3 :: 2.099(D) HG2 :: 2.592(D) HG3 :: 2.511(D) HE21 :: 8.125 HE22 :: 6.939 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 :: 113.195 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L41 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.57 R 0.31 G 0.1 C Shift Assignments>> CA :: 57.364(D) CB :: 43.302(D) CG :: 27.051(D) CD1 :: 26.739(D) CD2 :: 22.989(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 :: 7.135(D) HA :: 4.040(D) HB2 :: 1.466(D) HB3 :: 1.466(D) HG :: 1.322(D) HD11 :: 0.887(D) HD12 :: 0.887(D) HD13 :: 0.887(D) HD21 :: 0.915(D) HD22 :: 0.915(D) HD23 :: 0.915(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 :: 119.757 Ave N Shift Values>> N :: 121.86(3.9) 1.V42 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> CA :: 67.364(D) CB :: 31.739(D) CG1 :: 23.668(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 :: 8.154(D) HA :: 3.123(D) HB :: 1.747(D) HG11 :: 0.671(D) HG12 :: 0.671(D) HG13 :: 0.671(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 :: 117.257 Ave N Shift Values>> N :: 121.14(4.54) 1.S43 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 61.332 CB :: 62.052(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.639(D) HA :: 3.563(D) HB2 :: 3.551(D) HB3 :: 3.124(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 :: 114.445 Ave N Shift Values>> N :: 116.28(3.52) 1.G44 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.92 L 0.05 C Shift Assignments>> CA :: 47.052(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.210(D) HA2 :: 3.777(D) HA3 :: 3.929(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.445 Ave N Shift Values>> N :: 109.67(3.87) 1.I45 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> CA :: 64.552(D) CB :: 39.239(D) CG1 :: 28.614(D) CG2 :: 18.614(D) CD1 :: 13.926(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 :: 7.510(D) HA :: 3.730(D) HB :: 1.761(D) HG12 :: 1.872(D) HG13 :: 1.028(D) HG21 :: 1.006(D) HG22 :: 1.006(D) HG23 :: 1.006(D) HD11 :: 0.727(D) HD12 :: 0.727(D) HD13 :: 0.727(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 :: 121.632 Ave N Shift Values>> N :: 121.46(4.28) 1.I46 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.99 HN Overlap>> 1.I15 1.N90 1.I15 1.N90 C Shift Assignments>> CA :: 63.302(D) CB :: 36.739(D) CG1 :: 30.176(D) CG2 :: 18.926(D) CD1 :: 12.051(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 :: 8.570(D) HA :: 3.735(D) HB :: 2.061(D) HG12 :: 1.505(D) HG13 :: 1.505(D) HG21 :: 1.003(D) HG22 :: 1.003(D) HG23 :: 1.003(D) HD11 :: 0.788(D) HD12 :: 0.788(D) HD13 :: 0.788(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 :: 118.820 Ave N Shift Values>> N :: 121.46(4.28) 1.R47 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> R 0.67 G 0.23 K 0.08 C Shift Assignments>> CA :: 59.864(D) CB :: 30.176(D) CG :: 28.301(D) CD :: 43.614(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 :: 7.938(D) HA :: 3.924(D) HB2 :: 2.048(D) HB3 :: 1.819(D) HG2 :: 1.815(D) HG3 :: 1.642(D) HD2 :: 3.228(D) HD3 :: 3.228(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 :: 119.132 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.G48 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.9 L 0.07 C Shift Assignments>> CA :: 45.802(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.222(D) HA2 :: 3.601(D) HA3 :: 4.000(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 102.258 Ave N Shift Values>> N :: 109.67(3.87) 1.Y49 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> Y 0.99 C Shift Assignments>> CA :: 56.427(D) CB :: 39.864(D) CD1 :: 132.491 CE1 :: 118.116 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 :: 8.017(D) HA :: 4.935(D) HB2 :: 3.524(D) HB3 :: 2.617(D) HD1 :: 7.039(D) HD2 :: 7.039(D) HE1 :: 6.709(D) HE2 :: 6.709(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 :: 118.195 Ave N Shift Values>> N :: 120.52(4.2) 1.L50 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.89 A 0.1 C Shift Assignments>> CA :: 53.614(D) CB :: 40.802(D) CG :: 26.426(D) CD1 :: 23.926(D) CD2 :: 22.989(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 :: 7.177(D) HA :: 4.505(D) HB2 :: 1.940(D) HB3 :: 1.940(D) HG :: 2.285(D) HD11 :: 0.978(D) HD12 :: 0.978(D) HD13 :: 0.978(D) HD21 :: 1.104(D) HD22 :: 1.104(D) HD23 :: 1.104(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 :: 120.695 Ave N Shift Values>> N :: 121.86(3.9) 1.P51 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> P 0.98 S 0.01 C Shift Assignments>> CA :: 63.614(D) CB :: 29.551(D) CG :: 28.301 CD :: 51.427(D) 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 :: 4.661(D) HB2 :: 2.194(D) HB3 :: 2.194(D) HG2 :: 2.167(D) HG3 :: 1.958(D) HD2 :: 3.945(D) HD3 :: 3.584(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.G52 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.72 L 0.17 R 0.05 F 0.01 D 0.01 Y 0.01 C Shift Assignments>> CA :: 44.864(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.550(D) HA2 :: 3.955(D) HA3 :: 4.449(D) 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.Q53 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> K 0.39 Q 0.37 R 0.09 E 0.06 M 0.03 I 0.02 C Shift Assignments>> CA :: 58.614 CB :: 28.614 CG :: 33.614 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 :: 3.968(D) HB2 :: 2.157 HB3 :: 2.059 HG2 :: 2.440(D) HG3 :: 2.440(D) HE21 :: 7.488(D) HE22 :: 6.864(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>> NE2 :: 112.570 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A54 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> M 0.52 A 0.42 I 0.03 C Shift Assignments>> CA :: 55.177(D) CB :: 18.301(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> HA :: 4.132(D) HB1 :: 1.446(D) HB2 :: 1.446(D) HB3 :: 1.446(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) 1.V55 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> CA :: 65.489(D) CB :: 31.114(D) CG1 :: 23.301(D) CG2 :: 23.301(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 :: 7.388(D) HA :: 3.494(D) HB :: 2.126(D) HG11 :: 1.101(D) HG12 :: 1.101(D) HG13 :: 1.101(D) HG21 :: 0.886(D) HG22 :: 0.886(D) HG23 :: 0.886(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 :: 116.945 Ave N Shift Values>> N :: 121.14(4.54) 1.V56 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> CA :: 67.052(D) CB :: 32.051(D) CG1 :: 23.614 CG2 :: 21.426(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 :: 7.587(D) HA :: 3.401(D) HB :: 2.199(D) HG11 :: 1.102(D) HG12 :: 1.102(D) HG13 :: 1.102(D) HG21 :: 0.952(D) HG22 :: 0.952(D) HG23 :: 0.952(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 :: 118.820 Ave N Shift Values>> N :: 121.14(4.54) 1.T57 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 66.114(D) CB :: 69.239(D) CG2 :: 21.739(D) 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 :: 8.499(D) HA :: 3.907(D) HB :: 4.087(D) HG21 :: 1.241(D) HG22 :: 1.241(D) HG23 :: 1.241(D) 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 :: 113.195 Ave N Shift Values>> N :: 115.42(4.75) 1.A58 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> A 0.58 M 0.35 I 0.02 L 0.01 V 0.01 HN Overlap>> 1.A27 1.A27 C Shift Assignments>> CA :: 55.177(D) CB :: 19.239(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.533(D) HA :: 4.163(D) HB1 :: 1.535(D) HB2 :: 1.535(D) HB3 :: 1.535(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.820 Ave N Shift Values>> N :: 123.23(3.54) 1.L59 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.89 G 0.05 K 0.04 C Shift Assignments>> CA :: 57.989(D) CB :: 42.677(D) CG :: 26.426(D) CD2 :: 22.676(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 :: 8.767(D) HA :: 3.862(D) HB2 :: 1.971(D) HB3 :: 1.291(D) HG :: 0.608(D) HD11 :: 0.994(D) HD12 :: 0.994(D) HD13 :: 0.994(D) HD21 :: 0.439(D) HD22 :: 0.439(D) HD23 :: 0.439(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 :: 118.820 Ave N Shift Values>> N :: 121.86(3.9) 1.Q60 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> K 0.37 Q 0.36 R 0.12 E 0.06 I 0.03 M 0.02 C Shift Assignments>> CA :: 58.927(D) CB :: 28.301(D) CG :: 33.614(D) 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 :: 8.405(D) HA :: 3.709(D) HB2 :: 2.283(D) HB3 :: 2.106(D) HG2 :: 2.499(D) HG3 :: 2.356(D) HE21 :: 8.035(D) HE22 :: 6.714(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 :: 118.820 NE2 :: 114.758 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.Q61 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> Q 0.37 K 0.35 R 0.1 E 0.09 I 0.04 M 0.02 C Shift Assignments>> CA :: 58.927(D) CB :: 28.301(D) CG :: 33.926(D) 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 :: 7.726(D) HA :: 4.015(D) HB2 :: 2.130(D) HB3 :: 2.040(D) HG2 :: 2.543(D) HG3 :: 2.349(D) HE21 :: 7.373(D) HE22 :: 6.749 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 :: 115.695 NE2 :: 111.320 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.R62 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> R 0.69 K 0.14 G 0.11 L 0.04 C Shift Assignments>> CA :: 58.927(D) CB :: 29.239(D) CG :: 26.739(D) CD :: 43.302(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 :: 6.908(D) HA :: 3.720(D) HB2 :: 1.716(D) HB3 :: 1.455(D) HG2 :: 1.606(D) HG3 :: 1.319(D) HD2 :: 3.093(D) HD3 :: 3.014(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 :: 116.632 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.L63 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.94 R 0.04 HN Overlap>> 1.E85 1.E85 C Shift Assignments>> CA :: 57.989(D) CB :: 41.427(D) CG :: 26.739(D) CD1 :: 25.801(D) CD2 :: 22.676(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 :: 8.148(D) HA :: 3.763(D) HB2 :: 1.851(D) HB3 :: 1.254(D) HG :: 1.615(D) HD11 :: 0.950(D) HD12 :: 0.950(D) HD13 :: 0.950(D) HD21 :: 0.946(D) HD22 :: 0.946(D) HD23 :: 0.946(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 :: 119.132 Ave N Shift Values>> N :: 121.86(3.9) 1.D64 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> F 0.26 Y 0.22 D 0.18 L 0.16 K 0.07 N 0.04 I 0.03 C Shift Assignments>> CA :: 56.739(D) CB :: 40.489(D) 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 :: 8.866(D) HA :: 4.385(D) HB2 :: 2.740(D) HB3 :: 2.633(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 :: 120.070 Ave N Shift Values>> N :: 120.65(3.86) 1.Q65 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> Q 0.4 K 0.36 E 0.11 M 0.06 R 0.04 C Shift Assignments>> CA :: 56.114(D) CB :: 29.239(D) CG :: 33.926(D) 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 :: 6.989(D) HA :: 4.206(D) HB2 :: 2.220(D) HB3 :: 2.063(D) HG2 :: 2.549(D) HG3 :: 2.437(D) HE21 :: 7.467 HE22 :: 6.785 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 :: 114.445 NE2 :: 112.258 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E66 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> Q 0.2 E 0.19 H 0.18 K 0.14 R 0.13 I 0.06 M 0.03 V 0.01 P 0.01 C Shift Assignments>> CB :: 29.551 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 :: 7.231(D) HA :: 4.657(D) HB3 :: 1.946(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 :: 117.882 Ave N Shift Values>> N :: 120.67(3.48) 1.I67 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> CA :: 63.927(D) CB :: 39.551(D) CG1 :: 27.676(D) CG2 :: 17.989(D) CD1 :: 13.926(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 :: 8.568(D) HA :: 3.956(D) HB :: 1.901(D) HG12 :: 1.482(D) HG13 :: 1.287(D) HG21 :: 0.989(D) HG22 :: 0.989(D) HG23 :: 0.989(D) HD11 :: 0.913(D) HD12 :: 0.913(D) HD13 :: 0.913(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 :: 116.632 Ave N Shift Values>> N :: 121.46(4.28) 1.D68 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> D 0.32 L 0.29 K 0.11 R 0.09 N 0.07 F 0.05 Y 0.03 G 0.01 C Shift Assignments>> CA :: 52.989(D) CB :: 42.191 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 :: 7.304(D) HA :: 4.609(D) HB2 :: 3.113(D) HB3 :: 2.993(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 :: 115.383 Ave N Shift Values>> N :: 120.65(3.86) 1.D69 Overall: Clerical Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Duplicate N Shifts: Indeterminable H Shift Assignments>> HA :: 4.266 HB2 :: 2.706(D) HB3 :: 2.582(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) 1.Q70 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> Q 0.37 K 0.3 R 0.19 E 0.04 I 0.04 M 0.01 C Shift Assignments>> CA :: 58.927(D) CB :: 27.676(D) CG :: 33.614(D) 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 :: 8.384(D) HA :: 3.961(D) HB2 :: 2.157(D) HB3 :: 2.013(D) HG2 :: 2.429(D) HG3 :: 2.352(D) HE21 :: 7.760(D) HE22 :: 6.825 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 :: 122.570 NE2 :: 112.883 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.T71 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 66.739(D) CB :: 68.302(D) CG2 :: 22.364(D) 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 :: 8.599(D) HA :: 4.057(D) HB :: 4.177(D) HG21 :: 1.373(D) HG22 :: 1.373(D) HG23 :: 1.373(D) 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 :: 116.320 Ave N Shift Values>> N :: 115.42(4.75) 1.R72 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.27 T 0.22 V 0.2 P 0.06 F 0.05 S 0.05 Y 0.05 E 0.01 R 0.01 K 0.01 C Shift Assignments>> CA :: 61.427 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 :: 8.131(D) HA :: 3.652(D) HB2 :: 1.847 HB3 :: 1.752 HG2 :: 1.627 HG3 :: 1.565 HD2 :: 3.072 HD3 :: 3.072 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 :: 124.132 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.A73 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> A 0.64 M 0.34 I 0.01 C Shift Assignments>> CA :: 53.927(D) CB :: 18.301(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.903(D) HA :: 4.327(D) HB1 :: 1.414(D) HB2 :: 1.414(D) HB3 :: 1.414(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 118.820 Ave N Shift Values>> N :: 123.23(3.54) 1.E74 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> E 0.65 M 0.18 I 0.06 Q 0.05 K 0.04 HN Overlap>> 1.R92 1.R92 C Shift Assignments>> CA :: 57.989(D) CB :: 30.801(D) CG :: 36.426(D) 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 :: 7.664(D) HA :: 4.275(D) HB2 :: 2.258(D) HB3 :: 2.205(D) HG2 :: 2.544(D) HG3 :: 2.376(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 :: 116.945 Ave N Shift Values>> N :: 120.67(3.48) 1.T75 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 62.364(D) CB :: 70.489(D) CG2 :: 21.739(D) 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 :: 7.902(D) HA :: 4.405(D) HB :: 3.956(D) HG21 :: 1.159(D) HG22 :: 1.159(D) HG23 :: 1.159(D) 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 :: 108.820 Ave N Shift Values>> N :: 115.42(4.75) 1.F76 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> Y 0.62 F 0.37 C Shift Assignments>> CA :: 63.614(D) CB :: 40.180(D) CD1 :: 132.491 CE1 :: 129.366 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 :: 7.730(D) HA :: 3.765(D) HB2 :: 3.505(D) HB3 :: 2.602(D) HD1 :: 6.716(D) HD2 :: 6.716(D) HE1 :: 6.830(D) HE2 :: 6.830(D) HZ :: 6.746 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 :: 124.757 Ave N Shift Values>> N :: 120.45(4.18) 1.I77 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> CA :: 63.927(D) CB :: 36.426(D) CG1 :: 28.926(D) CG2 :: 17.676(D) CD1 :: 12.364(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 :: 8.417(D) HA :: 3.500(D) HB :: 1.935(D) HG12 :: 1.804(D) HG13 :: 1.298(D) HG21 :: 0.872(D) HG22 :: 0.872(D) HG23 :: 0.872(D) HD11 :: 1.081(D) HD12 :: 1.081(D) HD13 :: 1.081(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 :: 116.007 Ave N Shift Values>> N :: 121.46(4.28) 1.Q78 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> Q 0.36 K 0.34 R 0.15 E 0.05 I 0.04 M 0.02 P 0.01 C Shift Assignments>> CA :: 59.239(D) CB :: 27.989(D) CG :: 33.614(D) 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 :: 7.850(D) HA :: 3.949(D) HB2 :: 1.983(D) HB3 :: 1.871(D) HG2 :: 2.247(D) HG3 :: 2.178(D) HE21 :: 7.222(D) HE22 :: 6.774(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 :: 121.320 NE2 :: 111.008 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.H79 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> H 0.99 HN Overlap>> 1.V83 1.V83 C Shift Assignments>> CB :: 31.426(D) CE1 :: 138.740 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 :: 8.370(D) HA :: 4.556(D) HB2 :: 2.821(D) HB3 :: 2.510(D) HD2 :: 6.753(D) HE1 :: 7.591(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 :: 119.757 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.L80 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.95 R 0.02 G 0.01 C Shift Assignments>> CA :: 58.614(D) CB :: 42.052(D) CG :: 26.426(D) CD1 :: 24.551(D) CD2 :: 24.942(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 :: 8.656(D) HA :: 3.496(D) HB2 :: 1.655(D) HB3 :: 0.918(D) HG :: 0.599(D) HD11 :: 0.561(D) HD12 :: 0.561(D) HD13 :: 0.561(D) HD21 :: 0.652(D) HD22 :: 0.652(D) HD23 :: 0.652(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 :: 122.257 Ave N Shift Values>> N :: 121.86(3.9) 1.N81 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> Y 0.24 N 0.2 F 0.18 E 0.16 D 0.06 M 0.05 I 0.04 L 0.02 K 0.01 C Shift Assignments>> CA :: 55.802(D) CB :: 37.676(D) 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 :: 8.660(D) HA :: 4.208(D) HB2 :: 2.789(D) HB3 :: 2.716(D) HD21 :: 7.299(D) HD22 :: 6.594(D) 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 :: 116.007 ND2 :: 109.758 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.A82 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> M 0.61 A 0.32 I 0.05 C Shift Assignments>> CA :: 55.489(D) CB :: 17.989(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.920(D) HA :: 4.234(D) HB1 :: 1.591(D) HB2 :: 1.591(D) HB3 :: 1.591(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.820 Ave N Shift Values>> N :: 123.23(3.54) 1.V83 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> 1.H79 1.H79 C Shift Assignments>> CA :: 66.427(D) CB :: 31.739(D) CG1 :: 23.301(D) CG2 :: 23.301(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 :: 8.362(D) HA :: 4.028(D) HB :: 2.406(D) HG11 :: 1.107(D) HG12 :: 1.107(D) HG13 :: 1.107(D) HG21 :: 1.004(D) HG22 :: 1.004(D) HG23 :: 1.004(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 :: 119.757 Ave N Shift Values>> N :: 121.14(4.54) 1.Y84 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> Y 0.93 H 0.06 C Shift Assignments>> CA :: 60.802(D) CB :: 35.801(D) CD1 :: 131.866 CE1 :: 116.866 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 :: 9.022(D) HA :: 4.132(D) HB2 :: 3.272(D) HB3 :: 3.149(D) HD1 :: 6.969(D) HD2 :: 6.969(D) HE1 :: 6.642(D) HE2 :: 6.642(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 :: 121.007 Ave N Shift Values>> N :: 120.52(4.2) 1.E85 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> E 0.52 I 0.28 K 0.1 Q 0.05 M 0.02 HN Overlap>> 1.L63 1.L63 C Shift Assignments>> CA :: 59.864(D) CB :: 29.551(D) CG :: 36.114(D) 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 :: 8.134(D) HA :: 4.229(D) HB2 :: 2.222(D) HB3 :: 2.222(D) HG2 :: 2.382(D) HG3 :: 2.257(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 :: 119.132 Ave N Shift Values>> N :: 120.67(3.48) 1.I86 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> CA :: 64.864(D) CB :: 38.926(D) CG1 :: 29.551(D) CG2 :: 17.364(D) CD1 :: 13.614(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 :: 7.981(D) HA :: 3.798(D) HB :: 1.966(D) HG12 :: 1.800(D) HG13 :: 1.214(D) HG21 :: 0.955(D) HG22 :: 0.955(D) HG23 :: 0.955(D) HD11 :: 0.865(D) HD12 :: 0.865(D) HD13 :: 0.865(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 :: 121.320 Ave N Shift Values>> N :: 121.46(4.28) 1.L87 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.8 A 0.13 R 0.05 G 0.01 HN Overlap>> 1.D20 1.D20 C Shift Assignments>> CA :: 55.177(D) CB :: 42.052 CG :: 27.051(D) CD1 :: 25.176(D) CD2 :: 22.051(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 :: 7.991(D) HA :: 4.306(D) HB2 :: 1.640(D) HB3 :: 1.540(D) HG :: 0.729(D) HD11 :: 0.321(D) HD12 :: 0.321(D) HD13 :: 0.321(D) HD21 :: 0.825(D) HD22 :: 0.825(D) HD23 :: 0.825(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 :: 117.882 Ave N Shift Values>> N :: 121.86(3.9) 1.G88 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.92 L 0.05 C Shift Assignments>> CA :: 47.052(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.854(D) HA2 :: 3.888(D) HA3 :: 3.974(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.383 Ave N Shift Values>> N :: 109.67(3.87) 1.L89 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.39 G 0.36 A 0.21 R 0.01 C Shift Assignments>> CA :: 52.582 CB :: 44.239(D) CG :: 26.426(D) CD1 :: 25.489(D) CD2 :: 22.051(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 :: 8.510(D) HA :: 4.891(D) HB2 :: 1.231(D) HB3 :: 0.800(D) HG :: 1.240(D) HD11 :: 0.322(D) HD12 :: 0.322(D) HD13 :: 0.322(D) HD21 :: 0.445(D) HD22 :: 0.445(D) HD23 :: 0.445(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 :: 119.757 Ave N Shift Values>> N :: 121.86(3.9) 1.N90 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> N 0.78 D 0.12 F 0.02 Y 0.02 L 0.02 HN Overlap>> 1.I46 1.I15 1.I46 1.I15 C Shift Assignments>> CA :: 50.394 CB :: 38.614(D) 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 :: 8.623 HA :: 4.769 HB2 :: 3.485(D) HB3 :: 2.827(D) HD21 :: 7.686 HD22 :: 7.097 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 :: 118.820 ND2 :: 111.320 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.A91 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> A 0.53 M 0.41 I 0.02 V 0.01 C Shift Assignments>> CA :: 55.177(D) CB :: 18.926(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> HA :: 4.311(D) HB1 :: 1.577(D) HB2 :: 1.577(D) HB3 :: 1.577(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) 1.R92 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> R 0.71 K 0.21 G 0.03 L 0.02 HN Overlap>> 1.E74 1.E74 C Shift Assignments>> CA :: 56.114(D) CB :: 29.551(D) CG :: 27.989(D) CD :: 42.677(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 :: 7.695(D) HA :: 4.293(D) HB2 :: 2.199(D) HB3 :: 2.199(D) HG2 :: 1.703(D) HG3 :: 1.393(D) HD2 :: 3.163(D) HD3 :: 3.129(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 :: 116.945 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.G93 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.92 L 0.06 C Shift Assignments>> CA :: 46.427(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.743 HA2 :: 3.303(D) HA3 :: 4.055(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.445 Ave N Shift Values>> N :: 109.67(3.87) 1.Q94 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> Q 0.45 K 0.29 M 0.18 E 0.04 R 0.02 C Shift Assignments>> CA :: 53.614(D) CB :: 29.864(D) CG :: 33.614(D) 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 :: 7.772 HA :: 4.438(D) HB2 :: 2.014(D) HB3 :: 1.914(D) HG2 :: 2.286(D) HG3 :: 2.248(D) HE21 :: 7.553 HE22 :: 6.842 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 :: 118.507 NE2 :: 112.570 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.S95 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> CA :: 59.239(D) CB :: 63.614(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> HA :: 4.559(D) HB2 :: 3.839(D) HB3 :: 3.808(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) 1.I96 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> CA :: 62.052(D) CB :: 38.926(D) CG1 :: 27.364(D) CG2 :: 18.301(D) CD1 :: 13.926(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 :: 8.394(D) HA :: 4.166(D) HB :: 1.892(D) HG12 :: 1.337(D) HG13 :: 1.051(D) HG21 :: 0.884(D) HG22 :: 0.884(D) HG23 :: 0.884(D) HD11 :: 0.788(D) HD12 :: 0.788(D) HD13 :: 0.788(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 :: 123.820 Ave N Shift Values>> N :: 121.46(4.28) 1.R97 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> R 0.79 G 0.15 K 0.04 C Shift Assignments>> CA :: 55.802(D) CB :: 30.801(D) CG :: 27.051(D) CD :: 43.614(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 :: 8.229(D) HA :: 4.363(D) HB2 :: 1.821(D) HB3 :: 1.711(D) HG2 :: 1.629(D) HG3 :: 1.555(D) HD2 :: 3.162(D) HD3 :: 3.162(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 :: 122.882 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.L98 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.E99 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> E 0.69 M 0.12 K 0.07 I 0.05 Q 0.04 HN Overlap>> 1.L30 1.L30 C Shift Assignments>> CA :: 56.410 CB :: 30.160 CG :: 36.722 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 :: 8.397 HA :: 4.184 HB2 :: 1.901 HB3 :: 1.857(D) HG2 :: 2.192 HG3 :: 2.110 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 :: 121.632 Ave N Shift Values>> N :: 120.67(3.48) ########################################################################### Overall Results: #Consistent: 1 #Clerical: 98 #Suspicious: 0 #Anomalous: 0 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 97 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 2 Shift Relative Order (SRO) Results: #Consistent: 99 #Suspicious: 0 C Shift Results: #Consistent: 34 #Duplicate: 267 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 43 #Duplicate: 636 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 N Shift Results: #Consistent: 93 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.R1 CA = 56.427(D), Expected = 56.77, Std = 2.3100, ChiSquare = 8.8196e-01 1.R1 CB = 30.801(D), Expected = 30.70, Std = 1.8300, ChiSquare = 9.5599e-01 1.R1 CG = 27.364(D), Expected = 27.21, Std = 1.2000, ChiSquare = 8.9789e-01 1.R1 CD = 43.302(D), Expected = 43.16, Std = 0.8800, ChiSquare = 8.7181e-01 1.R1 HA = 4.439(D), Expected = 4.30, Std = 0.4600, ChiSquare = 7.6252e-01 1.R1 HB2 = 1.842(D), Expected = 1.79, Std = 0.2700, ChiSquare = 8.4728e-01 1.R1 HB3 = 1.789(D), Expected = 1.76, Std = 0.2800, ChiSquare = 9.1751e-01 1.R1 HG2 = 1.626(D), Expected = 1.57, Std = 0.2700, ChiSquare = 8.3569e-01 1.R1 HG3 = 1.626(D), Expected = 1.54, Std = 0.2900, ChiSquare = 7.6681e-01 1.R1 HD2 = 3.203(D), Expected = 3.12, Std = 0.2400, ChiSquare = 7.2947e-01 1.R1 HD3 = 3.203(D), Expected = 3.10, Std = 0.2600, ChiSquare = 6.9199e-01 1.T2 CA = 61.739(D), Expected = 62.22, Std = 2.5900, ChiSquare = 8.5267e-01 1.T2 CB = 70.177(D), Expected = 69.73, Std = 1.6300, ChiSquare = 7.8391e-01 1.T2 HA = 4.352(D), Expected = 4.46, Std = 0.4800, ChiSquare = 8.2198e-01 1.T2 HB = 4.207(D), Expected = 4.17, Std = 0.3300, ChiSquare = 9.1073e-01 1.T2 HG21 = 1.157(D), Expected = 1.14, Std = 0.2300, ChiSquare = 9.4108e-01 1.T2 HG22 = 1.157(D), Expected = 1.14, Std = 0.2300, ChiSquare = 9.4108e-01 1.T2 HG23 = 1.157(D), Expected = 1.14, Std = 0.2300, ChiSquare = 9.4108e-01 1.H3 CA = 57.052(D), Expected = 56.52, Std = 2.3100, ChiSquare = 8.1786e-01 1.H3 CB = 31.426(D), Expected = 30.24, Std = 2.0700, ChiSquare = 5.6668e-01 1.H3 HA = 4.668(D), Expected = 4.61, Std = 0.4300, ChiSquare = 8.9270e-01 1.H3 HB2 = 3.159(D), Expected = 3.10, Std = 0.3600, ChiSquare = 8.6982e-01 1.H3 HB3 = 3.072(D), Expected = 3.04, Std = 0.3800, ChiSquare = 9.3289e-01 1.H3 HD2 = 6.986(D), Expected = 7.00, Std = 0.4300, ChiSquare = 9.7403e-01 1.G4 CA = 45.489(D), Expected = 45.35, Std = 1.3400, ChiSquare = 9.1738e-01 1.G4 HA2 = 3.983(D), Expected = 3.97, Std = 0.3700, ChiSquare = 9.7197e-01 1.G4 HA3 = 3.983(D), Expected = 3.90, Std = 0.3700, ChiSquare = 8.2250e-01 1.T5 CA = 61.427(D), Expected = 62.22, Std = 2.5900, ChiSquare = 7.5947e-01 1.T5 CB = 70.177(D), Expected = 69.73, Std = 1.6300, ChiSquare = 7.8391e-01 1.T5 HA = 4.425(D), Expected = 4.46, Std = 0.4800, ChiSquare = 9.4187e-01 1.T5 HB = 4.249(D), Expected = 4.17, Std = 0.3300, ChiSquare = 8.1080e-01 1.T5 HG21 = 1.155(D), Expected = 1.14, Std = 0.2300, ChiSquare = 9.4800e-01 1.T5 HG22 = 1.155(D), Expected = 1.14, Std = 0.2300, ChiSquare = 9.4800e-01 1.T5 HG23 = 1.155(D), Expected = 1.14, Std = 0.2300, ChiSquare = 9.4800e-01 1.F6 CA = 56.427(D), Expected = 58.08, Std = 2.5700, ChiSquare = 5.2010e-01 1.F6 CB = 40.802(D), Expected = 39.99, Std = 2.0900, ChiSquare = 6.9763e-01 1.F6 HA = 4.555(D), Expected = 4.63, Std = 0.5700, ChiSquare = 8.9532e-01 1.F6 HB2 = 2.976(D), Expected = 3.00, Std = 0.3700, ChiSquare = 9.4828e-01 1.F6 HB3 = 2.939(D), Expected = 2.93, Std = 0.4000, ChiSquare = 9.8205e-01 1.F6 HD1 = 7.059(D), Expected = 7.06, Std = 0.3100, ChiSquare = 9.9743e-01 1.F6 HD2 = 7.059(D), Expected = 7.06, Std = 0.3100, ChiSquare = 9.9743e-01 1.F6 HE1 = 6.998(D), Expected = 7.08, Std = 0.3100, ChiSquare = 7.9138e-01 1.F6 HE2 = 6.998(D), Expected = 7.08, Std = 0.3200, ChiSquare = 7.9776e-01 1.F6 HZ = 6.912(D), Expected = 7.00, Std = 0.4200, ChiSquare = 8.3404e-01 1.P7 CA = 62.052(D), Expected = 63.33, Std = 1.5200, ChiSquare = 4.0047e-01 1.P7 CB = 31.114(D), Expected = 31.85, Std = 1.1800, ChiSquare = 5.3281e-01 1.P7 CG = 27.676(D), Expected = 27.17, Std = 1.0900, ChiSquare = 6.4249e-01 1.P7 CD = 50.177(D), Expected = 50.32, Std = 0.9900, ChiSquare = 8.8515e-01 1.P7 HA = 4.391(D), Expected = 4.40, Std = 0.3300, ChiSquare = 9.7824e-01 1.P7 HB2 = 1.990(D), Expected = 2.08, Std = 0.3500, ChiSquare = 7.9707e-01 1.P7 HB3 = 1.391(D), Expected = 2.00, Std = 0.3600, ChiSquare = 9.0710e-02 1.P7 HG2 = 1.703(D), Expected = 1.93, Std = 0.3100, ChiSquare = 4.6401e-01 1.P7 HG3 = 1.470(D), Expected = 1.90, Std = 0.3300, ChiSquare = 1.9256e-01 1.P7 HD2 = 3.468(D), Expected = 3.65, Std = 0.3500, ChiSquare = 6.0306e-01 1.M8 CA = 57.364(D), Expected = 56.11, Std = 2.2300, ChiSquare = 5.7389e-01 1.M8 CB = 31.739(D), Expected = 32.99, Std = 2.2400, ChiSquare = 5.7652e-01 1.M8 CG = 32.676(D), Expected = 32.01, Std = 1.2400, ChiSquare = 5.9120e-01 1.M8 CE = 17.364(D), Expected = 17.07, Std = 1.5800, ChiSquare = 8.5239e-01 1.M8 HA = 4.249(D), Expected = 4.41, Std = 0.4800, ChiSquare = 7.3731e-01 1.M8 HB2 = 2.176(D), Expected = 2.03, Std = 0.3400, ChiSquare = 6.6762e-01 1.M8 HB3 = 2.090(D), Expected = 1.99, Std = 0.3400, ChiSquare = 7.6867e-01 1.M8 HG2 = 2.769(D), Expected = 2.42, Std = 0.3500, ChiSquare = 3.1870e-01 1.M8 HG3 = 2.700(D), Expected = 2.39, Std = 0.3800, ChiSquare = 4.1462e-01 1.M8 HE1 = 2.132(D), Expected = 1.89, Std = 0.4600, ChiSquare = 5.9883e-01 1.M8 HE2 = 2.132(D), Expected = 1.89, Std = 0.4600, ChiSquare = 5.9883e-01 1.M8 HE3 = 2.132(D), Expected = 1.89, Std = 0.4600, ChiSquare = 5.9883e-01 1.H9 CA = 56.427(D), Expected = 56.52, Std = 2.3100, ChiSquare = 9.6789e-01 1.H9 CB = 31.114(D), Expected = 30.24, Std = 2.0700, ChiSquare = 6.7286e-01 1.H9 HA = 4.520(D), Expected = 4.61, Std = 0.4300, ChiSquare = 8.3421e-01 1.H9 HB2 = 2.962(D), Expected = 3.10, Std = 0.3600, ChiSquare = 7.0147e-01 1.H9 HB3 = 2.962(D), Expected = 3.04, Std = 0.3800, ChiSquare = 8.3737e-01 1.H9 HD2 = 6.801(D), Expected = 7.00, Std = 0.4300, ChiSquare = 6.4351e-01 1.H9 HE1 = 7.631(D), Expected = 7.95, Std = 0.4800, ChiSquare = 5.0632e-01 1.Q10 HG2 = 1.900(D), Expected = 2.32, Std = 0.2700, ChiSquare = 1.1981e-01 1.Q10 HG3 = 1.900(D), Expected = 2.29, Std = 0.2900, ChiSquare = 1.7868e-01 1.L11 CA = 55.177(D), Expected = 55.62, Std = 2.1300, ChiSquare = 8.3524e-01 1.L11 CB = 42.052(D), Expected = 42.31, Std = 1.8800, ChiSquare = 8.9085e-01 1.L11 CG = 27.364(D), Expected = 26.78, Std = 1.1000, ChiSquare = 5.9548e-01 1.L11 CD1 = 24.864(D), Expected = 24.72, Std = 1.5900, ChiSquare = 9.2784e-01 1.L11 CD2 = 23.614(D), Expected = 24.05, Std = 1.7000, ChiSquare = 7.9759e-01 1.L11 HA = 4.311(D), Expected = 4.32, Std = 0.4700, ChiSquare = 9.8472e-01 1.L11 HB2 = 1.565(D), Expected = 1.61, Std = 0.3400, ChiSquare = 8.9471e-01 1.L11 HB3 = 1.499(D), Expected = 1.52, Std = 0.3600, ChiSquare = 9.5348e-01 1.L11 HG = 1.564(D), Expected = 1.51, Std = 0.3300, ChiSquare = 8.7002e-01 1.L11 HD11 = 0.902(D), Expected = 0.75, Std = 0.2800, ChiSquare = 5.8723e-01 1.L11 HD12 = 0.902(D), Expected = 0.75, Std = 0.2800, ChiSquare = 5.8723e-01 1.L11 HD13 = 0.902(D), Expected = 0.75, Std = 0.2800, ChiSquare = 5.8723e-01 1.L11 HD21 = 0.828(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.3541e-01 1.L11 HD22 = 0.828(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.3541e-01 1.L11 HD23 = 0.828(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.3541e-01 1.G12 CA = 47.989(D), Expected = 45.35, Std = 1.3400, ChiSquare = 4.8907e-02 1.G12 HA2 = 3.697(D), Expected = 3.97, Std = 0.3700, ChiSquare = 4.6061e-01 1.G12 HA3 = 4.067(D), Expected = 3.90, Std = 0.3700, ChiSquare = 6.5174e-01 1.N13 CA = 55.802(D), Expected = 53.54, Std = 1.8800, ChiSquare = 2.2890e-01 1.N13 CB = 38.301(D), Expected = 38.69, Std = 1.6900, ChiSquare = 8.1795e-01 1.N13 HA = 4.502(D), Expected = 4.67, Std = 0.3600, ChiSquare = 6.4074e-01 1.N13 HB2 = 2.935(D), Expected = 2.81, Std = 0.3100, ChiSquare = 6.8678e-01 1.N13 HB3 = 2.721(D), Expected = 2.75, Std = 0.3300, ChiSquare = 9.2997e-01 1.V14 CA = 66.427(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.6864e-01 1.V14 CB = 31.739(D), Expected = 32.73, Std = 1.7900, ChiSquare = 5.7983e-01 1.V14 CG1 = 23.614(D), Expected = 21.49, Std = 1.3600, ChiSquare = 1.1834e-01 1.V14 CG2 = 21.114(D), Expected = 21.26, Std = 1.5600, ChiSquare = 9.2544e-01 1.V14 H = 8.039(D), Expected = 8.29, Std = 0.6700, ChiSquare = 7.0794e-01 1.V14 HA = 3.958(D), Expected = 4.19, Std = 0.5800, ChiSquare = 6.8916e-01 1.V14 HB = 2.196(D), Expected = 1.98, Std = 0.3200, ChiSquare = 4.9968e-01 1.V14 HG11 = 1.049(D), Expected = 0.83, Std = 0.2600, ChiSquare = 3.9962e-01 1.V14 HG12 = 1.049(D), Expected = 0.83, Std = 0.2600, ChiSquare = 3.9962e-01 1.V14 HG13 = 1.049(D), Expected = 0.83, Std = 0.2600, ChiSquare = 3.9962e-01 1.V14 HG21 = 0.746(D), Expected = 0.80, Std = 0.2800, ChiSquare = 8.4707e-01 1.V14 HG22 = 0.746(D), Expected = 0.80, Std = 0.2800, ChiSquare = 8.4707e-01 1.V14 HG23 = 0.746(D), Expected = 0.80, Std = 0.2800, ChiSquare = 8.4707e-01 1.I15 CA = 66.427(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.2274e-02 1.I15 CB = 37.364(D), Expected = 38.63, Std = 2.0200, ChiSquare = 5.3083e-01 1.I15 CG1 = 29.864(D), Expected = 27.71, Std = 1.6800, ChiSquare = 1.9979e-01 1.I15 CG2 = 17.989(D), Expected = 17.53, Std = 1.3600, ChiSquare = 7.3574e-01 1.I15 CD1 = 13.926(D), Expected = 13.43, Std = 1.6700, ChiSquare = 7.6646e-01 1.I15 H = 8.592(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.4636e-01 1.I15 HA = 3.426(D), Expected = 4.18, Std = 0.5600, ChiSquare = 1.7816e-01 1.I15 HB = 2.002(D), Expected = 1.78, Std = 0.2900, ChiSquare = 4.4396e-01 1.I15 HG12 = 1.733(D), Expected = 1.28, Std = 0.4000, ChiSquare = 2.5742e-01 1.I15 HG13 = 0.995(D), Expected = 1.19, Std = 0.4100, ChiSquare = 6.3435e-01 1.I15 HG21 = 0.763(D), Expected = 0.77, Std = 0.2700, ChiSquare = 9.7932e-01 1.I15 HG22 = 0.763(D), Expected = 0.77, Std = 0.2700, ChiSquare = 9.7932e-01 1.I15 HG23 = 0.763(D), Expected = 0.77, Std = 0.2700, ChiSquare = 9.7932e-01 1.I15 HD11 = 0.752(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.0392e-01 1.I15 HD12 = 0.752(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.0392e-01 1.I15 HD13 = 0.752(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.0392e-01 1.K16 CA = 59.864(D), Expected = 56.95, Std = 2.2000, ChiSquare = 1.8532e-01 1.K16 CB = 31.739(D), Expected = 32.79, Std = 1.7800, ChiSquare = 5.5489e-01 1.K16 CG = 24.239(D), Expected = 24.89, Std = 1.1300, ChiSquare = 5.6454e-01 1.K16 CD = 28.301(D), Expected = 28.96, Std = 1.0800, ChiSquare = 5.4174e-01 1.K16 CE = 42.364(D), Expected = 41.89, Std = 0.8200, ChiSquare = 5.6323e-01 1.K16 H = 8.174(D), Expected = 8.19, Std = 0.6000, ChiSquare = 9.7873e-01 1.K16 HA = 3.196(D), Expected = 4.27, Std = 0.4400, ChiSquare = 1.4650e-02 1.K16 HB2 = 1.723(D), Expected = 1.78, Std = 0.2500, ChiSquare = 8.1965e-01 1.K16 HB3 = 1.723(D), Expected = 1.74, Std = 0.2700, ChiSquare = 9.4980e-01 1.K16 HG2 = 1.118(D), Expected = 1.37, Std = 0.2600, ChiSquare = 3.3243e-01 1.K16 HD2 = 1.601(D), Expected = 1.61, Std = 0.2200, ChiSquare = 9.6737e-01 1.K16 HD3 = 1.155(D), Expected = 1.60, Std = 0.2200, ChiSquare = 4.3101e-02 1.K16 HE2 = 2.932(D), Expected = 2.92, Std = 0.1900, ChiSquare = 9.4964e-01 1.K16 HE3 = 2.880(D), Expected = 2.91, Std = 0.2000, ChiSquare = 8.8076e-01 1.G17 CA = 47.052(D), Expected = 45.35, Std = 1.3400, ChiSquare = 2.0403e-01 1.G17 H = 7.605(D), Expected = 8.33, Std = 0.6500, ChiSquare = 2.6469e-01 1.G17 HA2 = 3.686(D), Expected = 3.97, Std = 0.3700, ChiSquare = 4.4274e-01 1.G17 HA3 = 3.932(D), Expected = 3.90, Std = 0.3700, ChiSquare = 9.3108e-01 1.I18 CA = 64.552(D), Expected = 61.61, Std = 2.6800, ChiSquare = 2.7231e-01 1.I18 CB = 37.676(D), Expected = 38.63, Std = 2.0200, ChiSquare = 6.3673e-01 1.I18 CG2 = 18.614(D), Expected = 17.53, Std = 1.3600, ChiSquare = 4.2542e-01 1.I18 CD1 = 13.301(D), Expected = 13.43, Std = 1.6700, ChiSquare = 9.3843e-01 1.I18 H = 7.943(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.2018e-01 1.I18 HA = 3.759(D), Expected = 4.18, Std = 0.5600, ChiSquare = 4.5218e-01 1.I18 HB = 1.787(D), Expected = 1.78, Std = 0.2900, ChiSquare = 9.8074e-01 1.I18 HG21 = 0.778(D), Expected = 0.77, Std = 0.2700, ChiSquare = 9.7636e-01 1.I18 HG22 = 0.778(D), Expected = 0.77, Std = 0.2700, ChiSquare = 9.7636e-01 1.I18 HG23 = 0.778(D), Expected = 0.77, Std = 0.2700, ChiSquare = 9.7636e-01 1.I18 HD11 = 0.628(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.5769e-01 1.I18 HD12 = 0.628(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.5769e-01 1.I18 HD13 = 0.628(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.5769e-01 1.V19 CA = 67.364(D), Expected = 62.49, Std = 2.8600, ChiSquare = 8.8345e-02 1.V19 CB = 31.114(D), Expected = 32.73, Std = 1.7900, ChiSquare = 3.6664e-01 1.V19 CG1 = 23.926(D), Expected = 21.49, Std = 1.3600, ChiSquare = 7.3265e-02 1.V19 CG2 = 22.051(D), Expected = 21.26, Std = 1.5600, ChiSquare = 6.1212e-01 1.V19 H = 8.890(D), Expected = 8.29, Std = 0.6700, ChiSquare = 3.7051e-01 1.V19 HA = 3.163(D), Expected = 4.19, Std = 0.5800, ChiSquare = 7.6612e-02 1.V19 HB = 2.150(D), Expected = 1.98, Std = 0.3200, ChiSquare = 5.9525e-01 1.V19 HG11 = 0.766(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.0556e-01 1.V19 HG12 = 0.766(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.0556e-01 1.V19 HG13 = 0.766(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.0556e-01 1.V19 HG21 = 0.886(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.5873e-01 1.V19 HG22 = 0.886(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.5873e-01 1.V19 HG23 = 0.886(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.5873e-01 1.D20 CA = 57.364(D), Expected = 54.69, Std = 2.0300, ChiSquare = 1.8776e-01 1.D20 CB = 40.802(D), Expected = 40.88, Std = 1.6200, ChiSquare = 9.6160e-01 1.D20 H = 7.911(D), Expected = 8.31, Std = 0.5800, ChiSquare = 4.9150e-01 1.D20 HA = 4.342(D), Expected = 4.59, Std = 0.3200, ChiSquare = 4.3834e-01 1.D20 HB2 = 2.759(D), Expected = 2.72, Std = 0.2600, ChiSquare = 8.8076e-01 1.D20 HB3 = 2.659(D), Expected = 2.66, Std = 0.2800, ChiSquare = 9.9715e-01 1.Q21 CA = 57.677(D), Expected = 56.57, Std = 2.1400, ChiSquare = 6.0495e-01 1.Q21 CB = 31.426(D), Expected = 29.19, Std = 1.8200, ChiSquare = 2.1923e-01 1.Q21 CG = 34.239(D), Expected = 33.76, Std = 1.1100, ChiSquare = 6.6608e-01 1.Q21 H = 7.471(D), Expected = 8.22, Std = 0.5900, ChiSquare = 2.0427e-01 1.Q21 HA = 4.367(D), Expected = 4.27, Std = 0.4400, ChiSquare = 8.2552e-01 1.Q21 HB2 = 2.109(D), Expected = 2.05, Std = 0.2500, ChiSquare = 8.1343e-01 1.Q21 HB3 = 2.109(D), Expected = 2.02, Std = 0.2800, ChiSquare = 7.5059e-01 1.Q21 HG2 = 2.535(D), Expected = 2.32, Std = 0.2700, ChiSquare = 4.2586e-01 1.Q21 HG3 = 2.492(D), Expected = 2.29, Std = 0.2900, ChiSquare = 4.8608e-01 1.Q21 HE22 = 6.787(D), Expected = 7.02, Std = 0.4400, ChiSquare = 5.9643e-01 1.E22 CA = 55.489(D), Expected = 57.32, Std = 2.0900, ChiSquare = 3.8099e-01 1.E22 CB = 32.676(D), Expected = 30.01, Std = 1.7200, ChiSquare = 1.2114e-01 1.E22 CG = 35.801(D), Expected = 36.11, Std = 1.1900, ChiSquare = 7.9512e-01 1.E22 H = 8.877(D), Expected = 8.33, Std = 0.5900, ChiSquare = 3.5387e-01 1.E22 HA = 4.655(D), Expected = 4.25, Std = 0.4100, ChiSquare = 3.2325e-01 1.E22 HB2 = 2.343(D), Expected = 2.02, Std = 0.2100, ChiSquare = 1.2403e-01 1.E22 HB3 = 1.719(D), Expected = 1.99, Std = 0.2300, ChiSquare = 2.3869e-01 1.E22 HG2 = 2.302(D), Expected = 2.27, Std = 0.2100, ChiSquare = 8.7889e-01 1.E22 HG3 = 2.141(D), Expected = 2.25, Std = 0.2200, ChiSquare = 6.2028e-01 1.G23 CA = 43.927(D), Expected = 45.35, Std = 1.3400, ChiSquare = 2.8826e-01 1.G23 H = 8.137(D), Expected = 8.33, Std = 0.6500, ChiSquare = 7.6653e-01 1.G23 HA2 = 4.128(D), Expected = 3.97, Std = 0.3700, ChiSquare = 6.6936e-01 1.G23 HA3 = 4.849(D), Expected = 3.90, Std = 0.3700, ChiSquare = 1.0322e-02 1.V24 CA = 66.739(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.3737e-01 1.V24 CB = 31.739(D), Expected = 32.73, Std = 1.7900, ChiSquare = 5.7983e-01 1.V24 CG1 = 23.926(D), Expected = 21.49, Std = 1.3600, ChiSquare = 7.3265e-02 1.V24 CG2 = 22.989(D), Expected = 21.26, Std = 1.5600, ChiSquare = 2.6772e-01 1.V24 H = 8.640(D), Expected = 8.29, Std = 0.6700, ChiSquare = 6.0140e-01 1.V24 HA = 3.555(D), Expected = 4.19, Std = 0.5800, ChiSquare = 2.7359e-01 1.V24 HB = 2.126(D), Expected = 1.98, Std = 0.3200, ChiSquare = 6.4821e-01 1.V24 HG11 = 1.181(D), Expected = 0.83, Std = 0.2600, ChiSquare = 1.7702e-01 1.V24 HG12 = 1.181(D), Expected = 0.83, Std = 0.2600, ChiSquare = 1.7702e-01 1.V24 HG13 = 1.181(D), Expected = 0.83, Std = 0.2600, ChiSquare = 1.7702e-01 1.V24 HG21 = 1.009(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.5541e-01 1.V24 HG22 = 1.009(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.5541e-01 1.V24 HG23 = 1.009(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.5541e-01 1.A25 CA = 56.427(D), Expected = 53.14, Std = 1.9800, ChiSquare = 9.6894e-02 1.A25 CB = 17.989(D), Expected = 19.01, Std = 1.8300, ChiSquare = 5.7690e-01 1.A25 H = 9.013(D), Expected = 8.20, Std = 0.6000, ChiSquare = 1.7542e-01 1.A25 HA = 3.931(D), Expected = 4.26, Std = 0.4400, ChiSquare = 4.5462e-01 1.A25 HB1 = 1.476(D), Expected = 1.35, Std = 0.2600, ChiSquare = 6.2795e-01 1.A25 HB2 = 1.476(D), Expected = 1.35, Std = 0.2600, ChiSquare = 6.2795e-01 1.A25 HB3 = 1.476(D), Expected = 1.35, Std = 0.2600, ChiSquare = 6.2795e-01 1.T26 CA = 66.739(D), Expected = 62.22, Std = 2.5900, ChiSquare = 8.1022e-02 1.T26 CB = 68.302(D), Expected = 69.73, Std = 1.6300, ChiSquare = 3.8099e-01 1.T26 CG2 = 22.051(D), Expected = 21.55, Std = 1.1100, ChiSquare = 6.5174e-01 1.T26 H = 8.369(D), Expected = 8.24, Std = 0.6200, ChiSquare = 8.3518e-01 1.T26 HA = 3.867(D), Expected = 4.46, Std = 0.4800, ChiSquare = 2.1668e-01 1.T26 HB = 3.726(D), Expected = 4.17, Std = 0.3300, ChiSquare = 1.7848e-01 1.T26 HG21 = 1.074(D), Expected = 1.14, Std = 0.2300, ChiSquare = 7.7415e-01 1.T26 HG22 = 1.074(D), Expected = 1.14, Std = 0.2300, ChiSquare = 7.7415e-01 1.T26 HG23 = 1.074(D), Expected = 1.14, Std = 0.2300, ChiSquare = 7.7415e-01 1.A27 CA = 55.802(D), Expected = 53.14, Std = 1.9800, ChiSquare = 1.7880e-01 1.A27 CB = 20.489(D), Expected = 19.01, Std = 1.8300, ChiSquare = 4.1898e-01 1.A27 H = 7.612(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.2709e-01 1.A27 HA = 3.746(D), Expected = 4.26, Std = 0.4400, ChiSquare = 2.4273e-01 1.A27 HB1 = 1.406(D), Expected = 1.35, Std = 0.2600, ChiSquare = 8.2947e-01 1.A27 HB2 = 1.406(D), Expected = 1.35, Std = 0.2600, ChiSquare = 8.2947e-01 1.A27 HB3 = 1.406(D), Expected = 1.35, Std = 0.2600, ChiSquare = 8.2947e-01 1.Y28 CA = 62.052(D), Expected = 58.13, Std = 2.5100, ChiSquare = 1.1816e-01 1.Y28 CB = 37.989(D), Expected = 39.32, Std = 2.1600, ChiSquare = 5.3776e-01 1.Y28 H = 9.004(D), Expected = 8.32, Std = 0.7300, ChiSquare = 3.4877e-01 1.Y28 HA = 3.640(D), Expected = 4.63, Std = 0.5600, ChiSquare = 7.7085e-02 1.Y28 HB2 = 3.261(D), Expected = 2.91, Std = 0.3700, ChiSquare = 3.4280e-01 1.Y28 HB3 = 2.707(D), Expected = 2.84, Std = 0.3900, ChiSquare = 7.3308e-01 1.Y28 HD1 = 6.816(D), Expected = 6.93, Std = 0.3000, ChiSquare = 7.0395e-01 1.Y28 HD2 = 6.816(D), Expected = 6.93, Std = 0.3000, ChiSquare = 7.0395e-01 1.T29 CA = 67.052(D), Expected = 62.22, Std = 2.5900, ChiSquare = 6.2092e-02 1.T29 CB = 68.614(D), Expected = 69.73, Std = 1.6300, ChiSquare = 4.9356e-01 1.T29 CG2 = 21.739(D), Expected = 21.55, Std = 1.1100, ChiSquare = 8.6480e-01 1.T29 H = 8.208(D), Expected = 8.24, Std = 0.6200, ChiSquare = 9.5884e-01 1.T29 HA = 3.578(D), Expected = 4.46, Std = 0.4800, ChiSquare = 6.6136e-02 1.T29 HB = 4.227(D), Expected = 4.17, Std = 0.3300, ChiSquare = 8.6287e-01 1.T29 HG21 = 1.253(D), Expected = 1.14, Std = 0.2300, ChiSquare = 6.2321e-01 1.T29 HG22 = 1.253(D), Expected = 1.14, Std = 0.2300, ChiSquare = 6.2321e-01 1.T29 HG23 = 1.253(D), Expected = 1.14, Std = 0.2300, ChiSquare = 6.2321e-01 1.L30 CA = 57.677(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.3418e-01 1.L30 CB = 41.427(D), Expected = 42.31, Std = 1.8800, ChiSquare = 6.3858e-01 1.L30 CG = 27.676(D), Expected = 26.78, Std = 1.1000, ChiSquare = 4.1533e-01 1.L30 CD1 = 25.176(D), Expected = 24.72, Std = 1.5900, ChiSquare = 7.7427e-01 1.L30 CD2 = 23.926(D), Expected = 24.05, Std = 1.7000, ChiSquare = 9.4185e-01 1.L30 H = 8.363(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.3787e-01 1.L30 HA = 4.045(D), Expected = 4.32, Std = 0.4700, ChiSquare = 5.5848e-01 1.L30 HB2 = 1.683(D), Expected = 1.61, Std = 0.3400, ChiSquare = 8.3000e-01 1.L30 HB3 = 1.231(D), Expected = 1.52, Std = 0.3600, ChiSquare = 4.2210e-01 1.L30 HG = 1.662(D), Expected = 1.51, Std = 0.3300, ChiSquare = 6.4508e-01 1.L30 HD11 = 0.716(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.0335e-01 1.L30 HD12 = 0.716(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.0335e-01 1.L30 HD13 = 0.716(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.0335e-01 1.L30 HD21 = 0.694(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.0121e-01 1.L30 HD22 = 0.694(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.0121e-01 1.L30 HD23 = 0.694(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.0121e-01 1.G31 CA = 47.364(D), Expected = 45.35, Std = 1.3400, ChiSquare = 1.3284e-01 1.G31 H = 8.836(D), Expected = 8.33, Std = 0.6500, ChiSquare = 4.3630e-01 1.G31 HA2 = 3.312(D), Expected = 3.97, Std = 0.3700, ChiSquare = 7.5342e-02 1.G31 HA3 = 3.416(D), Expected = 3.90, Std = 0.3700, ChiSquare = 1.9084e-01 1.M32 CA = 57.989(D), Expected = 56.11, Std = 2.2300, ChiSquare = 3.9945e-01 1.M32 CE = 17.989(D), Expected = 17.07, Std = 1.5800, ChiSquare = 5.6081e-01 1.M32 H = 8.622(D), Expected = 8.26, Std = 0.6000, ChiSquare = 5.4629e-01 1.M32 HA = 3.875(D), Expected = 4.41, Std = 0.4800, ChiSquare = 2.6503e-01 1.M32 HB2 = 2.066(D), Expected = 2.03, Std = 0.3400, ChiSquare = 9.1568e-01 1.M32 HB3 = 1.639(D), Expected = 1.99, Std = 0.3400, ChiSquare = 3.0191e-01 1.M32 HE1 = 2.069(D), Expected = 1.89, Std = 0.4600, ChiSquare = 6.9718e-01 1.M32 HE2 = 2.069(D), Expected = 1.89, Std = 0.4600, ChiSquare = 6.9718e-01 1.M32 HE3 = 2.069(D), Expected = 1.89, Std = 0.4600, ChiSquare = 6.9718e-01 1.M33 CA = 59.552(D), Expected = 56.11, Std = 2.2300, ChiSquare = 1.2271e-01 1.M33 CB = 32.676(D), Expected = 32.99, Std = 2.2400, ChiSquare = 8.8852e-01 1.M33 CG = 31.739(D), Expected = 32.01, Std = 1.2400, ChiSquare = 8.2700e-01 1.M33 CE = 17.051(D), Expected = 17.07, Std = 1.5800, ChiSquare = 9.9041e-01 1.M33 H = 7.609(D), Expected = 8.26, Std = 0.6000, ChiSquare = 2.7792e-01 1.M33 HA = 4.044(D), Expected = 4.41, Std = 0.4800, ChiSquare = 4.4576e-01 1.M33 HB2 = 2.178(D), Expected = 2.03, Std = 0.3400, ChiSquare = 6.6335e-01 1.M33 HB3 = 2.141(D), Expected = 1.99, Std = 0.3400, ChiSquare = 6.5696e-01 1.M33 HG2 = 2.693(D), Expected = 2.42, Std = 0.3500, ChiSquare = 4.3539e-01 1.M33 HG3 = 2.349(D), Expected = 2.39, Std = 0.3800, ChiSquare = 9.1408e-01 1.M33 HE1 = 1.940(D), Expected = 1.89, Std = 0.4600, ChiSquare = 9.1344e-01 1.M33 HE2 = 1.940(D), Expected = 1.89, Std = 0.4600, ChiSquare = 9.1344e-01 1.M33 HE3 = 1.940(D), Expected = 1.89, Std = 0.4600, ChiSquare = 9.1344e-01 1.L34 CA = 57.052(D), Expected = 55.62, Std = 2.1300, ChiSquare = 5.0139e-01 1.L34 CB = 42.364(D), Expected = 42.31, Std = 1.8800, ChiSquare = 9.7709e-01 1.L34 CG = 26.426(D), Expected = 26.78, Std = 1.1000, ChiSquare = 7.4759e-01 1.L34 CD1 = 25.176(D), Expected = 24.72, Std = 1.5900, ChiSquare = 7.7427e-01 1.L34 CD2 = 22.364(D), Expected = 24.05, Std = 1.7000, ChiSquare = 3.2131e-01 1.L34 H = 8.307(D), Expected = 8.23, Std = 0.6500, ChiSquare = 9.0570e-01 1.L34 HA = 3.873(D), Expected = 4.32, Std = 0.4700, ChiSquare = 3.4157e-01 1.L34 HB3 = 1.380(D), Expected = 1.52, Std = 0.3600, ChiSquare = 6.9736e-01 1.L34 HG = 1.607(D), Expected = 1.51, Std = 0.3300, ChiSquare = 7.6880e-01 1.L34 HD11 = 0.240(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.8542e-02 1.L34 HD12 = 0.240(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.8542e-02 1.L34 HD13 = 0.240(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.8542e-02 1.L34 HD21 = 0.447(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.2913e-01 1.L34 HD22 = 0.447(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.2913e-01 1.L34 HD23 = 0.447(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.2913e-01 1.S35 CA = 58.614(D), Expected = 58.72, Std = 2.0700, ChiSquare = 9.5916e-01 1.S35 CB = 65.802(D), Expected = 63.80, Std = 1.4800, ChiSquare = 1.7615e-01 1.S35 H = 7.631(D), Expected = 8.28, Std = 0.5900, ChiSquare = 2.7133e-01 1.S35 HA = 4.489(D), Expected = 4.48, Std = 0.4000, ChiSquare = 9.8205e-01 1.S35 HB2 = 4.217(D), Expected = 3.88, Std = 0.2500, ChiSquare = 1.7766e-01 1.S35 HB3 = 3.664(D), Expected = 3.85, Std = 0.2700, ChiSquare = 4.9089e-01 1.G36 CA = 47.364(D), Expected = 45.35, Std = 1.3400, ChiSquare = 1.3284e-01 1.G36 H = 7.559(D), Expected = 8.33, Std = 0.6500, ChiSquare = 2.3556e-01 1.G36 HA2 = 3.898(D), Expected = 3.97, Std = 0.3700, ChiSquare = 8.4571e-01 1.G36 HA3 = 3.898(D), Expected = 3.90, Std = 0.3700, ChiSquare = 9.9569e-01 1.Q37 CA = 55.802(D), Expected = 56.57, Std = 2.1400, ChiSquare = 7.1969e-01 1.Q37 CB = 24.551(D), Expected = 29.19, Std = 1.8200, ChiSquare = 1.0806e-02 1.Q37 CG = 32.989(D), Expected = 33.76, Std = 1.1100, ChiSquare = 4.8731e-01 1.Q37 H = 9.192(D), Expected = 8.22, Std = 0.5900, ChiSquare = 9.9464e-02 1.Q37 HA = 3.553(D), Expected = 4.27, Std = 0.4400, ChiSquare = 1.0320e-01 1.Q37 HB2 = 2.457(D), Expected = 2.05, Std = 0.2500, ChiSquare = 1.0352e-01 1.Q37 HB3 = 2.135(D), Expected = 2.02, Std = 0.2800, ChiSquare = 6.8128e-01 1.Q37 HG2 = 2.311(D), Expected = 2.32, Std = 0.2700, ChiSquare = 9.7341e-01 1.Q37 HG3 = 2.164(D), Expected = 2.29, Std = 0.2900, ChiSquare = 6.6394e-01 1.Q37 HE21 = 7.570(D), Expected = 7.24, Std = 0.4500, ChiSquare = 4.6336e-01 1.Q37 HE22 = 6.773(D), Expected = 7.02, Std = 0.4400, ChiSquare = 5.7455e-01 1.N38 CB = 37.051(D), Expected = 38.69, Std = 1.6900, ChiSquare = 3.3214e-01 1.N38 H = 7.241(D), Expected = 8.34, Std = 0.6300, ChiSquare = 8.1082e-02 1.N38 HA = 4.216(D), Expected = 4.67, Std = 0.3600, ChiSquare = 2.0727e-01 1.N38 HB2 = 3.033(D), Expected = 2.81, Std = 0.3100, ChiSquare = 4.7192e-01 1.N38 HB3 = 2.661(D), Expected = 2.75, Std = 0.3300, ChiSquare = 7.8739e-01 1.N38 HD22 = 6.949(D), Expected = 7.14, Std = 0.4900, ChiSquare = 6.9669e-01 1.Y39 CA = 62.364(D), Expected = 58.13, Std = 2.5100, ChiSquare = 9.1632e-02 1.Y39 CB = 40.177(D), Expected = 39.32, Std = 2.1600, ChiSquare = 6.9154e-01 1.Y39 H = 7.909(D), Expected = 8.32, Std = 0.7300, ChiSquare = 5.7343e-01 1.Y39 HA = 4.076(D), Expected = 4.63, Std = 0.5600, ChiSquare = 3.2252e-01 1.Y39 HB2 = 3.179(D), Expected = 2.91, Std = 0.3700, ChiSquare = 4.6721e-01 1.Y39 HB3 = 2.832(D), Expected = 2.84, Std = 0.3900, ChiSquare = 9.8363e-01 1.Y39 HD1 = 7.069(D), Expected = 6.93, Std = 0.3000, ChiSquare = 6.4313e-01 1.Y39 HD2 = 7.069(D), Expected = 6.93, Std = 0.3000, ChiSquare = 6.4313e-01 1.Y39 HE1 = 6.758(D), Expected = 6.70, Std = 0.2300, ChiSquare = 8.0091e-01 1.Y39 HE2 = 6.758(D), Expected = 6.71, Std = 0.2300, ChiSquare = 8.3469e-01 1.Q40 CA = 60.177(D), Expected = 56.57, Std = 2.1400, ChiSquare = 9.1889e-02 1.Q40 CB = 27.989(D), Expected = 29.19, Std = 1.8200, ChiSquare = 5.0932e-01 1.Q40 CG = 33.926(D), Expected = 33.76, Std = 1.1100, ChiSquare = 8.8112e-01 1.Q40 HA = 3.442(D), Expected = 4.27, Std = 0.4400, ChiSquare = 5.9861e-02 1.Q40 HB2 = 2.155(D), Expected = 2.05, Std = 0.2500, ChiSquare = 6.7449e-01 1.Q40 HB3 = 2.099(D), Expected = 2.02, Std = 0.2800, ChiSquare = 7.7783e-01 1.Q40 HG2 = 2.592(D), Expected = 2.32, Std = 0.2700, ChiSquare = 3.1374e-01 1.Q40 HG3 = 2.511(D), Expected = 2.29, Std = 0.2900, ChiSquare = 4.4602e-01 1.L41 CA = 57.364(D), Expected = 55.62, Std = 2.1300, ChiSquare = 4.1291e-01 1.L41 CB = 43.302(D), Expected = 42.31, Std = 1.8800, ChiSquare = 5.9774e-01 1.L41 CG = 27.051(D), Expected = 26.78, Std = 1.1000, ChiSquare = 8.0540e-01 1.L41 CD1 = 26.739(D), Expected = 24.72, Std = 1.5900, ChiSquare = 2.0415e-01 1.L41 CD2 = 22.989(D), Expected = 24.05, Std = 1.7000, ChiSquare = 5.3255e-01 1.L41 H = 7.135(D), Expected = 8.23, Std = 0.6500, ChiSquare = 9.2063e-02 1.L41 HA = 4.040(D), Expected = 4.32, Std = 0.4700, ChiSquare = 5.5135e-01 1.L41 HB2 = 1.466(D), Expected = 1.61, Std = 0.3400, ChiSquare = 6.7191e-01 1.L41 HB3 = 1.466(D), Expected = 1.52, Std = 0.3600, ChiSquare = 8.8076e-01 1.L41 HG = 1.322(D), Expected = 1.51, Std = 0.3300, ChiSquare = 5.6888e-01 1.L41 HD11 = 0.887(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.2464e-01 1.L41 HD12 = 0.887(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.2464e-01 1.L41 HD13 = 0.887(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.2464e-01 1.L41 HD21 = 0.915(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.2352e-01 1.L41 HD22 = 0.915(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.2352e-01 1.L41 HD23 = 0.915(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.2352e-01 1.V42 CA = 67.364(D), Expected = 62.49, Std = 2.8600, ChiSquare = 8.8345e-02 1.V42 CB = 31.739(D), Expected = 32.73, Std = 1.7900, ChiSquare = 5.7983e-01 1.V42 CG1 = 23.668(D), Expected = 21.49, Std = 1.3600, ChiSquare = 1.0927e-01 1.V42 H = 8.154(D), Expected = 8.29, Std = 0.6700, ChiSquare = 8.3915e-01 1.V42 HA = 3.123(D), Expected = 4.19, Std = 0.5800, ChiSquare = 6.5819e-02 1.V42 HB = 1.747(D), Expected = 1.98, Std = 0.3200, ChiSquare = 4.6654e-01 1.V42 HG11 = 0.671(D), Expected = 0.83, Std = 0.2600, ChiSquare = 5.4084e-01 1.V42 HG12 = 0.671(D), Expected = 0.83, Std = 0.2600, ChiSquare = 5.4084e-01 1.V42 HG13 = 0.671(D), Expected = 0.83, Std = 0.2600, ChiSquare = 5.4084e-01 1.S43 CB = 62.052(D), Expected = 63.80, Std = 1.4800, ChiSquare = 2.3757e-01 1.S43 H = 8.639(D), Expected = 8.28, Std = 0.5900, ChiSquare = 5.4287e-01 1.S43 HA = 3.563(D), Expected = 4.48, Std = 0.4000, ChiSquare = 2.1877e-02 1.S43 HB2 = 3.551(D), Expected = 3.88, Std = 0.2500, ChiSquare = 1.8817e-01 1.S43 HB3 = 3.124(D), Expected = 3.85, Std = 0.2700, ChiSquare = 7.1690e-03 1.G44 CA = 47.052(D), Expected = 45.35, Std = 1.3400, ChiSquare = 2.0403e-01 1.G44 H = 7.210(D), Expected = 8.33, Std = 0.6500, ChiSquare = 8.4875e-02 1.G44 HA2 = 3.777(D), Expected = 3.97, Std = 0.3700, ChiSquare = 6.0193e-01 1.G44 HA3 = 3.929(D), Expected = 3.90, Std = 0.3700, ChiSquare = 9.3753e-01 1.I45 CA = 64.552(D), Expected = 61.61, Std = 2.6800, ChiSquare = 2.7231e-01 1.I45 CB = 39.239(D), Expected = 38.63, Std = 2.0200, ChiSquare = 7.6304e-01 1.I45 CG1 = 28.614(D), Expected = 27.71, Std = 1.6800, ChiSquare = 5.9051e-01 1.I45 CG2 = 18.614(D), Expected = 17.53, Std = 1.3600, ChiSquare = 4.2542e-01 1.I45 CD1 = 13.926(D), Expected = 13.43, Std = 1.6700, ChiSquare = 7.6646e-01 1.I45 H = 7.510(D), Expected = 8.28, Std = 0.6800, ChiSquare = 2.5749e-01 1.I45 HA = 3.730(D), Expected = 4.18, Std = 0.5600, ChiSquare = 4.2164e-01 1.I45 HB = 1.761(D), Expected = 1.78, Std = 0.2900, ChiSquare = 9.4776e-01 1.I45 HG12 = 1.872(D), Expected = 1.28, Std = 0.4000, ChiSquare = 1.3887e-01 1.I45 HG13 = 1.028(D), Expected = 1.19, Std = 0.4100, ChiSquare = 6.9275e-01 1.I45 HG21 = 1.006(D), Expected = 0.77, Std = 0.2700, ChiSquare = 3.8208e-01 1.I45 HG22 = 1.006(D), Expected = 0.77, Std = 0.2700, ChiSquare = 3.8208e-01 1.I45 HG23 = 1.006(D), Expected = 0.77, Std = 0.2700, ChiSquare = 3.8208e-01 1.I45 HD11 = 0.727(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.7125e-01 1.I45 HD12 = 0.727(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.7125e-01 1.I45 HD13 = 0.727(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.7125e-01 1.I46 CA = 63.302(D), Expected = 61.61, Std = 2.6800, ChiSquare = 5.2782e-01 1.I46 CB = 36.739(D), Expected = 38.63, Std = 2.0200, ChiSquare = 3.4920e-01 1.I46 CG1 = 30.176(D), Expected = 27.71, Std = 1.6800, ChiSquare = 1.4214e-01 1.I46 CG2 = 18.926(D), Expected = 17.53, Std = 1.3600, ChiSquare = 3.0467e-01 1.I46 CD1 = 12.051(D), Expected = 13.43, Std = 1.6700, ChiSquare = 4.0895e-01 1.I46 H = 8.570(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.6976e-01 1.I46 HA = 3.735(D), Expected = 4.18, Std = 0.5600, ChiSquare = 4.2682e-01 1.I46 HB = 2.061(D), Expected = 1.78, Std = 0.2900, ChiSquare = 3.3256e-01 1.I46 HG12 = 1.505(D), Expected = 1.28, Std = 0.4000, ChiSquare = 5.7378e-01 1.I46 HG13 = 1.505(D), Expected = 1.19, Std = 0.4100, ChiSquare = 4.4231e-01 1.I46 HG21 = 1.003(D), Expected = 0.77, Std = 0.2700, ChiSquare = 3.8816e-01 1.I46 HG22 = 1.003(D), Expected = 0.77, Std = 0.2700, ChiSquare = 3.8816e-01 1.I46 HG23 = 1.003(D), Expected = 0.77, Std = 0.2700, ChiSquare = 3.8816e-01 1.I46 HD11 = 0.788(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.0958e-01 1.I46 HD12 = 0.788(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.0958e-01 1.I46 HD13 = 0.788(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.0958e-01 1.R47 CA = 59.864(D), Expected = 56.77, Std = 2.3100, ChiSquare = 1.8044e-01 1.R47 CB = 30.176(D), Expected = 30.70, Std = 1.8300, ChiSquare = 7.7462e-01 1.R47 CG = 28.301(D), Expected = 27.21, Std = 1.2000, ChiSquare = 3.6326e-01 1.R47 CD = 43.614(D), Expected = 43.16, Std = 0.8800, ChiSquare = 6.0592e-01 1.R47 H = 7.938(D), Expected = 8.24, Std = 0.6100, ChiSquare = 6.2054e-01 1.R47 HA = 3.924(D), Expected = 4.30, Std = 0.4600, ChiSquare = 4.1371e-01 1.R47 HB2 = 2.048(D), Expected = 1.79, Std = 0.2700, ChiSquare = 3.3930e-01 1.R47 HB3 = 1.819(D), Expected = 1.76, Std = 0.2800, ChiSquare = 8.3311e-01 1.R47 HG2 = 1.815(D), Expected = 1.57, Std = 0.2700, ChiSquare = 3.6419e-01 1.R47 HG3 = 1.642(D), Expected = 1.54, Std = 0.2900, ChiSquare = 7.2504e-01 1.R47 HD2 = 3.228(D), Expected = 3.12, Std = 0.2400, ChiSquare = 6.5271e-01 1.R47 HD3 = 3.228(D), Expected = 3.10, Std = 0.2600, ChiSquare = 6.2250e-01 1.G48 CA = 45.802(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.3588e-01 1.G48 H = 7.222(D), Expected = 8.33, Std = 0.6500, ChiSquare = 8.8266e-02 1.G48 HA2 = 3.601(D), Expected = 3.97, Std = 0.3700, ChiSquare = 3.1862e-01 1.G48 HA3 = 4.000(D), Expected = 3.90, Std = 0.3700, ChiSquare = 7.8695e-01 1.Y49 CA = 56.427(D), Expected = 58.13, Std = 2.5100, ChiSquare = 4.9746e-01 1.Y49 CB = 39.864(D), Expected = 39.32, Std = 2.1600, ChiSquare = 8.0116e-01 1.Y49 H = 8.017(D), Expected = 8.32, Std = 0.7300, ChiSquare = 6.7809e-01 1.Y49 HA = 4.935(D), Expected = 4.63, Std = 0.5600, ChiSquare = 5.8600e-01 1.Y49 HB2 = 3.524(D), Expected = 2.91, Std = 0.3700, ChiSquare = 9.7023e-02 1.Y49 HB3 = 2.617(D), Expected = 2.84, Std = 0.3900, ChiSquare = 5.6746e-01 1.Y49 HD1 = 7.039(D), Expected = 6.93, Std = 0.3000, ChiSquare = 7.1636e-01 1.Y49 HD2 = 7.039(D), Expected = 6.93, Std = 0.3000, ChiSquare = 7.1636e-01 1.Y49 HE1 = 6.709(D), Expected = 6.70, Std = 0.2300, ChiSquare = 9.6879e-01 1.Y49 HE2 = 6.709(D), Expected = 6.71, Std = 0.2300, ChiSquare = 9.9653e-01 1.L50 CA = 53.614(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.4630e-01 1.L50 CB = 40.802(D), Expected = 42.31, Std = 1.8800, ChiSquare = 4.2248e-01 1.L50 CG = 26.426(D), Expected = 26.78, Std = 1.1000, ChiSquare = 7.4759e-01 1.L50 CD1 = 23.926(D), Expected = 24.72, Std = 1.5900, ChiSquare = 6.1752e-01 1.L50 CD2 = 22.989(D), Expected = 24.05, Std = 1.7000, ChiSquare = 5.3255e-01 1.L50 H = 7.177(D), Expected = 8.23, Std = 0.6500, ChiSquare = 1.0523e-01 1.L50 HA = 4.505(D), Expected = 4.32, Std = 0.4700, ChiSquare = 6.9386e-01 1.L50 HB2 = 1.940(D), Expected = 1.61, Std = 0.3400, ChiSquare = 3.3175e-01 1.L50 HB3 = 1.940(D), Expected = 1.52, Std = 0.3600, ChiSquare = 2.4334e-01 1.L50 HG = 2.285(D), Expected = 1.51, Std = 0.3300, ChiSquare = 1.8850e-02 1.L50 HD11 = 0.978(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.1548e-01 1.L50 HD12 = 0.978(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.1548e-01 1.L50 HD13 = 0.978(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.1548e-01 1.L50 HD21 = 1.104(D), Expected = 0.73, Std = 0.2900, ChiSquare = 1.9717e-01 1.L50 HD22 = 1.104(D), Expected = 0.73, Std = 0.2900, ChiSquare = 1.9717e-01 1.L50 HD23 = 1.104(D), Expected = 0.73, Std = 0.2900, ChiSquare = 1.9717e-01 1.P51 CA = 63.614(D), Expected = 63.33, Std = 1.5200, ChiSquare = 8.5178e-01 1.P51 CB = 29.551(D), Expected = 31.85, Std = 1.1800, ChiSquare = 5.1379e-02 1.P51 CD = 51.427(D), Expected = 50.32, Std = 0.9900, ChiSquare = 2.6349e-01 1.P51 HA = 4.661(D), Expected = 4.40, Std = 0.3300, ChiSquare = 4.2900e-01 1.P51 HB2 = 2.194(D), Expected = 2.08, Std = 0.3500, ChiSquare = 7.4464e-01 1.P51 HB3 = 2.194(D), Expected = 2.00, Std = 0.3600, ChiSquare = 5.8996e-01 1.P51 HG2 = 2.167(D), Expected = 1.93, Std = 0.3100, ChiSquare = 4.4456e-01 1.P51 HG3 = 1.958(D), Expected = 1.90, Std = 0.3300, ChiSquare = 8.6048e-01 1.P51 HD2 = 3.945(D), Expected = 3.65, Std = 0.3500, ChiSquare = 3.9931e-01 1.P51 HD3 = 3.584(D), Expected = 3.61, Std = 0.3900, ChiSquare = 9.4685e-01 1.G52 CA = 44.864(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.1684e-01 1.G52 H = 7.550(D), Expected = 8.33, Std = 0.6500, ChiSquare = 2.3014e-01 1.G52 HA2 = 3.955(D), Expected = 3.97, Std = 0.3700, ChiSquare = 9.6766e-01 1.G52 HA3 = 4.449(D), Expected = 3.90, Std = 0.3700, ChiSquare = 1.3787e-01 1.Q53 HA = 3.968(D), Expected = 4.27, Std = 0.4400, ChiSquare = 4.9248e-01 1.Q53 HG2 = 2.440(D), Expected = 2.32, Std = 0.2700, ChiSquare = 6.5672e-01 1.Q53 HG3 = 2.440(D), Expected = 2.29, Std = 0.2900, ChiSquare = 6.0499e-01 1.Q53 HE21 = 7.488(D), Expected = 7.24, Std = 0.4500, ChiSquare = 5.8156e-01 1.Q53 HE22 = 6.864(D), Expected = 7.02, Std = 0.4400, ChiSquare = 7.2293e-01 1.A54 CA = 55.177(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.0358e-01 1.A54 CB = 18.301(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.9844e-01 1.A54 HA = 4.132(D), Expected = 4.26, Std = 0.4400, ChiSquare = 7.7112e-01 1.A54 HB1 = 1.446(D), Expected = 1.35, Std = 0.2600, ChiSquare = 7.1196e-01 1.A54 HB2 = 1.446(D), Expected = 1.35, Std = 0.2600, ChiSquare = 7.1196e-01 1.A54 HB3 = 1.446(D), Expected = 1.35, Std = 0.2600, ChiSquare = 7.1196e-01 1.V55 CA = 65.489(D), Expected = 62.49, Std = 2.8600, ChiSquare = 2.9436e-01 1.V55 CB = 31.114(D), Expected = 32.73, Std = 1.7900, ChiSquare = 3.6664e-01 1.V55 CG1 = 23.301(D), Expected = 21.49, Std = 1.3600, ChiSquare = 1.8299e-01 1.V55 CG2 = 23.301(D), Expected = 21.26, Std = 1.5600, ChiSquare = 1.9076e-01 1.V55 H = 7.388(D), Expected = 8.29, Std = 0.6700, ChiSquare = 1.7822e-01 1.V55 HA = 3.494(D), Expected = 4.19, Std = 0.5800, ChiSquare = 2.3014e-01 1.V55 HB = 2.126(D), Expected = 1.98, Std = 0.3200, ChiSquare = 6.4821e-01 1.V55 HG11 = 1.101(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.9727e-01 1.V55 HG12 = 1.101(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.9727e-01 1.V55 HG13 = 1.101(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.9727e-01 1.V55 HG21 = 0.886(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.5873e-01 1.V55 HG22 = 0.886(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.5873e-01 1.V55 HG23 = 0.886(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.5873e-01 1.V56 CA = 67.052(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.1069e-01 1.V56 CB = 32.051(D), Expected = 32.73, Std = 1.7900, ChiSquare = 7.0444e-01 1.V56 CG2 = 21.426(D), Expected = 21.26, Std = 1.5600, ChiSquare = 9.1526e-01 1.V56 H = 7.587(D), Expected = 8.29, Std = 0.6700, ChiSquare = 2.9406e-01 1.V56 HA = 3.401(D), Expected = 4.19, Std = 0.5800, ChiSquare = 1.7372e-01 1.V56 HB = 2.199(D), Expected = 1.98, Std = 0.3200, ChiSquare = 4.9374e-01 1.V56 HG11 = 1.102(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.9549e-01 1.V56 HG12 = 1.102(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.9549e-01 1.V56 HG13 = 1.102(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.9549e-01 1.V56 HG21 = 0.952(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.8723e-01 1.V56 HG22 = 0.952(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.8723e-01 1.V56 HG23 = 0.952(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.8723e-01 1.T57 CA = 66.114(D), Expected = 62.22, Std = 2.5900, ChiSquare = 1.3272e-01 1.T57 CB = 69.239(D), Expected = 69.73, Std = 1.6300, ChiSquare = 7.6324e-01 1.T57 CG2 = 21.739(D), Expected = 21.55, Std = 1.1100, ChiSquare = 8.6480e-01 1.T57 H = 8.499(D), Expected = 8.24, Std = 0.6200, ChiSquare = 6.7614e-01 1.T57 HA = 3.907(D), Expected = 4.46, Std = 0.4800, ChiSquare = 2.4929e-01 1.T57 HB = 4.087(D), Expected = 4.17, Std = 0.3300, ChiSquare = 8.0142e-01 1.T57 HG21 = 1.241(D), Expected = 1.14, Std = 0.2300, ChiSquare = 6.6057e-01 1.T57 HG22 = 1.241(D), Expected = 1.14, Std = 0.2300, ChiSquare = 6.6057e-01 1.T57 HG23 = 1.241(D), Expected = 1.14, Std = 0.2300, ChiSquare = 6.6057e-01 1.A58 CA = 55.177(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.0358e-01 1.A58 CB = 19.239(D), Expected = 19.01, Std = 1.8300, ChiSquare = 9.0042e-01 1.A58 H = 7.533(D), Expected = 8.20, Std = 0.6000, ChiSquare = 2.6628e-01 1.A58 HA = 4.163(D), Expected = 4.26, Std = 0.4400, ChiSquare = 8.2552e-01 1.A58 HB1 = 1.535(D), Expected = 1.35, Std = 0.2600, ChiSquare = 4.7675e-01 1.A58 HB2 = 1.535(D), Expected = 1.35, Std = 0.2600, ChiSquare = 4.7675e-01 1.A58 HB3 = 1.535(D), Expected = 1.35, Std = 0.2600, ChiSquare = 4.7675e-01 1.L59 CA = 57.989(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.6605e-01 1.L59 CB = 42.677(D), Expected = 42.31, Std = 1.8800, ChiSquare = 8.4523e-01 1.L59 CG = 26.426(D), Expected = 26.78, Std = 1.1000, ChiSquare = 7.4759e-01 1.L59 CD2 = 22.676(D), Expected = 24.05, Std = 1.7000, ChiSquare = 4.1896e-01 1.L59 H = 8.767(D), Expected = 8.23, Std = 0.6500, ChiSquare = 4.0872e-01 1.L59 HA = 3.862(D), Expected = 4.32, Std = 0.4700, ChiSquare = 3.2982e-01 1.L59 HB2 = 1.971(D), Expected = 1.61, Std = 0.3400, ChiSquare = 2.8834e-01 1.L59 HB3 = 1.291(D), Expected = 1.52, Std = 0.3600, ChiSquare = 5.2470e-01 1.L59 HG = 0.608(D), Expected = 1.51, Std = 0.3300, ChiSquare = 6.2697e-03 1.L59 HD11 = 0.994(D), Expected = 0.75, Std = 0.2800, ChiSquare = 3.8352e-01 1.L59 HD12 = 0.994(D), Expected = 0.75, Std = 0.2800, ChiSquare = 3.8352e-01 1.L59 HD13 = 0.994(D), Expected = 0.75, Std = 0.2800, ChiSquare = 3.8352e-01 1.L59 HD21 = 0.439(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.1564e-01 1.L59 HD22 = 0.439(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.1564e-01 1.L59 HD23 = 0.439(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.1564e-01 1.Q60 CA = 58.927(D), Expected = 56.57, Std = 2.1400, ChiSquare = 2.7072e-01 1.Q60 CB = 28.301(D), Expected = 29.19, Std = 1.8200, ChiSquare = 6.2522e-01 1.Q60 CG = 33.614(D), Expected = 33.76, Std = 1.1100, ChiSquare = 8.9536e-01 1.Q60 H = 8.405(D), Expected = 8.22, Std = 0.5900, ChiSquare = 7.5386e-01 1.Q60 HA = 3.709(D), Expected = 4.27, Std = 0.4400, ChiSquare = 2.0231e-01 1.Q60 HB2 = 2.283(D), Expected = 2.05, Std = 0.2500, ChiSquare = 3.5134e-01 1.Q60 HB3 = 2.106(D), Expected = 2.02, Std = 0.2800, ChiSquare = 7.5873e-01 1.Q60 HG2 = 2.499(D), Expected = 2.32, Std = 0.2700, ChiSquare = 5.0735e-01 1.Q60 HG3 = 2.356(D), Expected = 2.29, Std = 0.2900, ChiSquare = 8.1997e-01 1.Q60 HE21 = 8.035(D), Expected = 7.24, Std = 0.4500, ChiSquare = 7.7284e-02 1.Q60 HE22 = 6.714(D), Expected = 7.02, Std = 0.4400, ChiSquare = 4.8677e-01 1.Q61 CA = 58.927(D), Expected = 56.57, Std = 2.1400, ChiSquare = 2.7072e-01 1.Q61 CB = 28.301(D), Expected = 29.19, Std = 1.8200, ChiSquare = 6.2522e-01 1.Q61 CG = 33.926(D), Expected = 33.76, Std = 1.1100, ChiSquare = 8.8112e-01 1.Q61 H = 7.726(D), Expected = 8.22, Std = 0.5900, ChiSquare = 4.0243e-01 1.Q61 HA = 4.015(D), Expected = 4.27, Std = 0.4400, ChiSquare = 5.6222e-01 1.Q61 HB2 = 2.130(D), Expected = 2.05, Std = 0.2500, ChiSquare = 7.4897e-01 1.Q61 HB3 = 2.040(D), Expected = 2.02, Std = 0.2800, ChiSquare = 9.4306e-01 1.Q61 HG2 = 2.543(D), Expected = 2.32, Std = 0.2700, ChiSquare = 4.0885e-01 1.Q61 HG3 = 2.349(D), Expected = 2.29, Std = 0.2900, ChiSquare = 8.3878e-01 1.Q61 HE21 = 7.373(D), Expected = 7.24, Std = 0.4500, ChiSquare = 7.6757e-01 1.R62 CA = 58.927(D), Expected = 56.77, Std = 2.3100, ChiSquare = 3.5042e-01 1.R62 CB = 29.239(D), Expected = 30.70, Std = 1.8300, ChiSquare = 4.2466e-01 1.R62 CG = 26.739(D), Expected = 27.21, Std = 1.2000, ChiSquare = 6.9469e-01 1.R62 CD = 43.302(D), Expected = 43.16, Std = 0.8800, ChiSquare = 8.7181e-01 1.R62 H = 6.908(D), Expected = 8.24, Std = 0.6100, ChiSquare = 2.8991e-02 1.R62 HA = 3.720(D), Expected = 4.30, Std = 0.4600, ChiSquare = 2.0736e-01 1.R62 HB2 = 1.716(D), Expected = 1.79, Std = 0.2700, ChiSquare = 7.8403e-01 1.R62 HB3 = 1.455(D), Expected = 1.76, Std = 0.2800, ChiSquare = 2.7603e-01 1.R62 HG2 = 1.606(D), Expected = 1.57, Std = 0.2700, ChiSquare = 8.9393e-01 1.R62 HG3 = 1.319(D), Expected = 1.54, Std = 0.2900, ChiSquare = 4.4602e-01 1.R62 HD2 = 3.093(D), Expected = 3.12, Std = 0.2400, ChiSquare = 9.1043e-01 1.R62 HD3 = 3.014(D), Expected = 3.10, Std = 0.2600, ChiSquare = 7.4082e-01 1.L63 CA = 57.989(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.6605e-01 1.L63 CB = 41.427(D), Expected = 42.31, Std = 1.8800, ChiSquare = 6.3858e-01 1.L63 CG = 26.739(D), Expected = 26.78, Std = 1.1000, ChiSquare = 9.7027e-01 1.L63 CD1 = 25.801(D), Expected = 24.72, Std = 1.5900, ChiSquare = 4.9658e-01 1.L63 CD2 = 22.676(D), Expected = 24.05, Std = 1.7000, ChiSquare = 4.1896e-01 1.L63 H = 8.148(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.9961e-01 1.L63 HA = 3.763(D), Expected = 4.32, Std = 0.4700, ChiSquare = 2.3598e-01 1.L63 HB2 = 1.851(D), Expected = 1.61, Std = 0.3400, ChiSquare = 4.7843e-01 1.L63 HB3 = 1.254(D), Expected = 1.52, Std = 0.3600, ChiSquare = 4.5997e-01 1.L63 HG = 1.615(D), Expected = 1.51, Std = 0.3300, ChiSquare = 7.5035e-01 1.L63 HD11 = 0.950(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.7505e-01 1.L63 HD12 = 0.950(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.7505e-01 1.L63 HD13 = 0.950(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.7505e-01 1.L63 HD21 = 0.946(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.5638e-01 1.L63 HD22 = 0.946(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.5638e-01 1.L63 HD23 = 0.946(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.5638e-01 1.D64 CA = 56.739(D), Expected = 54.69, Std = 2.0300, ChiSquare = 3.1280e-01 1.D64 CB = 40.489(D), Expected = 40.88, Std = 1.6200, ChiSquare = 8.0928e-01 1.D64 H = 8.866(D), Expected = 8.31, Std = 0.5800, ChiSquare = 3.3775e-01 1.D64 HA = 4.385(D), Expected = 4.59, Std = 0.3200, ChiSquare = 5.2177e-01 1.D64 HB2 = 2.740(D), Expected = 2.72, Std = 0.2600, ChiSquare = 9.3868e-01 1.D64 HB3 = 2.633(D), Expected = 2.66, Std = 0.2800, ChiSquare = 9.2318e-01 1.Q65 CA = 56.114(D), Expected = 56.57, Std = 2.1400, ChiSquare = 8.3126e-01 1.Q65 CB = 29.239(D), Expected = 29.19, Std = 1.8200, ChiSquare = 9.7852e-01 1.Q65 CG = 33.926(D), Expected = 33.76, Std = 1.1100, ChiSquare = 8.8112e-01 1.Q65 H = 6.989(D), Expected = 8.22, Std = 0.5900, ChiSquare = 3.6939e-02 1.Q65 HA = 4.206(D), Expected = 4.27, Std = 0.4400, ChiSquare = 8.8435e-01 1.Q65 HB2 = 2.220(D), Expected = 2.05, Std = 0.2500, ChiSquare = 4.9650e-01 1.Q65 HB3 = 2.063(D), Expected = 2.02, Std = 0.2800, ChiSquare = 8.7795e-01 1.Q65 HG2 = 2.549(D), Expected = 2.32, Std = 0.2700, ChiSquare = 3.9636e-01 1.Q65 HG3 = 2.437(D), Expected = 2.29, Std = 0.2900, ChiSquare = 6.1223e-01 1.E66 H = 7.231(D), Expected = 8.33, Std = 0.5900, ChiSquare = 6.2503e-02 1.E66 HA = 4.657(D), Expected = 4.25, Std = 0.4100, ChiSquare = 3.2086e-01 1.E66 HB3 = 1.946(D), Expected = 1.99, Std = 0.2300, ChiSquare = 8.4829e-01 1.I67 CA = 63.927(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.8728e-01 1.I67 CB = 39.551(D), Expected = 38.63, Std = 2.0200, ChiSquare = 6.4843e-01 1.I67 CG1 = 27.676(D), Expected = 27.71, Std = 1.6800, ChiSquare = 9.8385e-01 1.I67 CG2 = 17.989(D), Expected = 17.53, Std = 1.3600, ChiSquare = 7.3574e-01 1.I67 CD1 = 13.926(D), Expected = 13.43, Std = 1.6700, ChiSquare = 7.6646e-01 1.I67 H = 8.568(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.7191e-01 1.I67 HA = 3.956(D), Expected = 4.18, Std = 0.5600, ChiSquare = 6.8916e-01 1.I67 HB = 1.901(D), Expected = 1.78, Std = 0.2900, ChiSquare = 6.7650e-01 1.I67 HG12 = 1.482(D), Expected = 1.28, Std = 0.4000, ChiSquare = 6.1356e-01 1.I67 HG13 = 1.287(D), Expected = 1.19, Std = 0.4100, ChiSquare = 8.1298e-01 1.I67 HG21 = 0.989(D), Expected = 0.77, Std = 0.2700, ChiSquare = 4.1730e-01 1.I67 HG22 = 0.989(D), Expected = 0.77, Std = 0.2700, ChiSquare = 4.1730e-01 1.I67 HG23 = 0.989(D), Expected = 0.77, Std = 0.2700, ChiSquare = 4.1730e-01 1.I67 HD11 = 0.913(D), Expected = 0.68, Std = 0.2900, ChiSquare = 4.2172e-01 1.I67 HD12 = 0.913(D), Expected = 0.68, Std = 0.2900, ChiSquare = 4.2172e-01 1.I67 HD13 = 0.913(D), Expected = 0.68, Std = 0.2900, ChiSquare = 4.2172e-01 1.D68 CA = 52.989(D), Expected = 54.69, Std = 2.0300, ChiSquare = 4.0207e-01 1.D68 H = 7.304(D), Expected = 8.31, Std = 0.5800, ChiSquare = 8.2833e-02 1.D68 HA = 4.609(D), Expected = 4.59, Std = 0.3200, ChiSquare = 9.5265e-01 1.D68 HB2 = 3.113(D), Expected = 2.72, Std = 0.2600, ChiSquare = 1.3065e-01 1.D68 HB3 = 2.993(D), Expected = 2.66, Std = 0.2800, ChiSquare = 2.3433e-01 1.D69 HB2 = 2.706(D), Expected = 2.72, Std = 0.2600, ChiSquare = 9.5706e-01 1.D69 HB3 = 2.582(D), Expected = 2.66, Std = 0.2800, ChiSquare = 7.8057e-01 1.Q70 CA = 58.927(D), Expected = 56.57, Std = 2.1400, ChiSquare = 2.7072e-01 1.Q70 CB = 27.676(D), Expected = 29.19, Std = 1.8200, ChiSquare = 4.0548e-01 1.Q70 CG = 33.614(D), Expected = 33.76, Std = 1.1100, ChiSquare = 8.9536e-01 1.Q70 H = 8.384(D), Expected = 8.22, Std = 0.5900, ChiSquare = 7.8104e-01 1.Q70 HA = 3.961(D), Expected = 4.27, Std = 0.4400, ChiSquare = 4.8251e-01 1.Q70 HB2 = 2.157(D), Expected = 2.05, Std = 0.2500, ChiSquare = 6.6865e-01 1.Q70 HB3 = 2.013(D), Expected = 2.02, Std = 0.2800, ChiSquare = 9.8006e-01 1.Q70 HG2 = 2.429(D), Expected = 2.32, Std = 0.2700, ChiSquare = 6.8643e-01 1.Q70 HG3 = 2.352(D), Expected = 2.29, Std = 0.2900, ChiSquare = 8.3071e-01 1.Q70 HE21 = 7.760(D), Expected = 7.24, Std = 0.4500, ChiSquare = 2.4786e-01 1.T71 CA = 66.739(D), Expected = 62.22, Std = 2.5900, ChiSquare = 8.1022e-02 1.T71 CB = 68.302(D), Expected = 69.73, Std = 1.6300, ChiSquare = 3.8099e-01 1.T71 CG2 = 22.364(D), Expected = 21.55, Std = 1.1100, ChiSquare = 4.6336e-01 1.T71 H = 8.599(D), Expected = 8.24, Std = 0.6200, ChiSquare = 5.6257e-01 1.T71 HA = 4.057(D), Expected = 4.46, Std = 0.4800, ChiSquare = 4.0114e-01 1.T71 HB = 4.177(D), Expected = 4.17, Std = 0.3300, ChiSquare = 9.8308e-01 1.T71 HG21 = 1.373(D), Expected = 1.14, Std = 0.2300, ChiSquare = 3.1104e-01 1.T71 HG22 = 1.373(D), Expected = 1.14, Std = 0.2300, ChiSquare = 3.1104e-01 1.T71 HG23 = 1.373(D), Expected = 1.14, Std = 0.2300, ChiSquare = 3.1104e-01 1.R72 H = 8.131(D), Expected = 8.24, Std = 0.6100, ChiSquare = 8.5818e-01 1.R72 HA = 3.652(D), Expected = 4.30, Std = 0.4600, ChiSquare = 1.5892e-01 1.A73 CA = 53.927(D), Expected = 53.14, Std = 1.9800, ChiSquare = 6.9102e-01 1.A73 CB = 18.301(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.9844e-01 1.A73 H = 7.903(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.2060e-01 1.A73 HA = 4.327(D), Expected = 4.26, Std = 0.4400, ChiSquare = 8.7897e-01 1.A73 HB1 = 1.414(D), Expected = 1.35, Std = 0.2600, ChiSquare = 8.0556e-01 1.A73 HB2 = 1.414(D), Expected = 1.35, Std = 0.2600, ChiSquare = 8.0556e-01 1.A73 HB3 = 1.414(D), Expected = 1.35, Std = 0.2600, ChiSquare = 8.0556e-01 1.E74 CA = 57.989(D), Expected = 57.32, Std = 2.0900, ChiSquare = 7.4890e-01 1.E74 CB = 30.801(D), Expected = 30.01, Std = 1.7200, ChiSquare = 6.4560e-01 1.E74 CG = 36.426(D), Expected = 36.11, Std = 1.1900, ChiSquare = 7.9059e-01 1.E74 H = 7.664(D), Expected = 8.33, Std = 0.5900, ChiSquare = 2.5898e-01 1.E74 HA = 4.275(D), Expected = 4.25, Std = 0.4100, ChiSquare = 9.5138e-01 1.E74 HB2 = 2.258(D), Expected = 2.02, Std = 0.2100, ChiSquare = 2.5707e-01 1.E74 HB3 = 2.205(D), Expected = 1.99, Std = 0.2300, ChiSquare = 3.4990e-01 1.E74 HG2 = 2.544(D), Expected = 2.27, Std = 0.2100, ChiSquare = 1.9197e-01 1.E74 HG3 = 2.376(D), Expected = 2.25, Std = 0.2200, ChiSquare = 5.6683e-01 1.T75 CA = 62.364(D), Expected = 62.22, Std = 2.5900, ChiSquare = 9.5566e-01 1.T75 CB = 70.489(D), Expected = 69.73, Std = 1.6300, ChiSquare = 6.4147e-01 1.T75 CG2 = 21.739(D), Expected = 21.55, Std = 1.1100, ChiSquare = 8.6480e-01 1.T75 H = 7.902(D), Expected = 8.24, Std = 0.6200, ChiSquare = 5.8564e-01 1.T75 HA = 4.405(D), Expected = 4.46, Std = 0.4800, ChiSquare = 9.0878e-01 1.T75 HB = 3.956(D), Expected = 4.17, Std = 0.3300, ChiSquare = 5.1667e-01 1.T75 HG21 = 1.159(D), Expected = 1.14, Std = 0.2300, ChiSquare = 9.3416e-01 1.T75 HG22 = 1.159(D), Expected = 1.14, Std = 0.2300, ChiSquare = 9.3416e-01 1.T75 HG23 = 1.159(D), Expected = 1.14, Std = 0.2300, ChiSquare = 9.3416e-01 1.F76 CA = 63.614(D), Expected = 58.08, Std = 2.5700, ChiSquare = 3.1295e-02 1.F76 CB = 40.180(D), Expected = 39.99, Std = 2.0900, ChiSquare = 9.2757e-01 1.F76 H = 7.730(D), Expected = 8.36, Std = 0.7200, ChiSquare = 3.8157e-01 1.F76 HA = 3.765(D), Expected = 4.63, Std = 0.5700, ChiSquare = 1.2913e-01 1.F76 HB2 = 3.505(D), Expected = 3.00, Std = 0.3700, ChiSquare = 1.7230e-01 1.F76 HB3 = 2.602(D), Expected = 2.93, Std = 0.4000, ChiSquare = 4.1222e-01 1.F76 HD1 = 6.716(D), Expected = 7.06, Std = 0.3100, ChiSquare = 2.6714e-01 1.F76 HD2 = 6.716(D), Expected = 7.06, Std = 0.3100, ChiSquare = 2.6714e-01 1.F76 HE1 = 6.830(D), Expected = 7.08, Std = 0.3100, ChiSquare = 4.1998e-01 1.F76 HE2 = 6.830(D), Expected = 7.08, Std = 0.3200, ChiSquare = 4.3466e-01 1.I77 CA = 63.927(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.8728e-01 1.I77 CB = 36.426(D), Expected = 38.63, Std = 2.0200, ChiSquare = 2.7523e-01 1.I77 CG1 = 28.926(D), Expected = 27.71, Std = 1.6800, ChiSquare = 4.6918e-01 1.I77 CG2 = 17.676(D), Expected = 17.53, Std = 1.3600, ChiSquare = 9.1451e-01 1.I77 CD1 = 12.364(D), Expected = 13.43, Std = 1.6700, ChiSquare = 5.2326e-01 1.I77 H = 8.417(D), Expected = 8.28, Std = 0.6800, ChiSquare = 8.4033e-01 1.I77 HA = 3.500(D), Expected = 4.18, Std = 0.5600, ChiSquare = 2.2464e-01 1.I77 HB = 1.935(D), Expected = 1.78, Std = 0.2900, ChiSquare = 5.9301e-01 1.I77 HG12 = 1.804(D), Expected = 1.28, Std = 0.4000, ChiSquare = 1.9020e-01 1.I77 HG13 = 1.298(D), Expected = 1.19, Std = 0.4100, ChiSquare = 7.9223e-01 1.I77 HG21 = 0.872(D), Expected = 0.77, Std = 0.2700, ChiSquare = 7.0560e-01 1.I77 HG22 = 0.872(D), Expected = 0.77, Std = 0.2700, ChiSquare = 7.0560e-01 1.I77 HG23 = 0.872(D), Expected = 0.77, Std = 0.2700, ChiSquare = 7.0560e-01 1.I77 HD11 = 1.081(D), Expected = 0.68, Std = 0.2900, ChiSquare = 1.6674e-01 1.I77 HD12 = 1.081(D), Expected = 0.68, Std = 0.2900, ChiSquare = 1.6674e-01 1.I77 HD13 = 1.081(D), Expected = 0.68, Std = 0.2900, ChiSquare = 1.6674e-01 1.Q78 CA = 59.239(D), Expected = 56.57, Std = 2.1400, ChiSquare = 2.1233e-01 1.Q78 CB = 27.989(D), Expected = 29.19, Std = 1.8200, ChiSquare = 5.0932e-01 1.Q78 CG = 33.614(D), Expected = 33.76, Std = 1.1100, ChiSquare = 8.9536e-01 1.Q78 H = 7.850(D), Expected = 8.22, Std = 0.5900, ChiSquare = 5.3058e-01 1.Q78 HA = 3.949(D), Expected = 4.27, Std = 0.4400, ChiSquare = 4.6567e-01 1.Q78 HB2 = 1.983(D), Expected = 2.05, Std = 0.2500, ChiSquare = 7.8870e-01 1.Q78 HB3 = 1.871(D), Expected = 2.02, Std = 0.2800, ChiSquare = 5.9463e-01 1.Q78 HG2 = 2.247(D), Expected = 2.32, Std = 0.2700, ChiSquare = 7.8688e-01 1.Q78 HG3 = 2.178(D), Expected = 2.29, Std = 0.2900, ChiSquare = 6.9934e-01 1.Q78 HE21 = 7.222(D), Expected = 7.24, Std = 0.4500, ChiSquare = 9.6809e-01 1.Q78 HE22 = 6.774(D), Expected = 7.02, Std = 0.4400, ChiSquare = 5.7610e-01 1.H79 CB = 31.426(D), Expected = 30.24, Std = 2.0700, ChiSquare = 5.6668e-01 1.H79 H = 8.370(D), Expected = 8.24, Std = 0.6800, ChiSquare = 8.4839e-01 1.H79 HA = 4.556(D), Expected = 4.61, Std = 0.4300, ChiSquare = 9.0006e-01 1.H79 HB2 = 2.821(D), Expected = 3.10, Std = 0.3600, ChiSquare = 4.3834e-01 1.H79 HB3 = 2.510(D), Expected = 3.04, Std = 0.3800, ChiSquare = 1.6309e-01 1.H79 HD2 = 6.753(D), Expected = 7.00, Std = 0.4300, ChiSquare = 5.6568e-01 1.H79 HE1 = 7.591(D), Expected = 7.95, Std = 0.4800, ChiSquare = 4.5451e-01 1.L80 CA = 58.614(D), Expected = 55.62, Std = 2.1300, ChiSquare = 1.5983e-01 1.L80 CB = 42.052(D), Expected = 42.31, Std = 1.8800, ChiSquare = 8.9085e-01 1.L80 CG = 26.426(D), Expected = 26.78, Std = 1.1000, ChiSquare = 7.4759e-01 1.L80 CD1 = 24.551(D), Expected = 24.72, Std = 1.5900, ChiSquare = 9.1535e-01 1.L80 CD2 = 24.942(D), Expected = 24.05, Std = 1.7000, ChiSquare = 5.9979e-01 1.L80 H = 8.656(D), Expected = 8.23, Std = 0.6500, ChiSquare = 5.1222e-01 1.L80 HA = 3.496(D), Expected = 4.32, Std = 0.4700, ChiSquare = 7.9569e-02 1.L80 HB2 = 1.655(D), Expected = 1.61, Std = 0.3400, ChiSquare = 8.9471e-01 1.L80 HB3 = 0.918(D), Expected = 1.52, Std = 0.3600, ChiSquare = 9.4481e-02 1.L80 HG = 0.599(D), Expected = 1.51, Std = 0.3300, ChiSquare = 5.7694e-03 1.L80 HD11 = 0.561(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.9968e-01 1.L80 HD12 = 0.561(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.9968e-01 1.L80 HD13 = 0.561(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.9968e-01 1.L80 HD21 = 0.652(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.8796e-01 1.L80 HD22 = 0.652(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.8796e-01 1.L80 HD23 = 0.652(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.8796e-01 1.N81 CA = 55.802(D), Expected = 53.54, Std = 1.8800, ChiSquare = 2.2890e-01 1.N81 CB = 37.676(D), Expected = 38.69, Std = 1.6900, ChiSquare = 5.4851e-01 1.N81 H = 8.660(D), Expected = 8.34, Std = 0.6300, ChiSquare = 6.1150e-01 1.N81 HA = 4.208(D), Expected = 4.67, Std = 0.3600, ChiSquare = 1.9938e-01 1.N81 HB2 = 2.789(D), Expected = 2.81, Std = 0.3100, ChiSquare = 9.4599e-01 1.N81 HB3 = 2.716(D), Expected = 2.75, Std = 0.3300, ChiSquare = 9.1794e-01 1.N81 HD21 = 7.299(D), Expected = 7.35, Std = 0.4800, ChiSquare = 9.1538e-01 1.N81 HD22 = 6.594(D), Expected = 7.14, Std = 0.4900, ChiSquare = 2.6516e-01 1.A82 CA = 55.489(D), Expected = 53.14, Std = 1.9800, ChiSquare = 2.3548e-01 1.A82 CB = 17.989(D), Expected = 19.01, Std = 1.8300, ChiSquare = 5.7690e-01 1.A82 H = 7.920(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.4074e-01 1.A82 HA = 4.234(D), Expected = 4.26, Std = 0.4400, ChiSquare = 9.5288e-01 1.A82 HB1 = 1.591(D), Expected = 1.35, Std = 0.2600, ChiSquare = 3.5397e-01 1.A82 HB2 = 1.591(D), Expected = 1.35, Std = 0.2600, ChiSquare = 3.5397e-01 1.A82 HB3 = 1.591(D), Expected = 1.35, Std = 0.2600, ChiSquare = 3.5397e-01 1.V83 CA = 66.427(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.6864e-01 1.V83 CB = 31.739(D), Expected = 32.73, Std = 1.7900, ChiSquare = 5.7983e-01 1.V83 CG1 = 23.301(D), Expected = 21.49, Std = 1.3600, ChiSquare = 1.8299e-01 1.V83 CG2 = 23.301(D), Expected = 21.26, Std = 1.5600, ChiSquare = 1.9076e-01 1.V83 H = 8.362(D), Expected = 8.29, Std = 0.6700, ChiSquare = 9.1442e-01 1.V83 HA = 4.028(D), Expected = 4.19, Std = 0.5800, ChiSquare = 7.8001e-01 1.V83 HB = 2.406(D), Expected = 1.98, Std = 0.3200, ChiSquare = 1.8311e-01 1.V83 HG11 = 1.107(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.8670e-01 1.V83 HG12 = 1.107(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.8670e-01 1.V83 HG13 = 1.107(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.8670e-01 1.V83 HG21 = 1.004(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.6626e-01 1.V83 HG22 = 1.004(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.6626e-01 1.V83 HG23 = 1.004(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.6626e-01 1.Y84 CA = 60.802(D), Expected = 58.13, Std = 2.5100, ChiSquare = 2.8708e-01 1.Y84 CB = 35.801(D), Expected = 39.32, Std = 2.1600, ChiSquare = 1.0328e-01 1.Y84 H = 9.022(D), Expected = 8.32, Std = 0.7300, ChiSquare = 3.3623e-01 1.Y84 HA = 4.132(D), Expected = 4.63, Std = 0.5600, ChiSquare = 3.7385e-01 1.Y84 HB2 = 3.272(D), Expected = 2.91, Std = 0.3700, ChiSquare = 3.2789e-01 1.Y84 HB3 = 3.149(D), Expected = 2.84, Std = 0.3900, ChiSquare = 4.2818e-01 1.Y84 HD1 = 6.969(D), Expected = 6.93, Std = 0.3000, ChiSquare = 8.9657e-01 1.Y84 HD2 = 6.969(D), Expected = 6.93, Std = 0.3000, ChiSquare = 8.9657e-01 1.Y84 HE1 = 6.642(D), Expected = 6.70, Std = 0.2300, ChiSquare = 8.0091e-01 1.Y84 HE2 = 6.642(D), Expected = 6.71, Std = 0.2300, ChiSquare = 7.6750e-01 1.E85 CA = 59.864(D), Expected = 57.32, Std = 2.0900, ChiSquare = 2.2352e-01 1.E85 CB = 29.551(D), Expected = 30.01, Std = 1.7200, ChiSquare = 7.8958e-01 1.E85 CG = 36.114(D), Expected = 36.11, Std = 1.1900, ChiSquare = 9.9732e-01 1.E85 H = 8.134(D), Expected = 8.33, Std = 0.5900, ChiSquare = 7.3974e-01 1.E85 HA = 4.229(D), Expected = 4.25, Std = 0.4100, ChiSquare = 9.5915e-01 1.E85 HB2 = 2.222(D), Expected = 2.02, Std = 0.2100, ChiSquare = 3.3610e-01 1.E85 HB3 = 2.222(D), Expected = 1.99, Std = 0.2300, ChiSquare = 3.1312e-01 1.E85 HG2 = 2.382(D), Expected = 2.27, Std = 0.2100, ChiSquare = 5.9380e-01 1.E85 HG3 = 2.257(D), Expected = 2.25, Std = 0.2200, ChiSquare = 9.7462e-01 1.I86 CA = 64.864(D), Expected = 61.61, Std = 2.6800, ChiSquare = 2.2468e-01 1.I86 CB = 38.926(D), Expected = 38.63, Std = 2.0200, ChiSquare = 8.8350e-01 1.I86 CG1 = 29.551(D), Expected = 27.71, Std = 1.6800, ChiSquare = 2.7315e-01 1.I86 CG2 = 17.364(D), Expected = 17.53, Std = 1.3600, ChiSquare = 9.0285e-01 1.I86 CD1 = 13.614(D), Expected = 13.43, Std = 1.6700, ChiSquare = 9.1227e-01 1.I86 H = 7.981(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.6015e-01 1.I86 HA = 3.798(D), Expected = 4.18, Std = 0.5600, ChiSquare = 4.9515e-01 1.I86 HB = 1.966(D), Expected = 1.78, Std = 0.2900, ChiSquare = 5.2128e-01 1.I86 HG12 = 1.800(D), Expected = 1.28, Std = 0.4000, ChiSquare = 1.9360e-01 1.I86 HG13 = 1.214(D), Expected = 1.19, Std = 0.4100, ChiSquare = 9.5332e-01 1.I86 HG21 = 0.955(D), Expected = 0.77, Std = 0.2700, ChiSquare = 4.9323e-01 1.I86 HG22 = 0.955(D), Expected = 0.77, Std = 0.2700, ChiSquare = 4.9323e-01 1.I86 HG23 = 0.955(D), Expected = 0.77, Std = 0.2700, ChiSquare = 4.9323e-01 1.I86 HD11 = 0.865(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.2352e-01 1.I86 HD12 = 0.865(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.2352e-01 1.I86 HD13 = 0.865(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.2352e-01 1.L87 CA = 55.177(D), Expected = 55.62, Std = 2.1300, ChiSquare = 8.3524e-01 1.L87 CG = 27.051(D), Expected = 26.78, Std = 1.1000, ChiSquare = 8.0540e-01 1.L87 CD1 = 25.176(D), Expected = 24.72, Std = 1.5900, ChiSquare = 7.7427e-01 1.L87 CD2 = 22.051(D), Expected = 24.05, Std = 1.7000, ChiSquare = 2.3964e-01 1.L87 H = 7.991(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.1310e-01 1.L87 HA = 4.306(D), Expected = 4.32, Std = 0.4700, ChiSquare = 9.7624e-01 1.L87 HB2 = 1.640(D), Expected = 1.61, Std = 0.3400, ChiSquare = 9.2969e-01 1.L87 HB3 = 1.540(D), Expected = 1.52, Std = 0.3600, ChiSquare = 9.5570e-01 1.L87 HG = 0.729(D), Expected = 1.51, Std = 0.3300, ChiSquare = 1.7949e-02 1.L87 HD11 = 0.321(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.2549e-01 1.L87 HD12 = 0.321(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.2549e-01 1.L87 HD13 = 0.321(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.2549e-01 1.L87 HD21 = 0.825(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.4322e-01 1.L87 HD22 = 0.825(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.4322e-01 1.L87 HD23 = 0.825(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.4322e-01 1.G88 CA = 47.052(D), Expected = 45.35, Std = 1.3400, ChiSquare = 2.0403e-01 1.G88 H = 7.854(D), Expected = 8.33, Std = 0.6500, ChiSquare = 4.6398e-01 1.G88 HA2 = 3.888(D), Expected = 3.97, Std = 0.3700, ChiSquare = 8.2461e-01 1.G88 HA3 = 3.974(D), Expected = 3.90, Std = 0.3700, ChiSquare = 8.4148e-01 1.L89 CB = 44.239(D), Expected = 42.31, Std = 1.8800, ChiSquare = 3.0486e-01 1.L89 CG = 26.426(D), Expected = 26.78, Std = 1.1000, ChiSquare = 7.4759e-01 1.L89 CD1 = 25.489(D), Expected = 24.72, Std = 1.5900, ChiSquare = 6.2864e-01 1.L89 CD2 = 22.051(D), Expected = 24.05, Std = 1.7000, ChiSquare = 2.3964e-01 1.L89 H = 8.510(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.6664e-01 1.L89 HA = 4.891(D), Expected = 4.32, Std = 0.4700, ChiSquare = 2.2441e-01 1.L89 HB2 = 1.231(D), Expected = 1.61, Std = 0.3400, ChiSquare = 2.6498e-01 1.L89 HB3 = 0.800(D), Expected = 1.52, Std = 0.3600, ChiSquare = 4.5500e-02 1.L89 HG = 1.240(D), Expected = 1.51, Std = 0.3300, ChiSquare = 4.1325e-01 1.L89 HD11 = 0.322(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.2637e-01 1.L89 HD12 = 0.322(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.2637e-01 1.L89 HD13 = 0.322(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.2637e-01 1.L89 HD21 = 0.445(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.2573e-01 1.L89 HD22 = 0.445(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.2573e-01 1.L89 HD23 = 0.445(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.2573e-01 1.N90 CB = 38.614(D), Expected = 38.69, Std = 1.6900, ChiSquare = 9.6413e-01 1.N90 HB2 = 3.485(D), Expected = 2.81, Std = 0.3100, ChiSquare = 2.9449e-02 1.N90 HB3 = 2.827(D), Expected = 2.75, Std = 0.3300, ChiSquare = 8.1550e-01 1.A91 CA = 55.177(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.0358e-01 1.A91 CB = 18.926(D), Expected = 19.01, Std = 1.8300, ChiSquare = 9.6339e-01 1.A91 HA = 4.311(D), Expected = 4.26, Std = 0.4400, ChiSquare = 9.0772e-01 1.A91 HB1 = 1.577(D), Expected = 1.35, Std = 0.2600, ChiSquare = 3.8262e-01 1.A91 HB2 = 1.577(D), Expected = 1.35, Std = 0.2600, ChiSquare = 3.8262e-01 1.A91 HB3 = 1.577(D), Expected = 1.35, Std = 0.2600, ChiSquare = 3.8262e-01 1.R92 CA = 56.114(D), Expected = 56.77, Std = 2.3100, ChiSquare = 7.7642e-01 1.R92 CB = 29.551(D), Expected = 30.70, Std = 1.8300, ChiSquare = 5.3009e-01 1.R92 CG = 27.989(D), Expected = 27.21, Std = 1.2000, ChiSquare = 5.1623e-01 1.R92 CD = 42.677(D), Expected = 43.16, Std = 0.8800, ChiSquare = 5.8310e-01 1.R92 H = 7.695(D), Expected = 8.24, Std = 0.6100, ChiSquare = 3.7162e-01 1.R92 HA = 4.293(D), Expected = 4.30, Std = 0.4600, ChiSquare = 9.8786e-01 1.R92 HB2 = 2.199(D), Expected = 1.79, Std = 0.2700, ChiSquare = 1.2982e-01 1.R92 HB3 = 2.199(D), Expected = 1.76, Std = 0.2800, ChiSquare = 1.1691e-01 1.R92 HG2 = 1.703(D), Expected = 1.57, Std = 0.2700, ChiSquare = 6.2230e-01 1.R92 HG3 = 1.393(D), Expected = 1.54, Std = 0.2900, ChiSquare = 6.1223e-01 1.R92 HD2 = 3.163(D), Expected = 3.12, Std = 0.2400, ChiSquare = 8.5781e-01 1.R92 HD3 = 3.129(D), Expected = 3.10, Std = 0.2600, ChiSquare = 9.1119e-01 1.G93 CA = 46.427(D), Expected = 45.35, Std = 1.3400, ChiSquare = 4.2155e-01 1.G93 HA2 = 3.303(D), Expected = 3.97, Std = 0.3700, ChiSquare = 7.1435e-02 1.G93 HA3 = 4.055(D), Expected = 3.90, Std = 0.3700, ChiSquare = 6.7528e-01 1.Q94 CA = 53.614(D), Expected = 56.57, Std = 2.1400, ChiSquare = 1.6718e-01 1.Q94 CB = 29.864(D), Expected = 29.19, Std = 1.8200, ChiSquare = 7.1114e-01 1.Q94 CG = 33.614(D), Expected = 33.76, Std = 1.1100, ChiSquare = 8.9536e-01 1.Q94 HA = 4.438(D), Expected = 4.27, Std = 0.4400, ChiSquare = 7.0260e-01 1.Q94 HB2 = 2.014(D), Expected = 2.05, Std = 0.2500, ChiSquare = 8.8550e-01 1.Q94 HB3 = 1.914(D), Expected = 2.02, Std = 0.2800, ChiSquare = 7.0501e-01 1.Q94 HG2 = 2.286(D), Expected = 2.32, Std = 0.2700, ChiSquare = 8.9979e-01 1.Q94 HG3 = 2.248(D), Expected = 2.29, Std = 0.2900, ChiSquare = 8.8485e-01 1.S95 CA = 59.239(D), Expected = 58.72, Std = 2.0700, ChiSquare = 8.0203e-01 1.S95 CB = 63.614(D), Expected = 63.80, Std = 1.4800, ChiSquare = 8.9999e-01 1.S95 HA = 4.559(D), Expected = 4.48, Std = 0.4000, ChiSquare = 8.4344e-01 1.S95 HB2 = 3.839(D), Expected = 3.88, Std = 0.2500, ChiSquare = 8.6973e-01 1.S95 HB3 = 3.808(D), Expected = 3.85, Std = 0.2700, ChiSquare = 8.7638e-01 1.I96 CA = 62.052(D), Expected = 61.61, Std = 2.6800, ChiSquare = 8.6900e-01 1.I96 CB = 38.926(D), Expected = 38.63, Std = 2.0200, ChiSquare = 8.8350e-01 1.I96 CG1 = 27.364(D), Expected = 27.71, Std = 1.6800, ChiSquare = 8.3683e-01 1.I96 CG2 = 18.301(D), Expected = 17.53, Std = 1.3600, ChiSquare = 5.7077e-01 1.I96 CD1 = 13.926(D), Expected = 13.43, Std = 1.6700, ChiSquare = 7.6646e-01 1.I96 H = 8.394(D), Expected = 8.28, Std = 0.6800, ChiSquare = 8.6686e-01 1.I96 HA = 4.166(D), Expected = 4.18, Std = 0.5600, ChiSquare = 9.8006e-01 1.I96 HB = 1.892(D), Expected = 1.78, Std = 0.2900, ChiSquare = 6.9934e-01 1.I96 HG12 = 1.337(D), Expected = 1.28, Std = 0.4000, ChiSquare = 8.8669e-01 1.I96 HG13 = 1.051(D), Expected = 1.19, Std = 0.4100, ChiSquare = 7.3459e-01 1.I96 HG21 = 0.884(D), Expected = 0.77, Std = 0.2700, ChiSquare = 6.7286e-01 1.I96 HG22 = 0.884(D), Expected = 0.77, Std = 0.2700, ChiSquare = 6.7286e-01 1.I96 HG23 = 0.884(D), Expected = 0.77, Std = 0.2700, ChiSquare = 6.7286e-01 1.I96 HD11 = 0.788(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.0958e-01 1.I96 HD12 = 0.788(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.0958e-01 1.I96 HD13 = 0.788(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.0958e-01 1.R97 CA = 55.802(D), Expected = 56.77, Std = 2.3100, ChiSquare = 6.7518e-01 1.R97 CB = 30.801(D), Expected = 30.70, Std = 1.8300, ChiSquare = 9.5599e-01 1.R97 CG = 27.051(D), Expected = 27.21, Std = 1.2000, ChiSquare = 8.9459e-01 1.R97 CD = 43.614(D), Expected = 43.16, Std = 0.8800, ChiSquare = 6.0592e-01 1.R97 H = 8.229(D), Expected = 8.24, Std = 0.6100, ChiSquare = 9.8561e-01 1.R97 HA = 4.363(D), Expected = 4.30, Std = 0.4600, ChiSquare = 8.9107e-01 1.R97 HB2 = 1.821(D), Expected = 1.79, Std = 0.2700, ChiSquare = 9.0859e-01 1.R97 HB3 = 1.711(D), Expected = 1.76, Std = 0.2800, ChiSquare = 8.6108e-01 1.R97 HG2 = 1.629(D), Expected = 1.57, Std = 0.2700, ChiSquare = 8.2703e-01 1.R97 HG3 = 1.555(D), Expected = 1.54, Std = 0.2900, ChiSquare = 9.5875e-01 1.R97 HD2 = 3.162(D), Expected = 3.12, Std = 0.2400, ChiSquare = 8.6108e-01 1.R97 HD3 = 3.162(D), Expected = 3.10, Std = 0.2600, ChiSquare = 8.1152e-01 1.E99 HB3 = 1.857(D), Expected = 1.99, Std = 0.2300, ChiSquare = 5.6309e-01