Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> R 0.41 L 0.3 G 0.09 D 0.06 F 0.05 Y 0.03 K 0.03 C Shift Assignments>> CA :: 43.483(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 3.800(D) HA3 :: 3.800(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 1.A2 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.89 M 0.08 C Shift Assignments>> CA :: 52.546(D) CB :: 19.408(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.189(D) HA :: 4.334(D) HB1 :: 1.376(D) HB2 :: 1.376(D) HB3 :: 1.376(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.700(D) Ave N Shift Values>> N :: 123.23(3.54) 1.M3 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.73 Q 0.23 K 0.01 E 0.01 C Shift Assignments>> CA :: 55.577(D) CB :: 32.282(D) CG :: 32.818(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 :: 8.499(D) HA :: 4.441(D) HB2 :: 2.531(D) HB3 :: 2.586(D) HG2 :: 1.999(D) HG3 :: 2.055(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 :: 119.676(D) Ave N Shift Values>> N :: 120.09(3.57) 1.G4 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.88 L 0.09 C Shift Assignments>> CA :: 45.411(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.395(D) HA2 :: 3.937(D) HA3 :: 3.937(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.982(D) Ave N Shift Values>> N :: 109.67(3.87) 1.M5 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.67 Q 0.27 K 0.02 E 0.02 C Shift Assignments>> CA :: 55.325(D) CB :: 32.112(D) CG :: 33.000(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 :: 8.207(D) HA :: 4.486(D) HB2 :: 2.476(D) HB3 :: 2.513(D) HG2 :: 1.949(D) HG3 :: 2.040(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 :: 119.734(D) Ave N Shift Values>> N :: 120.09(3.57) 1.S6 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> CA :: 58.471(D) CB :: 63.837(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.322(D) HA :: 4.413(D) HB2 :: 3.792(D) HB3 :: 3.792(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 :: 116.731(D) Ave N Shift Values>> N :: 116.28(3.52) 1.H7 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.21 H 0.21 E 0.16 Q 0.14 M 0.13 K 0.1 HN Overlap>> 1.E35 1.E35 C Shift Assignments>> CA :: 56.062(D) CB :: 30.753(D) 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 :: 8.343(D) HA :: 4.641(D) HB2 :: 3.013(D) HB3 :: 3.070(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 :: 120.800(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.I8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.99 C Shift Assignments>> CA :: 60.584(D) CB :: 38.169(D) CG1 :: 27.442(D) CG2 :: 18.259(D) CD1 :: 12.207(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 :: 8.270(D) HA :: 3.984(D) HB :: 1.711(D) HG12 :: 1.157(D) HG13 :: 1.284(D) HG21 :: 0.780(D) HG22 :: 0.780(D) HG23 :: 0.780(D) HD11 :: 0.705(D) HD12 :: 0.705(D) HD13 :: 0.705(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 :: 123.181(D) Ave N Shift Values>> N :: 121.46(4.28) 1.Q9 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.43 K 0.32 M 0.12 E 0.07 R 0.02 C Shift Assignments>> CA :: 54.852(D) CB :: 29.651(D) CG :: 33.791(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 :: 8.359(D) HA :: 4.268(D) HB2 :: 1.869(D) HB3 :: 1.920(D) HG2 :: 2.203(D) HG3 :: 2.203(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 :: 126.943(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.I10 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.9 A 0.09 C Shift Assignments>> CA :: 57.620(D) CB :: 37.186 CG1 :: 27.022(D) CG2 :: 17.608(D) CD1 :: 11.710(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 :: 8.517(D) HA :: 4.174(D) HB :: 1.925(D) HG12 :: 1.179(D) HG13 :: 1.477(D) HG21 :: 0.894(D) HG22 :: 0.894(D) HG23 :: 0.894(D) HD11 :: 0.722(D) HD12 :: 0.722(D) HD13 :: 0.722(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 :: 125.692(D) Ave N Shift Values>> N :: 121.46(4.28) 1.P11 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.P12 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.88 L 0.08 C Shift Assignments>> CA :: 45.471(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.751(D) HA2 :: 3.940(D) HA3 :: 3.940(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.392(D) Ave N Shift Values>> N :: 109.67(3.87) 1.L14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.6 R 0.35 G 0.02 K 0.01 C Shift Assignments>> CA :: 58.672(D) CB :: 42.300(D) CG :: 27.597(D) CD1 :: 24.558(D) CD2 :: 26.364(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 :: 7.546(D) HA :: 4.119(D) HB2 :: 1.462(D) HB3 :: 1.386(D) HG :: 1.575(D) HD11 :: 1.127(D) HD12 :: 1.127(D) HD13 :: 1.127(D) HD21 :: 0.987(D) HD22 :: 0.987(D) HD23 :: 0.987(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 :: 122.193(D) Ave N Shift Values>> N :: 121.86(3.9) 1.T15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> CA :: 67.350(D) CB :: 68.035(D) CG2 :: 22.174(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 :: 8.621(D) HA :: 3.650(D) HB :: 4.100(D) HG21 :: 1.192(D) HG22 :: 1.192(D) HG23 :: 1.192(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 :: 114.575(D) Ave N Shift Values>> N :: 115.42(4.75) 1.E16 Overall: Clerical Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Duplicate N Shifts: Duplicate H Shift Assignments>> H :: 8.937(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 :: 121.469(D) Ave N Shift Values>> N :: 120.67(3.48) 1.L17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.46 V 0.18 K 0.17 T 0.14 HN Overlap>> 1.R43 1.R43 C Shift Assignments>> CA :: 57.900(D) CD2 :: 22.802(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 :: 7.913(D) HA :: 4.289(D) HB2 :: 1.630(D) HB3 :: 2.140(D) HG :: 1.931(D) HD11 :: 1.038(D) HD12 :: 1.038(D) HD13 :: 1.038(D) HD21 :: 0.995(D) HD22 :: 0.995(D) HD23 :: 0.995(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 :: 121.877(D) Ave N Shift Values>> N :: 121.86(3.9) 1.L18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.93 R 0.04 G 0.01 C Shift Assignments>> CA :: 57.683(D) CB :: 42.150(D) CG :: 26.850(D) CD1 :: 24.376(D) CD2 :: 24.926(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 :: 8.566(D) HA :: 3.899(D) HB2 :: 1.532(D) HB3 :: 1.531(D) HG :: 1.386(D) HD11 :: 0.768(D) HD12 :: 0.768(D) HD13 :: 0.768(D) HD21 :: 0.743(D) HD22 :: 0.743(D) HD23 :: 0.743(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 :: 116.949(D) Ave N Shift Values>> N :: 121.86(3.9) 1.Q19 Overall: Clerical Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Duplicate N Shifts: Duplicate H Shift Assignments>> H :: 9.088(D) HA :: 4.664(D) HB2 :: 1.791(D) HB3 :: 1.791(D) HG2 :: 2.379(D) HG3 :: 2.379(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 :: 122.865(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.G20 Overall: Suspicious Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Duplicate N Shifts: Suspicious H Shift Assignments>> H :: 7.998 HA2 :: 4.121(D) HA3 :: 4.121(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 126.606(S) Ave N Shift Values>> N :: 109.67(3.87) 1.Y21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.17 T 0.13 S 0.12 V 0.12 F 0.11 Y 0.11 E 0.04 K 0.03 R 0.03 H 0.02 Q 0.02 M 0.01 P 0.01 C Shift Assignments>> CA :: 60.282(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 6.991(D) HA :: 3.633(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 :: 119.726 Ave N Shift Values>> N :: 120.52(4.2) 1.T22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> CA :: 68.423(D) CB :: 67.435(D) CG2 :: 22.144(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 :: 7.991(D) HA :: 3.266(D) HB :: 4.181(D) HG21 :: 0.995(D) HG22 :: 0.995(D) HG23 :: 0.995(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 :: 115.834(D) Ave N Shift Values>> N :: 115.42(4.75) 1.V23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> CA :: 67.101(D) CB :: 31.485(D) CG1 :: 24.405(D) CG2 :: 21.313(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 :: 8.558(D) HA :: 3.425(D) HB :: 2.126(D) HG11 :: 0.963(D) HG12 :: 0.963(D) HG13 :: 0.963(D) HG21 :: 0.938(D) HG22 :: 0.938(D) HG23 :: 0.938(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 :: 120.852(D) Ave N Shift Values>> N :: 121.14(4.54) 1.E24 Overall: Clerical Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Duplicate N Shifts: Duplicate H Shift Assignments>> H :: 6.949(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.265(D) Ave N Shift Values>> N :: 120.67(3.48) 1.V25 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> CA :: 66.437(D) CB :: 30.900(D) CG1 :: 23.230(D) CG2 :: 23.444(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 :: 8.063(D) HA :: 2.694(D) HB :: 1.910(D) HG11 :: 0.592(D) HG12 :: 0.592(D) HG13 :: 0.592(D) HG21 :: 0.228(D) HG22 :: 0.228(D) HG23 :: 0.228(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 :: 120.521(D) Ave N Shift Values>> N :: 121.14(4.54) 1.L26 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.93 R 0.04 A 0.01 C Shift Assignments>> CA :: 57.571(D) CB :: 41.080(D) CG :: 26.900(D) CD1 :: 22.874(D) CD2 :: 26.100(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 :: 8.169(D) HA :: 3.861(D) HB2 :: 1.903(D) HB3 :: 1.212(D) HG :: 1.939(D) HD11 :: 0.703(D) HD12 :: 0.703(D) HD13 :: 0.703(D) HD21 :: 0.653(D) HD22 :: 0.653(D) HD23 :: 0.653(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 :: 118.175(D) Ave N Shift Values>> N :: 121.86(3.9) 1.R27 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.49 G 0.27 L 0.21 K 0.02 C Shift Assignments>> CA :: 59.355(D) CB :: 27.472(D) CG :: 27.470(D) CD :: 43.573(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 :: 8.184(D) HA :: 3.941(D) HB2 :: 1.671(D) HB3 :: 1.671(D) HG2 :: 1.503(D) HG3 :: 1.503(D) HD2 :: 3.060(D) HD3 :: 3.060(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 :: 116.756(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.Q28 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.61 I 0.18 K 0.11 Q 0.04 M 0.03 C Shift Assignments>> CA :: 58.006(D) CB :: 29.421(D) CG :: 36.589(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 :: 8.523(D) HA :: 4.059(D) HB2 :: 2.058(D) HB3 :: 2.012(D) HG2 :: 2.411(D) HG3 :: 2.305(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 :: 115.153(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.Q29 Overall: Clerical Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Duplicate N Shifts: Duplicate H Shift Assignments>> H :: 9.215(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 123.678(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.P30 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> I 0.22 T 0.16 V 0.16 S 0.1 F 0.09 Y 0.09 E 0.03 R 0.02 K 0.02 P 0.02 H 0.02 Q 0.01 M 0.01 C Shift Assignments>> CA :: 60.722(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 :: 4.531(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.P31 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> P 0.96 S 0.02 C Shift Assignments>> CA :: 63.988(D) CB :: 35.611(D) CD :: 50.573(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 :: 4.338(D) HB2 :: 2.321(D) HB3 :: 2.248(D) HG2 :: 1.981(D) HG3 :: 1.981(D) HD2 :: 3.802(D) HD3 :: 3.733(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.D32 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.34 D 0.27 R 0.18 G 0.07 K 0.06 F 0.03 Y 0.02 C Shift Assignments>> CA :: 52.460(D) CB :: 42.882(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 :: 7.530(D) HA :: 4.952(D) HB2 :: 2.898(D) HB3 :: 2.467(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 :: 116.066(D) Ave N Shift Values>> N :: 120.65(3.86) 1.L33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.83 R 0.12 G 0.03 C Shift Assignments>> CA :: 59.573(D) CB :: 42.275(D) CG :: 26.910(D) CD1 :: 25.807(D) CD2 :: 23.827(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 :: 9.074(D) HA :: 3.835(D) HB2 :: 1.821(D) HB3 :: 1.550(D) HG :: 1.876(D) HD11 :: 0.838(D) HD12 :: 0.838(D) HD13 :: 0.838(D) HD21 :: 0.755(D) HD22 :: 0.755(D) HD23 :: 0.755(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 :: 125.925(D) Ave N Shift Values>> N :: 121.86(3.9) 1.V34 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> CA :: 67.000(D) CB :: 31.806(D) CG1 :: 24.035(D) CG2 :: 22.737(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 :: 8.165(D) HA :: 3.621(D) HB :: 2.312(D) HG11 :: 1.147(D) HG12 :: 1.147(D) HG13 :: 1.147(D) HG21 :: 0.989(D) HG22 :: 0.989(D) HG23 :: 0.989(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 :: 121.227(D) Ave N Shift Values>> N :: 121.14(4.54) 1.E35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.16 Y 0.13 F 0.13 I 0.09 E 0.07 V 0.06 T 0.06 K 0.05 R 0.05 H 0.04 Q 0.04 M 0.03 L 0.01 HN Overlap>> 1.H7 1.H7 C Shift Assignments>> CA :: 59.428(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 :: 8.237(D) HA :: 3.921(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 :: 120.804(D) Ave N Shift Values>> N :: 120.67(3.48) 1.F36 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.5 F 0.24 Y 0.23 C Shift Assignments>> CA :: 61.500(D) CB :: 39.833(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.012(D) HA :: 4.356(D) HB2 :: 3.231(D) HB3 :: 2.794(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 116.846(D) Ave N Shift Values>> N :: 120.45(4.18) 1.A37 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.8 A 0.13 I 0.05 HN Overlap>> 1.S52 1.S52 C Shift Assignments>> CA :: 55.684(D) CB :: 16.310(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.954(D) HA :: 3.733(D) HB1 :: 0.611(D) HB2 :: 0.611(D) HB3 :: 0.611(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.724(D) Ave N Shift Values>> N :: 123.23(3.54) 1.V38 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> CA :: 68.531(D) CB :: 32.965(D) CG1 :: 20.870(D) CG2 :: 21.690(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 :: 8.202(D) HA :: 3.366(D) HB :: 2.184(D) HG11 :: 0.951(D) HG12 :: 0.951(D) HG13 :: 0.951(D) HG21 :: 0.880(D) HG22 :: 0.880(D) HG23 :: 0.880(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 :: 117.592(D) Ave N Shift Values>> N :: 121.14(4.54) 1.E39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.52 I 0.23 K 0.12 Q 0.08 M 0.03 C Shift Assignments>> CA :: 59.703(D) CB :: 29.589(D) CG :: 35.919(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 :: 7.830(D) HA :: 3.876(D) HB2 :: 2.073(D) HB3 :: 1.999(D) HG2 :: 2.281(D) HG3 :: 2.281(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 :: 121.474(D) Ave N Shift Values>> N :: 120.67(3.48) 1.Y40 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.62 Y 0.19 F 0.17 C Shift Assignments>> CA :: 61.995(D) CB :: 38.950(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.939(D) HA :: 3.539(D) HB2 :: 2.272(D) HB3 :: 2.173(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 :: 120.686(D) Ave N Shift Values>> N :: 120.52(4.2) 1.F41 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.74 Y 0.12 F 0.1 V 0.01 C Shift Assignments>> CA :: 62.791(D) CB :: 38.033(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.737(D) HA :: 4.113(D) HB2 :: 3.150(D) HB3 :: 2.742(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 :: 115.524(D) Ave N Shift Values>> N :: 120.45(4.18) 1.T42 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> CA :: 67.893(D) CB :: 68.166(D) CG2 :: 21.288(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 :: 8.016(D) HA :: 3.727(D) HB :: 4.240(D) HG21 :: 1.175(D) HG22 :: 1.175(D) HG23 :: 1.175(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 :: 117.076(D) Ave N Shift Values>> N :: 115.42(4.75) 1.R43 Overall: Clerical Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Duplicate N Shifts: Duplicate HN Overlap>> 1.L17 1.L17 H Shift Assignments>> H :: 7.859(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 :: 121.893(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.L44 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.56 R 0.37 G 0.05 C Shift Assignments>> CA :: 57.962(D) CB :: 42.680(D) CG :: 27.079(D) CD1 :: 26.205(D) CD2 :: 26.625(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 :: 7.430(D) HA :: 4.309(D) HB2 :: 2.072(D) HB3 :: 2.000(D) HG :: 1.863(D) HD11 :: 1.109(D) HD12 :: 1.109(D) HD13 :: 1.109(D) HD21 :: 0.986(D) HD22 :: 0.986(D) HD23 :: 0.986(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 :: 119.704(D) Ave N Shift Values>> N :: 121.86(3.9) 1.R45 Overall: Clerical Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Duplicate N Shifts: Duplicate H Shift Assignments>> H :: 7.935(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 :: 119.789(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.E46 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.61 I 0.14 K 0.12 Q 0.06 M 0.04 C Shift Assignments>> CA :: 57.830(D) CB :: 29.481(D) CG :: 36.441(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 :: 7.998(D) HA :: 4.191(D) HB2 :: 2.176(D) HB3 :: 1.942(D) HG2 :: 2.525(D) HG3 :: 2.525(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 :: 117.902(D) Ave N Shift Values>> N :: 120.67(3.48) 1.A47 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.8 M 0.18 C Shift Assignments>> CA :: 53.011(D) CB :: 18.693(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.689(D) HA :: 4.235(D) HB1 :: 1.420(D) HB2 :: 1.420(D) HB3 :: 1.420(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.880(D) Ave N Shift Values>> N :: 123.23(3.54) 1.R48 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.71 G 0.26 K 0.02 C Shift Assignments>> CA :: 56.520(D) CB :: 30.924(D) CG :: 26.817(D) CD :: 44.044(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 :: 7.470(D) HA :: 4.240(D) HB2 :: 1.929(D) HB3 :: 1.824(D) HG2 :: 1.808(D) HG3 :: 1.728(D) HD2 :: 3.190(D) HD3 :: 3.190(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 :: 117.602(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.A49 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.9 M 0.09 C Shift Assignments>> CA :: 50.677(D) CB :: 18.104(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.937(D) HA :: 4.572(D) HB1 :: 1.367(D) HB2 :: 1.367(D) HB3 :: 1.367(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.709(D) Ave N Shift Values>> N :: 123.23(3.54) 1.P50 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> CA :: 63.095(D) CB :: 32.027(D) CG :: 27.479(D) CD :: 50.437(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 :: 4.412(D) HB2 :: 2.297(D) HB3 :: 1.944(D) HG2 :: 2.025(D) HG3 :: 2.018(D) HD2 :: 3.786(D) HD3 :: 3.622(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.A51 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.89 M 0.09 C Shift Assignments>> CA :: 52.531(D) CB :: 19.367(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.425(D) HA :: 4.347(D) HB1 :: 1.399(D) HB2 :: 1.399(D) HB3 :: 1.399(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.078(D) Ave N Shift Values>> N :: 123.23(3.54) 1.S52 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.98 T 0.01 HN Overlap>> 1.A37 1.A37 C Shift Assignments>> CA :: 59.828(D) CB :: 64.951(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.879(D) HA :: 4.227(D) HB2 :: 3.822(D) HB3 :: 3.822(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 :: 120.645(D) Ave N Shift Values>> N :: 116.28(3.52) 2.R1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.T3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.A4 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E5 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E6 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.V7 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.S8 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.A9 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.R10 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.I11 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.V12 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.Q13 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.V14 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.V15 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.T16 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.A17 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E18 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.A19 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.V20 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.A21 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.V22 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.L23 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.K24 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.G25 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E26 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.Q27 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E28 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable ########################################################################### Overall Results: #Consistent: 30 #Clerical: 49 #Suspicious: 1 #Anomalous: 0 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 43 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 37 Shift Relative Order (SRO) Results: #Consistent: 80 #Suspicious: 0 C Shift Results: #Consistent: 1 #Duplicate: 124 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 1 #Duplicate: 287 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 N Shift Results: #Consistent: 1 #Duplicate: 44 #Unknown: 0 #Suspicious: 1 #Anomalous: 0 Error Summary: 1.G1 CA = 43.483(D), Expected = 45.35, Std = 1.3400, ChiSquare = 1.6353e-01 1.G1 HA2 = 3.800(D), Expected = 3.97, Std = 0.3700, ChiSquare = 6.4590e-01 1.G1 HA3 = 3.800(D), Expected = 3.90, Std = 0.3700, ChiSquare = 7.8695e-01 1.A2 CA = 52.546(D), Expected = 53.14, Std = 1.9800, ChiSquare = 7.6418e-01 1.A2 CB = 19.408(D), Expected = 19.01, Std = 1.8300, ChiSquare = 8.2783e-01 1.A2 H = 8.189(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.8537e-01 1.A2 HA = 4.334(D), Expected = 4.26, Std = 0.4400, ChiSquare = 8.6644e-01 1.A2 HB1 = 1.376(D), Expected = 1.35, Std = 0.2600, ChiSquare = 9.2034e-01 1.A2 HB2 = 1.376(D), Expected = 1.35, Std = 0.2600, ChiSquare = 9.2034e-01 1.A2 HB3 = 1.376(D), Expected = 1.35, Std = 0.2600, ChiSquare = 9.2034e-01 1.A2 N = 123.700(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.9438e-01 1.M3 CA = 55.577(D), Expected = 56.11, Std = 2.2300, ChiSquare = 8.1110e-01 1.M3 CB = 32.282(D), Expected = 32.99, Std = 2.2400, ChiSquare = 7.5195e-01 1.M3 CG = 32.818(D), Expected = 32.01, Std = 1.2400, ChiSquare = 5.1465e-01 1.M3 H = 8.499(D), Expected = 8.26, Std = 0.6000, ChiSquare = 6.9038e-01 1.M3 HA = 4.441(D), Expected = 4.41, Std = 0.4800, ChiSquare = 9.4851e-01 1.M3 HB2 = 2.531(D), Expected = 2.03, Std = 0.3400, ChiSquare = 1.4061e-01 1.M3 HB3 = 2.586(D), Expected = 1.99, Std = 0.3400, ChiSquare = 7.9612e-02 1.M3 HG2 = 1.999(D), Expected = 2.42, Std = 0.3500, ChiSquare = 2.2903e-01 1.M3 HG3 = 2.055(D), Expected = 2.39, Std = 0.3800, ChiSquare = 3.7800e-01 1.M3 N = 119.676(D), Expected = 120.09, Std = 3.5700, ChiSquare = 9.0768e-01 1.G4 CA = 45.411(D), Expected = 45.35, Std = 1.3400, ChiSquare = 9.6369e-01 1.G4 H = 8.395(D), Expected = 8.33, Std = 0.6500, ChiSquare = 9.2034e-01 1.G4 HA2 = 3.937(D), Expected = 3.97, Std = 0.3700, ChiSquare = 9.2893e-01 1.G4 HA3 = 3.937(D), Expected = 3.90, Std = 0.3700, ChiSquare = 9.2034e-01 1.G4 N = 109.982(D), Expected = 109.67, Std = 3.8700, ChiSquare = 9.3574e-01 1.M5 CA = 55.325(D), Expected = 56.11, Std = 2.2300, ChiSquare = 7.2482e-01 1.M5 CB = 32.112(D), Expected = 32.99, Std = 2.2400, ChiSquare = 6.9508e-01 1.M5 CG = 33.000(D), Expected = 32.01, Std = 1.2400, ChiSquare = 4.2465e-01 1.M5 H = 8.207(D), Expected = 8.26, Std = 0.6000, ChiSquare = 9.2961e-01 1.M5 HA = 4.486(D), Expected = 4.41, Std = 0.4800, ChiSquare = 8.7419e-01 1.M5 HB2 = 2.476(D), Expected = 2.03, Std = 0.3400, ChiSquare = 1.8960e-01 1.M5 HB3 = 2.513(D), Expected = 1.99, Std = 0.3400, ChiSquare = 1.2399e-01 1.M5 HG2 = 1.949(D), Expected = 2.42, Std = 0.3500, ChiSquare = 1.7839e-01 1.M5 HG3 = 2.040(D), Expected = 2.39, Std = 0.3800, ChiSquare = 3.5702e-01 1.M5 N = 119.734(D), Expected = 120.09, Std = 3.5700, ChiSquare = 9.2057e-01 1.S6 CA = 58.471(D), Expected = 58.72, Std = 2.0700, ChiSquare = 9.0425e-01 1.S6 CB = 63.837(D), Expected = 63.80, Std = 1.4800, ChiSquare = 9.8006e-01 1.S6 H = 8.322(D), Expected = 8.28, Std = 0.5900, ChiSquare = 9.4325e-01 1.S6 HA = 4.413(D), Expected = 4.48, Std = 0.4000, ChiSquare = 8.6698e-01 1.S6 HB2 = 3.792(D), Expected = 3.88, Std = 0.2500, ChiSquare = 7.2484e-01 1.S6 HB3 = 3.792(D), Expected = 3.85, Std = 0.2700, ChiSquare = 8.2991e-01 1.S6 N = 116.731(D), Expected = 116.28, Std = 3.5200, ChiSquare = 8.9805e-01 1.H7 CA = 56.062(D), Expected = 56.52, Std = 2.3100, ChiSquare = 8.4284e-01 1.H7 CB = 30.753(D), Expected = 30.24, Std = 2.0700, ChiSquare = 8.0427e-01 1.H7 H = 8.343(D), Expected = 8.24, Std = 0.6800, ChiSquare = 8.7960e-01 1.H7 HA = 4.641(D), Expected = 4.61, Std = 0.4300, ChiSquare = 9.4253e-01 1.H7 HB2 = 3.013(D), Expected = 3.10, Std = 0.3600, ChiSquare = 8.0904e-01 1.H7 HB3 = 3.070(D), Expected = 3.04, Std = 0.3800, ChiSquare = 9.3707e-01 1.H7 N = 120.800(D), Expected = 119.69, Std = 4.0000, ChiSquare = 7.8140e-01 1.I8 CA = 60.584(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.0184e-01 1.I8 CB = 38.169(D), Expected = 38.63, Std = 2.0200, ChiSquare = 8.1948e-01 1.I8 CG1 = 27.442(D), Expected = 27.71, Std = 1.6800, ChiSquare = 8.7326e-01 1.I8 CG2 = 18.259(D), Expected = 17.53, Std = 1.3600, ChiSquare = 5.9194e-01 1.I8 CD1 = 12.207(D), Expected = 13.43, Std = 1.6700, ChiSquare = 4.6396e-01 1.I8 H = 8.270(D), Expected = 8.28, Std = 0.6800, ChiSquare = 9.8827e-01 1.I8 HA = 3.984(D), Expected = 4.18, Std = 0.5600, ChiSquare = 7.2634e-01 1.I8 HB = 1.711(D), Expected = 1.78, Std = 0.2900, ChiSquare = 8.1193e-01 1.I8 HG12 = 1.157(D), Expected = 1.28, Std = 0.4000, ChiSquare = 7.5846e-01 1.I8 HG13 = 1.284(D), Expected = 1.19, Std = 0.4100, ChiSquare = 8.1866e-01 1.I8 HG21 = 0.780(D), Expected = 0.77, Std = 0.2700, ChiSquare = 9.7046e-01 1.I8 HG22 = 0.780(D), Expected = 0.77, Std = 0.2700, ChiSquare = 9.7046e-01 1.I8 HG23 = 0.780(D), Expected = 0.77, Std = 0.2700, ChiSquare = 9.7046e-01 1.I8 HD11 = 0.705(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.3130e-01 1.I8 HD12 = 0.705(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.3130e-01 1.I8 HD13 = 0.705(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.3130e-01 1.I8 N = 123.181(D), Expected = 121.46, Std = 4.2800, ChiSquare = 6.8761e-01 1.Q9 CA = 54.852(D), Expected = 56.57, Std = 2.1400, ChiSquare = 4.2209e-01 1.Q9 CB = 29.651(D), Expected = 29.19, Std = 1.8200, ChiSquare = 8.0004e-01 1.Q9 CG = 33.791(D), Expected = 33.76, Std = 1.1100, ChiSquare = 9.7772e-01 1.Q9 H = 8.359(D), Expected = 8.22, Std = 0.5900, ChiSquare = 8.1375e-01 1.Q9 HA = 4.268(D), Expected = 4.27, Std = 0.4400, ChiSquare = 9.9637e-01 1.Q9 HB2 = 1.869(D), Expected = 2.05, Std = 0.2500, ChiSquare = 4.6907e-01 1.Q9 HB3 = 1.920(D), Expected = 2.02, Std = 0.2800, ChiSquare = 7.2098e-01 1.Q9 HG2 = 2.203(D), Expected = 2.32, Std = 0.2700, ChiSquare = 6.6477e-01 1.Q9 HG3 = 2.203(D), Expected = 2.29, Std = 0.2900, ChiSquare = 7.6418e-01 1.Q9 N = 126.943(D), Expected = 119.89, Std = 3.6000, ChiSquare = 5.0093e-02 1.I10 CA = 57.620(D), Expected = 61.61, Std = 2.6800, ChiSquare = 1.3654e-01 1.I10 CG1 = 27.022(D), Expected = 27.71, Std = 1.6800, ChiSquare = 6.8216e-01 1.I10 CG2 = 17.608(D), Expected = 17.53, Std = 1.3600, ChiSquare = 9.5426e-01 1.I10 CD1 = 11.710(D), Expected = 13.43, Std = 1.6700, ChiSquare = 3.0304e-01 1.I10 H = 8.517(D), Expected = 8.28, Std = 0.6800, ChiSquare = 7.2744e-01 1.I10 HA = 4.174(D), Expected = 4.18, Std = 0.5600, ChiSquare = 9.9145e-01 1.I10 HB = 1.925(D), Expected = 1.78, Std = 0.2900, ChiSquare = 6.1707e-01 1.I10 HG12 = 1.179(D), Expected = 1.28, Std = 0.4000, ChiSquare = 8.0065e-01 1.I10 HG13 = 1.477(D), Expected = 1.19, Std = 0.4100, ChiSquare = 4.8393e-01 1.I10 HG21 = 0.894(D), Expected = 0.77, Std = 0.2700, ChiSquare = 6.4605e-01 1.I10 HG22 = 0.894(D), Expected = 0.77, Std = 0.2700, ChiSquare = 6.4605e-01 1.I10 HG23 = 0.894(D), Expected = 0.77, Std = 0.2700, ChiSquare = 6.4605e-01 1.I10 HD11 = 0.722(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.8485e-01 1.I10 HD12 = 0.722(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.8485e-01 1.I10 HD13 = 0.722(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.8485e-01 1.I10 N = 125.692(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.2277e-01 1.G13 CA = 45.471(D), Expected = 45.35, Std = 1.3400, ChiSquare = 9.2805e-01 1.G13 H = 8.751(D), Expected = 8.33, Std = 0.6500, ChiSquare = 5.1718e-01 1.G13 HA2 = 3.940(D), Expected = 3.97, Std = 0.3700, ChiSquare = 9.3538e-01 1.G13 HA3 = 3.940(D), Expected = 3.90, Std = 0.3700, ChiSquare = 9.1391e-01 1.G13 N = 110.392(D), Expected = 109.67, Std = 3.8700, ChiSquare = 8.5200e-01 1.L14 CA = 58.672(D), Expected = 55.62, Std = 2.1300, ChiSquare = 1.5190e-01 1.L14 CB = 42.300(D), Expected = 42.31, Std = 1.8800, ChiSquare = 9.9576e-01 1.L14 CG = 27.597(D), Expected = 26.78, Std = 1.1000, ChiSquare = 4.5765e-01 1.L14 CD1 = 24.558(D), Expected = 24.72, Std = 1.5900, ChiSquare = 9.1885e-01 1.L14 CD2 = 26.364(D), Expected = 24.05, Std = 1.7000, ChiSquare = 1.7346e-01 1.L14 H = 7.546(D), Expected = 8.23, Std = 0.6500, ChiSquare = 2.9266e-01 1.L14 HA = 4.119(D), Expected = 4.32, Std = 0.4700, ChiSquare = 6.6890e-01 1.L14 HB2 = 1.462(D), Expected = 1.61, Std = 0.3400, ChiSquare = 6.6335e-01 1.L14 HB3 = 1.386(D), Expected = 1.52, Std = 0.3600, ChiSquare = 7.0973e-01 1.L14 HG = 1.575(D), Expected = 1.51, Std = 0.3300, ChiSquare = 8.4385e-01 1.L14 HD11 = 1.127(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.7816e-01 1.L14 HD12 = 1.127(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.7816e-01 1.L14 HD13 = 1.127(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.7816e-01 1.L14 HD21 = 0.987(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.7551e-01 1.L14 HD22 = 0.987(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.7551e-01 1.L14 HD23 = 0.987(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.7551e-01 1.L14 N = 122.193(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.3196e-01 1.T15 CA = 67.350(D), Expected = 62.22, Std = 2.5900, ChiSquare = 4.7626e-02 1.T15 CB = 68.035(D), Expected = 69.73, Std = 1.6300, ChiSquare = 2.9840e-01 1.T15 CG2 = 22.174(D), Expected = 21.55, Std = 1.1100, ChiSquare = 5.7401e-01 1.T15 H = 8.621(D), Expected = 8.24, Std = 0.6200, ChiSquare = 5.3887e-01 1.T15 HA = 3.650(D), Expected = 4.46, Std = 0.4800, ChiSquare = 9.1507e-02 1.T15 HB = 4.100(D), Expected = 4.17, Std = 0.3300, ChiSquare = 8.3201e-01 1.T15 HG21 = 1.192(D), Expected = 1.14, Std = 0.2300, ChiSquare = 8.2113e-01 1.T15 HG22 = 1.192(D), Expected = 1.14, Std = 0.2300, ChiSquare = 8.2113e-01 1.T15 HG23 = 1.192(D), Expected = 1.14, Std = 0.2300, ChiSquare = 8.2113e-01 1.T15 N = 114.575(D), Expected = 115.42, Std = 4.7500, ChiSquare = 8.5881e-01 1.E16 H = 8.937(D), Expected = 8.33, Std = 0.5900, ChiSquare = 3.0357e-01 1.E16 N = 121.469(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.1840e-01 1.L17 CA = 57.900(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.8443e-01 1.L17 CD2 = 22.802(D), Expected = 24.05, Std = 1.7000, ChiSquare = 4.6288e-01 1.L17 H = 7.913(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.2577e-01 1.L17 HA = 4.289(D), Expected = 4.32, Std = 0.4700, ChiSquare = 9.4741e-01 1.L17 HB2 = 1.630(D), Expected = 1.61, Std = 0.3400, ChiSquare = 9.5309e-01 1.L17 HB3 = 2.140(D), Expected = 1.52, Std = 0.3600, ChiSquare = 8.5029e-02 1.L17 HG = 1.931(D), Expected = 1.51, Std = 0.3300, ChiSquare = 2.0204e-01 1.L17 HD11 = 1.038(D), Expected = 0.75, Std = 0.2800, ChiSquare = 3.0368e-01 1.L17 HD12 = 1.038(D), Expected = 0.75, Std = 0.2800, ChiSquare = 3.0368e-01 1.L17 HD13 = 1.038(D), Expected = 0.75, Std = 0.2800, ChiSquare = 3.0368e-01 1.L17 HD21 = 0.995(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.6083e-01 1.L17 HD22 = 0.995(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.6083e-01 1.L17 HD23 = 0.995(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.6083e-01 1.L17 N = 121.877(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.9652e-01 1.L18 CA = 57.683(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.3277e-01 1.L18 CB = 42.150(D), Expected = 42.31, Std = 1.8800, ChiSquare = 9.3218e-01 1.L18 CG = 26.850(D), Expected = 26.78, Std = 1.1000, ChiSquare = 9.4926e-01 1.L18 CD1 = 24.376(D), Expected = 24.72, Std = 1.5900, ChiSquare = 8.2871e-01 1.L18 CD2 = 24.926(D), Expected = 24.05, Std = 1.7000, ChiSquare = 6.0635e-01 1.L18 H = 8.566(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.0521e-01 1.L18 HA = 3.899(D), Expected = 4.32, Std = 0.4700, ChiSquare = 3.7039e-01 1.L18 HB2 = 1.532(D), Expected = 1.61, Std = 0.3400, ChiSquare = 8.1855e-01 1.L18 HB3 = 1.531(D), Expected = 1.52, Std = 0.3600, ChiSquare = 9.7562e-01 1.L18 HG = 1.386(D), Expected = 1.51, Std = 0.3300, ChiSquare = 7.0710e-01 1.L18 HD11 = 0.768(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.4874e-01 1.L18 HD12 = 0.768(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.4874e-01 1.L18 HD13 = 0.768(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.4874e-01 1.L18 HD21 = 0.743(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.6424e-01 1.L18 HD22 = 0.743(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.6424e-01 1.L18 HD23 = 0.743(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.6424e-01 1.L18 N = 116.949(D), Expected = 121.86, Std = 3.9000, ChiSquare = 2.0795e-01 1.Q19 H = 9.088(D), Expected = 8.22, Std = 0.5900, ChiSquare = 1.4124e-01 1.Q19 HA = 4.664(D), Expected = 4.27, Std = 0.4400, ChiSquare = 3.7054e-01 1.Q19 HB2 = 1.791(D), Expected = 2.05, Std = 0.2500, ChiSquare = 3.0020e-01 1.Q19 HB3 = 1.791(D), Expected = 2.02, Std = 0.2800, ChiSquare = 4.1344e-01 1.Q19 HG2 = 2.379(D), Expected = 2.32, Std = 0.2700, ChiSquare = 8.2703e-01 1.Q19 HG3 = 2.379(D), Expected = 2.29, Std = 0.2900, ChiSquare = 7.5892e-01 1.Q19 N = 122.865(D), Expected = 119.89, Std = 3.6000, ChiSquare = 4.0858e-01 1.G20 HA2 = 4.121(D), Expected = 3.97, Std = 0.3700, ChiSquare = 6.8319e-01 1.G20 HA3 = 4.121(D), Expected = 3.90, Std = 0.3700, ChiSquare = 5.5031e-01 1.G20 N = 126.606(S), Expected = 109.67, Std = 3.8700, ChiSquare = 1.2075e-05 1.Y21 CA = 60.282(D), Expected = 58.13, Std = 2.5100, ChiSquare = 3.9124e-01 1.Y21 H = 6.991(D), Expected = 8.32, Std = 0.7300, ChiSquare = 6.8676e-02 1.Y21 HA = 3.633(D), Expected = 4.63, Std = 0.5600, ChiSquare = 7.5018e-02 1.T22 CA = 68.423(D), Expected = 62.22, Std = 2.5900, ChiSquare = 1.6621e-02 1.T22 CB = 67.435(D), Expected = 69.73, Std = 1.6300, ChiSquare = 1.5914e-01 1.T22 CG2 = 22.144(D), Expected = 21.55, Std = 1.1100, ChiSquare = 5.9256e-01 1.T22 H = 7.991(D), Expected = 8.24, Std = 0.6200, ChiSquare = 6.8797e-01 1.T22 HA = 3.266(D), Expected = 4.46, Std = 0.4800, ChiSquare = 1.2864e-02 1.T22 HB = 4.181(D), Expected = 4.17, Std = 0.3300, ChiSquare = 9.7341e-01 1.T22 HG21 = 0.995(D), Expected = 1.14, Std = 0.2300, ChiSquare = 5.2841e-01 1.T22 HG22 = 0.995(D), Expected = 1.14, Std = 0.2300, ChiSquare = 5.2841e-01 1.T22 HG23 = 0.995(D), Expected = 1.14, Std = 0.2300, ChiSquare = 5.2841e-01 1.T22 N = 115.834(D), Expected = 115.42, Std = 4.7500, ChiSquare = 9.3055e-01 1.V23 CA = 67.101(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.0691e-01 1.V23 CB = 31.485(D), Expected = 32.73, Std = 1.7900, ChiSquare = 4.8672e-01 1.V23 CG1 = 24.405(D), Expected = 21.49, Std = 1.3600, ChiSquare = 3.2082e-02 1.V23 CG2 = 21.313(D), Expected = 21.26, Std = 1.5600, ChiSquare = 9.7290e-01 1.V23 H = 8.558(D), Expected = 8.29, Std = 0.6700, ChiSquare = 6.8916e-01 1.V23 HA = 3.425(D), Expected = 4.19, Std = 0.5800, ChiSquare = 1.8718e-01 1.V23 HB = 2.126(D), Expected = 1.98, Std = 0.3200, ChiSquare = 6.4821e-01 1.V23 HG11 = 0.963(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.0897e-01 1.V23 HG12 = 0.963(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.0897e-01 1.V23 HG13 = 0.963(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.0897e-01 1.V23 HG21 = 0.938(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.2211e-01 1.V23 HG22 = 0.938(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.2211e-01 1.V23 HG23 = 0.938(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.2211e-01 1.V23 N = 120.852(D), Expected = 121.14, Std = 4.5400, ChiSquare = 9.4942e-01 1.E24 H = 6.949(D), Expected = 8.33, Std = 0.5900, ChiSquare = 1.9249e-02 1.E24 N = 118.265(D), Expected = 120.67, Std = 3.4800, ChiSquare = 4.8951e-01 1.V25 CA = 66.437(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.6756e-01 1.V25 CB = 30.900(D), Expected = 32.73, Std = 1.7900, ChiSquare = 3.0662e-01 1.V25 CG1 = 23.230(D), Expected = 21.49, Std = 1.3600, ChiSquare = 2.0075e-01 1.V25 CG2 = 23.444(D), Expected = 21.26, Std = 1.5600, ChiSquare = 1.6151e-01 1.V25 H = 8.063(D), Expected = 8.29, Std = 0.6700, ChiSquare = 7.3476e-01 1.V25 HA = 2.694(D), Expected = 4.19, Std = 0.5800, ChiSquare = 9.8998e-03 1.V25 HB = 1.910(D), Expected = 1.98, Std = 0.3200, ChiSquare = 8.2684e-01 1.V25 HG11 = 0.592(D), Expected = 0.83, Std = 0.2600, ChiSquare = 3.5999e-01 1.V25 HG12 = 0.592(D), Expected = 0.83, Std = 0.2600, ChiSquare = 3.5999e-01 1.V25 HG13 = 0.592(D), Expected = 0.83, Std = 0.2600, ChiSquare = 3.5999e-01 1.V25 HG21 = 0.228(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.1067e-02 1.V25 HG22 = 0.228(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.1067e-02 1.V25 HG23 = 0.228(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.1067e-02 1.V25 N = 120.521(D), Expected = 121.14, Std = 4.5400, ChiSquare = 8.9155e-01 1.L26 CA = 57.571(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.5969e-01 1.L26 CB = 41.080(D), Expected = 42.31, Std = 1.8800, ChiSquare = 5.1295e-01 1.L26 CG = 26.900(D), Expected = 26.78, Std = 1.1000, ChiSquare = 9.1313e-01 1.L26 CD1 = 22.874(D), Expected = 24.72, Std = 1.5900, ChiSquare = 2.4564e-01 1.L26 CD2 = 26.100(D), Expected = 24.05, Std = 1.7000, ChiSquare = 2.2786e-01 1.L26 H = 8.169(D), Expected = 8.23, Std = 0.6500, ChiSquare = 9.2523e-01 1.L26 HA = 3.861(D), Expected = 4.32, Std = 0.4700, ChiSquare = 3.2877e-01 1.L26 HB2 = 1.903(D), Expected = 1.61, Std = 0.3400, ChiSquare = 3.8882e-01 1.L26 HB3 = 1.212(D), Expected = 1.52, Std = 0.3600, ChiSquare = 3.9224e-01 1.L26 HG = 1.939(D), Expected = 1.51, Std = 0.3300, ChiSquare = 1.9360e-01 1.L26 HD11 = 0.703(D), Expected = 0.75, Std = 0.2800, ChiSquare = 8.6670e-01 1.L26 HD12 = 0.703(D), Expected = 0.75, Std = 0.2800, ChiSquare = 8.6670e-01 1.L26 HD13 = 0.703(D), Expected = 0.75, Std = 0.2800, ChiSquare = 8.6670e-01 1.L26 HD21 = 0.653(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.9061e-01 1.L26 HD22 = 0.653(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.9061e-01 1.L26 HD23 = 0.653(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.9061e-01 1.L26 N = 118.175(D), Expected = 121.86, Std = 3.9000, ChiSquare = 3.4472e-01 1.R27 CA = 59.355(D), Expected = 56.77, Std = 2.3100, ChiSquare = 2.6312e-01 1.R27 CB = 27.472(D), Expected = 30.70, Std = 1.8300, ChiSquare = 7.7743e-02 1.R27 CG = 27.470(D), Expected = 27.21, Std = 1.2000, ChiSquare = 8.2847e-01 1.R27 CD = 43.573(D), Expected = 43.16, Std = 0.8800, ChiSquare = 6.3884e-01 1.R27 H = 8.184(D), Expected = 8.24, Std = 0.6100, ChiSquare = 9.2685e-01 1.R27 HA = 3.941(D), Expected = 4.30, Std = 0.4600, ChiSquare = 4.3514e-01 1.R27 HB2 = 1.671(D), Expected = 1.79, Std = 0.2700, ChiSquare = 6.5940e-01 1.R27 HB3 = 1.671(D), Expected = 1.76, Std = 0.2800, ChiSquare = 7.5059e-01 1.R27 HG2 = 1.503(D), Expected = 1.57, Std = 0.2700, ChiSquare = 8.0402e-01 1.R27 HG3 = 1.503(D), Expected = 1.54, Std = 0.2900, ChiSquare = 8.9848e-01 1.R27 HD2 = 3.060(D), Expected = 3.12, Std = 0.2400, ChiSquare = 8.0259e-01 1.R27 HD3 = 3.060(D), Expected = 3.10, Std = 0.2600, ChiSquare = 8.7773e-01 1.R27 N = 116.756(D), Expected = 120.80, Std = 3.6800, ChiSquare = 2.7181e-01 1.Q28 CA = 58.006(D), Expected = 56.57, Std = 2.1400, ChiSquare = 5.0220e-01 1.Q28 CB = 29.421(D), Expected = 29.19, Std = 1.8200, ChiSquare = 8.9900e-01 1.Q28 CG = 36.589(D), Expected = 33.76, Std = 1.1100, ChiSquare = 1.0814e-02 1.Q28 H = 8.523(D), Expected = 8.22, Std = 0.5900, ChiSquare = 6.0756e-01 1.Q28 HA = 4.059(D), Expected = 4.27, Std = 0.4400, ChiSquare = 6.3155e-01 1.Q28 HB2 = 2.058(D), Expected = 2.05, Std = 0.2500, ChiSquare = 9.7447e-01 1.Q28 HB3 = 2.012(D), Expected = 2.02, Std = 0.2800, ChiSquare = 9.7721e-01 1.Q28 HG2 = 2.411(D), Expected = 2.32, Std = 0.2700, ChiSquare = 7.3609e-01 1.Q28 HG3 = 2.305(D), Expected = 2.29, Std = 0.2900, ChiSquare = 9.5875e-01 1.Q28 N = 115.153(D), Expected = 119.89, Std = 3.6000, ChiSquare = 1.8823e-01 1.Q29 H = 9.215(D), Expected = 8.22, Std = 0.5900, ChiSquare = 9.1711e-02 1.Q29 N = 123.678(D), Expected = 119.89, Std = 3.6000, ChiSquare = 2.9270e-01 1.P30 CA = 60.722(D), Expected = 63.33, Std = 1.5200, ChiSquare = 8.6201e-02 1.P30 HA = 4.531(D), Expected = 4.40, Std = 0.3300, ChiSquare = 6.9139e-01 1.P31 CA = 63.988(D), Expected = 63.33, Std = 1.5200, ChiSquare = 6.6509e-01 1.P31 CB = 35.611(D), Expected = 31.85, Std = 1.1800, ChiSquare = 1.4361e-03 1.P31 CD = 50.573(D), Expected = 50.32, Std = 0.9900, ChiSquare = 7.9829e-01 1.P31 HA = 4.338(D), Expected = 4.40, Std = 0.3300, ChiSquare = 8.5097e-01 1.P31 HB2 = 2.321(D), Expected = 2.08, Std = 0.3500, ChiSquare = 4.9109e-01 1.P31 HB3 = 2.248(D), Expected = 2.00, Std = 0.3600, ChiSquare = 4.9089e-01 1.P31 HG2 = 1.981(D), Expected = 1.93, Std = 0.3100, ChiSquare = 8.6932e-01 1.P31 HG3 = 1.981(D), Expected = 1.90, Std = 0.3300, ChiSquare = 8.0610e-01 1.P31 HD2 = 3.802(D), Expected = 3.65, Std = 0.3500, ChiSquare = 6.6408e-01 1.P31 HD3 = 3.733(D), Expected = 3.61, Std = 0.3900, ChiSquare = 7.5247e-01 1.D32 CA = 52.460(D), Expected = 54.69, Std = 2.0300, ChiSquare = 2.7198e-01 1.D32 CB = 42.882(D), Expected = 40.88, Std = 1.6200, ChiSquare = 2.1653e-01 1.D32 H = 7.530(D), Expected = 8.31, Std = 0.5800, ChiSquare = 1.7868e-01 1.D32 HA = 4.952(D), Expected = 4.59, Std = 0.3200, ChiSquare = 2.5795e-01 1.D32 HB2 = 2.898(D), Expected = 2.72, Std = 0.2600, ChiSquare = 4.9359e-01 1.D32 HB3 = 2.467(D), Expected = 2.66, Std = 0.2800, ChiSquare = 4.9064e-01 1.D32 N = 116.066(D), Expected = 120.65, Std = 3.8600, ChiSquare = 2.3500e-01 1.L33 CA = 59.573(D), Expected = 55.62, Std = 2.1300, ChiSquare = 6.3472e-02 1.L33 CB = 42.275(D), Expected = 42.31, Std = 1.8800, ChiSquare = 9.8515e-01 1.L33 CG = 26.910(D), Expected = 26.78, Std = 1.1000, ChiSquare = 9.0592e-01 1.L33 CD1 = 25.807(D), Expected = 24.72, Std = 1.5900, ChiSquare = 4.9420e-01 1.L33 CD2 = 23.827(D), Expected = 24.05, Std = 1.7000, ChiSquare = 8.9564e-01 1.L33 H = 9.074(D), Expected = 8.23, Std = 0.6500, ChiSquare = 1.9413e-01 1.L33 HA = 3.835(D), Expected = 4.32, Std = 0.4700, ChiSquare = 3.0211e-01 1.L33 HB2 = 1.821(D), Expected = 1.61, Std = 0.3400, ChiSquare = 5.3487e-01 1.L33 HB3 = 1.550(D), Expected = 1.52, Std = 0.3600, ChiSquare = 9.3359e-01 1.L33 HG = 1.876(D), Expected = 1.51, Std = 0.3300, ChiSquare = 2.6739e-01 1.L33 HD11 = 0.838(D), Expected = 0.75, Std = 0.2800, ChiSquare = 7.5330e-01 1.L33 HD12 = 0.838(D), Expected = 0.75, Std = 0.2800, ChiSquare = 7.5330e-01 1.L33 HD13 = 0.838(D), Expected = 0.75, Std = 0.2800, ChiSquare = 7.5330e-01 1.L33 HD21 = 0.755(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.3130e-01 1.L33 HD22 = 0.755(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.3130e-01 1.L33 HD23 = 0.755(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.3130e-01 1.L33 N = 125.925(D), Expected = 121.86, Std = 3.9000, ChiSquare = 2.9727e-01 1.V34 CA = 67.000(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.1481e-01 1.V34 CB = 31.806(D), Expected = 32.73, Std = 1.7900, ChiSquare = 6.0571e-01 1.V34 CG1 = 24.035(D), Expected = 21.49, Std = 1.3600, ChiSquare = 6.1300e-02 1.V34 CG2 = 22.737(D), Expected = 21.26, Std = 1.5600, ChiSquare = 3.4374e-01 1.V34 H = 8.165(D), Expected = 8.29, Std = 0.6700, ChiSquare = 8.5200e-01 1.V34 HA = 3.621(D), Expected = 4.19, Std = 0.5800, ChiSquare = 3.2658e-01 1.V34 HB = 2.312(D), Expected = 1.98, Std = 0.3200, ChiSquare = 2.9950e-01 1.V34 HG11 = 1.147(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.2276e-01 1.V34 HG12 = 1.147(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.2276e-01 1.V34 HG13 = 1.147(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.2276e-01 1.V34 HG21 = 0.989(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.9968e-01 1.V34 HG22 = 0.989(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.9968e-01 1.V34 HG23 = 0.989(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.9968e-01 1.V34 N = 121.227(D), Expected = 121.14, Std = 4.5400, ChiSquare = 9.8471e-01 1.E35 CA = 59.428(D), Expected = 57.32, Std = 2.0900, ChiSquare = 3.1316e-01 1.E35 H = 8.237(D), Expected = 8.33, Std = 0.5900, ChiSquare = 8.7475e-01 1.E35 HA = 3.921(D), Expected = 4.25, Std = 0.4100, ChiSquare = 4.2230e-01 1.E35 N = 120.804(D), Expected = 120.67, Std = 3.4800, ChiSquare = 9.6928e-01 1.F36 CA = 61.500(D), Expected = 58.08, Std = 2.5700, ChiSquare = 1.8327e-01 1.F36 CB = 39.833(D), Expected = 39.99, Std = 2.0900, ChiSquare = 9.4012e-01 1.F36 H = 8.012(D), Expected = 8.36, Std = 0.7200, ChiSquare = 6.2886e-01 1.F36 HA = 4.356(D), Expected = 4.63, Std = 0.5700, ChiSquare = 6.3073e-01 1.F36 HB2 = 3.231(D), Expected = 3.00, Std = 0.3700, ChiSquare = 5.3241e-01 1.F36 HB3 = 2.794(D), Expected = 2.93, Std = 0.4000, ChiSquare = 7.3386e-01 1.F36 N = 116.846(D), Expected = 120.45, Std = 4.1800, ChiSquare = 3.8858e-01 1.A37 CA = 55.684(D), Expected = 53.14, Std = 1.9800, ChiSquare = 1.9885e-01 1.A37 CB = 16.310(D), Expected = 19.01, Std = 1.8300, ChiSquare = 1.4010e-01 1.A37 H = 7.954(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.8181e-01 1.A37 HA = 3.733(D), Expected = 4.26, Std = 0.4400, ChiSquare = 2.3102e-01 1.A37 HB1 = 0.611(D), Expected = 1.35, Std = 0.2600, ChiSquare = 4.4788e-03 1.A37 HB2 = 0.611(D), Expected = 1.35, Std = 0.2600, ChiSquare = 4.4788e-03 1.A37 HB3 = 0.611(D), Expected = 1.35, Std = 0.2600, ChiSquare = 4.4788e-03 1.A37 N = 120.724(D), Expected = 123.23, Std = 3.5400, ChiSquare = 4.7900e-01 1.V38 CA = 68.531(D), Expected = 62.49, Std = 2.8600, ChiSquare = 3.4666e-02 1.V38 CB = 32.965(D), Expected = 32.73, Std = 1.7900, ChiSquare = 8.9555e-01 1.V38 CG1 = 20.870(D), Expected = 21.49, Std = 1.3600, ChiSquare = 6.4847e-01 1.V38 CG2 = 21.690(D), Expected = 21.26, Std = 1.5600, ChiSquare = 7.8282e-01 1.V38 H = 8.202(D), Expected = 8.29, Std = 0.6700, ChiSquare = 8.9550e-01 1.V38 HA = 3.366(D), Expected = 4.19, Std = 0.5800, ChiSquare = 1.5541e-01 1.V38 HB = 2.184(D), Expected = 1.98, Std = 0.3200, ChiSquare = 5.2380e-01 1.V38 HG11 = 0.951(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.4166e-01 1.V38 HG12 = 0.951(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.4166e-01 1.V38 HG13 = 0.951(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.4166e-01 1.V38 HG21 = 0.880(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.7510e-01 1.V38 HG22 = 0.880(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.7510e-01 1.V38 HG23 = 0.880(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.7510e-01 1.V38 N = 117.592(D), Expected = 121.14, Std = 4.5400, ChiSquare = 4.3451e-01 1.E39 CA = 59.703(D), Expected = 57.32, Std = 2.0900, ChiSquare = 2.5421e-01 1.E39 CB = 29.589(D), Expected = 30.01, Std = 1.7200, ChiSquare = 8.0664e-01 1.E39 CG = 35.919(D), Expected = 36.11, Std = 1.1900, ChiSquare = 8.7248e-01 1.E39 H = 7.830(D), Expected = 8.33, Std = 0.5900, ChiSquare = 3.9674e-01 1.E39 HA = 3.876(D), Expected = 4.25, Std = 0.4100, ChiSquare = 3.6167e-01 1.E39 HB2 = 2.073(D), Expected = 2.02, Std = 0.2100, ChiSquare = 8.0075e-01 1.E39 HB3 = 1.999(D), Expected = 1.99, Std = 0.2300, ChiSquare = 9.6879e-01 1.E39 HG2 = 2.281(D), Expected = 2.27, Std = 0.2100, ChiSquare = 9.5823e-01 1.E39 HG3 = 2.281(D), Expected = 2.25, Std = 0.2200, ChiSquare = 8.8794e-01 1.E39 N = 121.474(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.1729e-01 1.Y40 CA = 61.995(D), Expected = 58.13, Std = 2.5100, ChiSquare = 1.2360e-01 1.Y40 CB = 38.950(D), Expected = 39.32, Std = 2.1600, ChiSquare = 8.6399e-01 1.Y40 H = 8.939(D), Expected = 8.32, Std = 0.7300, ChiSquare = 3.9647e-01 1.Y40 HA = 3.539(D), Expected = 4.63, Std = 0.5600, ChiSquare = 5.1389e-02 1.Y40 HB2 = 2.272(D), Expected = 2.91, Std = 0.3700, ChiSquare = 8.4649e-02 1.Y40 HB3 = 2.173(D), Expected = 2.84, Std = 0.3900, ChiSquare = 8.7219e-02 1.Y40 N = 120.686(D), Expected = 120.52, Std = 4.2000, ChiSquare = 9.6847e-01 1.F41 CA = 62.791(D), Expected = 58.08, Std = 2.5700, ChiSquare = 6.6792e-02 1.F41 CB = 38.033(D), Expected = 39.99, Std = 2.0900, ChiSquare = 3.4909e-01 1.F41 H = 8.737(D), Expected = 8.36, Std = 0.7200, ChiSquare = 6.0055e-01 1.F41 HA = 4.113(D), Expected = 4.63, Std = 0.5700, ChiSquare = 3.6440e-01 1.F41 HB2 = 3.150(D), Expected = 3.00, Std = 0.3700, ChiSquare = 6.8518e-01 1.F41 HB3 = 2.742(D), Expected = 2.93, Std = 0.4000, ChiSquare = 6.3835e-01 1.F41 N = 115.524(D), Expected = 120.45, Std = 4.1800, ChiSquare = 2.3861e-01 1.T42 CA = 67.893(D), Expected = 62.22, Std = 2.5900, ChiSquare = 2.8499e-02 1.T42 CB = 68.166(D), Expected = 69.73, Std = 1.6300, ChiSquare = 3.3730e-01 1.T42 CG2 = 21.288(D), Expected = 21.55, Std = 1.1100, ChiSquare = 8.1340e-01 1.T42 H = 8.016(D), Expected = 8.24, Std = 0.6200, ChiSquare = 7.1788e-01 1.T42 HA = 3.727(D), Expected = 4.46, Std = 0.4800, ChiSquare = 1.2674e-01 1.T42 HB = 4.240(D), Expected = 4.17, Std = 0.3300, ChiSquare = 8.3201e-01 1.T42 HG21 = 1.175(D), Expected = 1.14, Std = 0.2300, ChiSquare = 8.7905e-01 1.T42 HG22 = 1.175(D), Expected = 1.14, Std = 0.2300, ChiSquare = 8.7905e-01 1.T42 HG23 = 1.175(D), Expected = 1.14, Std = 0.2300, ChiSquare = 8.7905e-01 1.T42 N = 117.076(D), Expected = 115.42, Std = 4.7500, ChiSquare = 7.2737e-01 1.R43 H = 7.859(D), Expected = 8.24, Std = 0.6100, ChiSquare = 5.3224e-01 1.R43 N = 121.893(D), Expected = 120.80, Std = 3.6800, ChiSquare = 7.6646e-01 1.L44 CA = 57.962(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.7154e-01 1.L44 CB = 42.680(D), Expected = 42.31, Std = 1.8800, ChiSquare = 8.4398e-01 1.L44 CG = 27.079(D), Expected = 26.78, Std = 1.1000, ChiSquare = 7.8576e-01 1.L44 CD1 = 26.205(D), Expected = 24.72, Std = 1.5900, ChiSquare = 3.5032e-01 1.L44 CD2 = 26.625(D), Expected = 24.05, Std = 1.7000, ChiSquare = 1.2985e-01 1.L44 H = 7.430(D), Expected = 8.23, Std = 0.6500, ChiSquare = 2.1841e-01 1.L44 HA = 4.309(D), Expected = 4.32, Std = 0.4700, ChiSquare = 9.8133e-01 1.L44 HB2 = 2.072(D), Expected = 1.61, Std = 0.3400, ChiSquare = 1.7420e-01 1.L44 HB3 = 2.000(D), Expected = 1.52, Std = 0.3600, ChiSquare = 1.8242e-01 1.L44 HG = 1.863(D), Expected = 1.51, Std = 0.3300, ChiSquare = 2.8476e-01 1.L44 HD11 = 1.109(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.9979e-01 1.L44 HD12 = 1.109(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.9979e-01 1.L44 HD13 = 1.109(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.9979e-01 1.L44 HD21 = 0.986(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.7737e-01 1.L44 HD22 = 0.986(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.7737e-01 1.L44 HD23 = 0.986(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.7737e-01 1.L44 N = 119.704(D), Expected = 121.86, Std = 3.9000, ChiSquare = 5.8039e-01 1.R45 H = 7.935(D), Expected = 8.24, Std = 0.6100, ChiSquare = 6.1707e-01 1.R45 N = 119.789(D), Expected = 120.80, Std = 3.6800, ChiSquare = 7.8352e-01 1.E46 CA = 57.830(D), Expected = 57.32, Std = 2.0900, ChiSquare = 8.0722e-01 1.E46 CB = 29.481(D), Expected = 30.01, Std = 1.7200, ChiSquare = 7.5842e-01 1.E46 CG = 36.441(D), Expected = 36.11, Std = 1.1900, ChiSquare = 7.8090e-01 1.E46 H = 7.998(D), Expected = 8.33, Std = 0.5900, ChiSquare = 5.7363e-01 1.E46 HA = 4.191(D), Expected = 4.25, Std = 0.4100, ChiSquare = 8.8558e-01 1.E46 HB2 = 2.176(D), Expected = 2.02, Std = 0.2100, ChiSquare = 4.5757e-01 1.E46 HB3 = 1.942(D), Expected = 1.99, Std = 0.2300, ChiSquare = 8.3469e-01 1.E46 HG2 = 2.525(D), Expected = 2.27, Std = 0.2100, ChiSquare = 2.2464e-01 1.E46 HG3 = 2.525(D), Expected = 2.25, Std = 0.2200, ChiSquare = 2.1130e-01 1.E46 N = 117.902(D), Expected = 120.67, Std = 3.4800, ChiSquare = 4.2638e-01 1.A47 CA = 53.011(D), Expected = 53.14, Std = 1.9800, ChiSquare = 9.4805e-01 1.A47 CB = 18.693(D), Expected = 19.01, Std = 1.8300, ChiSquare = 8.6248e-01 1.A47 H = 7.689(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.9440e-01 1.A47 HA = 4.235(D), Expected = 4.26, Std = 0.4400, ChiSquare = 9.5469e-01 1.A47 HB1 = 1.420(D), Expected = 1.35, Std = 0.2600, ChiSquare = 7.8775e-01 1.A47 HB2 = 1.420(D), Expected = 1.35, Std = 0.2600, ChiSquare = 7.8775e-01 1.A47 HB3 = 1.420(D), Expected = 1.35, Std = 0.2600, ChiSquare = 7.8775e-01 1.A47 N = 120.880(D), Expected = 123.23, Std = 3.5400, ChiSquare = 5.0679e-01 1.R48 CA = 56.520(D), Expected = 56.77, Std = 2.3100, ChiSquare = 9.1382e-01 1.R48 CB = 30.924(D), Expected = 30.70, Std = 1.8300, ChiSquare = 9.0258e-01 1.R48 CG = 26.817(D), Expected = 27.21, Std = 1.2000, ChiSquare = 7.4329e-01 1.R48 CD = 44.044(D), Expected = 43.16, Std = 0.8800, ChiSquare = 3.1512e-01 1.R48 H = 7.470(D), Expected = 8.24, Std = 0.6100, ChiSquare = 2.0684e-01 1.R48 HA = 4.240(D), Expected = 4.30, Std = 0.4600, ChiSquare = 8.9622e-01 1.R48 HB2 = 1.929(D), Expected = 1.79, Std = 0.2700, ChiSquare = 6.0668e-01 1.R48 HB3 = 1.824(D), Expected = 1.76, Std = 0.2800, ChiSquare = 8.1920e-01 1.R48 HG2 = 1.808(D), Expected = 1.57, Std = 0.2700, ChiSquare = 3.7806e-01 1.R48 HG3 = 1.728(D), Expected = 1.54, Std = 0.2900, ChiSquare = 5.1681e-01 1.R48 HD2 = 3.190(D), Expected = 3.12, Std = 0.2400, ChiSquare = 7.7054e-01 1.R48 HD3 = 3.190(D), Expected = 3.10, Std = 0.2600, ChiSquare = 7.2923e-01 1.R48 N = 117.602(D), Expected = 120.80, Std = 3.6800, ChiSquare = 3.8484e-01 1.A49 CA = 50.677(D), Expected = 53.14, Std = 1.9800, ChiSquare = 2.1352e-01 1.A49 CB = 18.104(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.2054e-01 1.A49 H = 7.937(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.6114e-01 1.A49 HA = 4.572(D), Expected = 4.26, Std = 0.4400, ChiSquare = 4.7827e-01 1.A49 HB1 = 1.367(D), Expected = 1.35, Std = 0.2600, ChiSquare = 9.4787e-01 1.A49 HB2 = 1.367(D), Expected = 1.35, Std = 0.2600, ChiSquare = 9.4787e-01 1.A49 HB3 = 1.367(D), Expected = 1.35, Std = 0.2600, ChiSquare = 9.4787e-01 1.A49 N = 125.709(D), Expected = 123.23, Std = 3.5400, ChiSquare = 4.8375e-01 1.P50 CA = 63.095(D), Expected = 63.33, Std = 1.5200, ChiSquare = 8.7713e-01 1.P50 CB = 32.027(D), Expected = 31.85, Std = 1.1800, ChiSquare = 8.8076e-01 1.P50 CG = 27.479(D), Expected = 27.17, Std = 1.0900, ChiSquare = 7.7680e-01 1.P50 CD = 50.437(D), Expected = 50.32, Std = 0.9900, ChiSquare = 9.0592e-01 1.P50 HA = 4.412(D), Expected = 4.40, Std = 0.3300, ChiSquare = 9.7099e-01 1.P50 HB2 = 2.297(D), Expected = 2.08, Std = 0.3500, ChiSquare = 5.3526e-01 1.P50 HB3 = 1.944(D), Expected = 2.00, Std = 0.3600, ChiSquare = 8.7638e-01 1.P50 HG2 = 2.025(D), Expected = 1.93, Std = 0.3100, ChiSquare = 7.5926e-01 1.P50 HG3 = 2.018(D), Expected = 1.90, Std = 0.3300, ChiSquare = 7.2066e-01 1.P50 HD2 = 3.786(D), Expected = 3.65, Std = 0.3500, ChiSquare = 6.9759e-01 1.P50 HD3 = 3.622(D), Expected = 3.61, Std = 0.3900, ChiSquare = 9.7545e-01 1.A51 CA = 52.531(D), Expected = 53.14, Std = 1.9800, ChiSquare = 7.5840e-01 1.A51 CB = 19.367(D), Expected = 19.01, Std = 1.8300, ChiSquare = 8.4533e-01 1.A51 H = 8.425(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.0766e-01 1.A51 HA = 4.347(D), Expected = 4.26, Std = 0.4400, ChiSquare = 8.4326e-01 1.A51 HB1 = 1.399(D), Expected = 1.35, Std = 0.2600, ChiSquare = 8.5051e-01 1.A51 HB2 = 1.399(D), Expected = 1.35, Std = 0.2600, ChiSquare = 8.5051e-01 1.A51 HB3 = 1.399(D), Expected = 1.35, Std = 0.2600, ChiSquare = 8.5051e-01 1.A51 N = 125.078(D), Expected = 123.23, Std = 3.5400, ChiSquare = 6.0165e-01 1.S52 CA = 59.828(D), Expected = 58.72, Std = 2.0700, ChiSquare = 5.9247e-01 1.S52 CB = 64.951(D), Expected = 63.80, Std = 1.4800, ChiSquare = 4.3674e-01 1.S52 H = 7.879(D), Expected = 8.28, Std = 0.5900, ChiSquare = 4.9672e-01 1.S52 HA = 4.227(D), Expected = 4.48, Std = 0.4000, ChiSquare = 5.2706e-01 1.S52 HB2 = 3.822(D), Expected = 3.88, Std = 0.2500, ChiSquare = 8.1654e-01 1.S52 HB3 = 3.822(D), Expected = 3.85, Std = 0.2700, ChiSquare = 9.1740e-01 1.S52 N = 120.645(D), Expected = 116.28, Std = 3.5200, ChiSquare = 2.1495e-01