M1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable K2 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> K 0.91 M 0.07 C Shift Assignments>> C :: 175.74(D) CA :: 55.51(D) CB :: 34.54(D) CG :: 24.78(D) CD :: 29.52(D) Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> HA :: 4.14(D) HB2 :: 1.41(D) HB3 :: 1.61(D) HG2 :: 1.41(D) HG3 :: 1.51(D) HD2 :: 1.74(D) HD3 :: 1.74(D) HE2 :: 3.01(D) HE3 :: 3.01(D) Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) Q3 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.31 K 0.22 Q 0.16 R 0.11 W 0.09 E 0.05 V 0.01 C Shift Assignments>> C :: 173.53(D) CA :: 54.26(D) CG :: 32.76(D) Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 9.10(D) HA :: 4.70(D) HB2 :: 1.53(D) HB3 :: 1.53(D) HG2 :: 1.80(D) HG3 :: 1.96(D) HE21 :: 6.81(D) HE22 :: 7.34(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 120.19(D) NE2 :: 110.67(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) R4 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.68 G 0.18 K 0.12 C Shift Assignments>> C :: 176.44(D) CA :: 55.63(D) CB :: 30.98(D) CG :: 27.33(D) CD :: 43.72(D) Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.69(D) HA :: 5.08(D) HB2 :: 1.73(D) HB3 :: 1.61(D) HG2 :: 1.56(D) HG3 :: 1.56(D) HD2 :: 3.15(D) HD3 :: 3.15(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 124.82(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) I5 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.95 G 0.03 A 0.01 C Shift Assignments>> C :: 173.94(D) CA :: 59.26(D) CB :: 41.97(D) CG1 :: 26.24(D) CG2 :: 17.05(D) CD1 :: 14.88(D) Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 9.01(D) HA :: 4.78(D) HB :: 1.75(D) HG2 :: 0.25(D) HG12 :: 0.85(D) HG13 :: 1.19(D) HD1 :: 0.54(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 119.88(D) Ave N Shift Values>> N :: 121.6(4.72) T6 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 174.55(D) CA :: 60.79(D) CB :: 69.51(D) CG2 :: 21.90(D) Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.31(D) HA :: 5.47(D) HB :: 3.91(D) HG2 :: 1.14(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 116.80(D) Ave N Shift Values>> N :: 115.7(5.05) V7 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.59 I 0.3 A 0.1 C Shift Assignments>> C :: 173.61(D) CA :: 58.97(D) CB :: 36.43(D) CG1 :: 19.07(D) CG2 :: 21.87(D) Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.90(D) HA :: 4.93(D) HB :: 2.33(D) HG1 :: 0.64(D) HG2 :: 0.84(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 119.27(D) Ave N Shift Values>> N :: 121.02(4.96) T8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 HN Overlap>> L39 N48 N69 C Shift Assignments>> C :: 174.47(D) CA :: 62.09(D) CB :: 69.47(D) CG2 :: 22.59(D) Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.38(D) HA :: 4.93(D) HB :: 3.99(D) HG2 :: 1.13(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 119.27(D) Ave N Shift Values>> N :: 115.7(5.05) V9 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.55 I 0.26 A 0.18 C Shift Assignments>> C :: 179.13(D) CA :: 58.29(D) CB :: 36.05(D) CG1 :: 19.68(D) CG2 :: 22.96(D) Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.91(D) HA :: 4.70(D) HB :: 2.08(D) HG1 :: 0.78(D) HG2 :: 0.87(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 117.42(D) Ave N Shift Values>> N :: 121.02(4.96) D10 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.5 F 0.27 Y 0.18 K 0.02 C Shift Assignments>> C :: 176.22(D) CA :: 62.33(M) CB :: 40.76(D) Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.16(D) HA :: 4.37(D) HB2 :: 2.76(D) HB3 :: 2.87(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 115.55(D) Ave N Shift Values>> N :: 120.73(4.2) S11 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.86 S 0.13 C Shift Assignments>> C :: 174.32(D) CA :: 58.29(D) CB :: 67.88(D) Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.50(D) HA :: 4.46(D) HB2 :: 3.92(D) HB3 :: 3.98(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 121.10(D) Ave N Shift Values>> N :: 116.3(3.95) D12 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.33 R 0.27 D 0.13 K 0.11 F 0.05 G 0.04 Y 0.04 N 0.01 C Shift Assignments>> C :: 176.55(D) CA :: 55.02(D) CB :: 43.09(D) Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 7.91(D) HB2 :: 2.72(D) HB3 :: 2.77(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 119.88(D) Ave N Shift Values>> N :: 120.73(4.2) S13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 175.25(D) CA :: 62.29(D) CB :: 63.16(D) Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 9.07(D) HA :: 4.23(D) HB2 :: 3.90(D) HB3 :: 3.98(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 122.97(D) Ave N Shift Values>> N :: 116.3(3.95) Y14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.99 C Shift Assignments>> C :: 176.03(D) CA :: 61.60(D) CB :: 39.03(D) CD1 :: 132.61(D) CD2 :: 132.61(D) CE1 :: 118.40(D) CE2 :: 118.40(D) Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 7.80(D) HA :: 4.14(D) HB2 :: 3.07(D) HB3 :: 3.14(D) HD1 :: 7.00(D) HD2 :: 7.00(D) HE1 :: 6.83(D) HE2 :: 6.83(D) Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 121.73(D) Ave N Shift Values>> N :: 120.79(4.69) Q15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.32 K 0.31 E 0.19 R 0.08 I 0.06 M 0.02 C Shift Assignments>> C :: 179.13(D) CA :: 58.66(D) CB :: 28.11(D) CG :: 34.25(D) Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.57(D) HA :: 3.70(D) HB2 :: 2.17(D) HB3 :: 2.21(D) HG2 :: 2.61(D) HG3 :: 2.76(D) HE21 :: 6.98(D) HE22 :: 7.58(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 115.26(D) NE2 :: 111.46(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) L16 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.64 R 0.3 K 0.02 G 0.01 C Shift Assignments>> C :: 178.10(D) CA :: 58.22(D) CB :: 42.09(D) CG :: 28.06(D) CD1 :: 25.51(D) CD2 :: 24.78(D) Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.64(D) HA :: 4.15(D) HB2 :: 1.79(D) HB3 :: 1.85(D) HG :: 1.69(D) HD1 :: 0.93(D) HD2 :: 0.95(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 121.73(D) Ave N Shift Values>> N :: 121.98(4.07) L17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.72 K 0.24 G 0.02 C Shift Assignments>> C :: 179.68(D) CA :: 58.23(D) CB :: 41.90(D) CD1 :: 23.33(D) CD2 :: 25.88(D) Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.92(D) HA :: 3.91(D) HB2 :: 1.27(D) HB3 :: 1.96(D) HD1 :: 0.88(D) HD2 :: 1.02(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 117.42(D) Ave N Shift Values>> N :: 121.98(4.07) K18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.6 R 0.36 M 0.02 C Shift Assignments>> C :: 178.43(D) CA :: 59.54(D) CB :: 30.54(D) CG :: 24.44(D) CD :: 28.79(D) CE :: 41.54(D) Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.24(D) HA :: 4.11(D) HB2 :: 1.87(D) HB3 :: 1.97(D) HG2 :: 1.21(D) HG3 :: 1.21(D) HD2 :: 1.53(D) HD3 :: 1.53(D) HE2 :: 2.88(D) HE3 :: 3.01(D) Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 118.96(D) Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) A19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.52 A 0.44 I 0.02 C Shift Assignments>> C :: 179.83(D) CA :: 54.79(D) CB :: 18.22(D) Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.76(D) HA :: 4.30(D) HB :: 1.61(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 120.81(D) Ave N Shift Values>> N :: 123.23(3.7) Y20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.99 C Shift Assignments>> CA :: 58.22(D) CB :: 39.16(D) CD1 :: 132.59(D) CD2 :: 132.59(D) CE1 :: 117.86(D) CE2 :: 117.86(D) Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 8.07(D) HA :: 4.20(D) HD1 :: 7.23(D) HD2 :: 7.23(D) HE1 :: 6.77(D) HE2 :: 6.77(D) Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 117.73(D) Ave N Shift Values>> N :: 120.79(4.69) D21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.23 Y 0.2 F 0.19 N 0.19 L 0.09 I 0.02 E 0.01 K 0.01 HN Overlap>> M61 N62 C Shift Assignments>> C :: 175.27(D) CA :: 55.38(D) CB :: 39.43(D) Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.16(D) HA :: 4.48(D) HB2 :: 2.63(D) HB3 :: 3.18(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 118.03(D) Ave N Shift Values>> N :: 120.73(4.2) V22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> C :: 176.16(D) CA :: 63.03(D) CB :: 32.80(D) CG1 :: 21.14(D) CG2 :: 23.33(D) Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.85(D) HA :: 3.86(D) HB :: 1.84(D) HG1 :: 0.90(D) HG2 :: 1.13(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 118.96(D) Ave N Shift Values>> N :: 121.02(4.96) N23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.66 Y 0.07 E 0.06 D 0.06 M 0.05 F 0.04 K 0.01 C Shift Assignments>> C :: 175.60(D) CA :: 52.41(D) CB :: 37.05(D) Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.77(D) HA :: 4.83(D) HB2 :: 2.98(D) HB3 :: 3.25(D) HD21 :: 7.19(D) HD22 :: 7.89(D) Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 124.51(D) ND2 :: 112.29(D) Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) I24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.99 C Shift Assignments>> C :: 177.57(D) CA :: 64.85(D) CB :: 37.17(D) CG1 :: 28.79(D) CG2 :: 17.87(D) CD1 :: 12.00(D) Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.38(D) HA :: 3.63(D) HB :: 2.22(D) HG2 :: 1.02(D) HG12 :: 1.38(D) HG13 :: 1.84(D) HD1 :: 0.90(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 130.68(D) Ave N Shift Values>> N :: 121.6(4.72) S25 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 176.50(D) CA :: 63.64(D) CB :: 68.58(D) Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.72(D) HA :: 4.37(D) HB2 :: 4.15(D) HB3 :: 4.22(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 116.80(D) Ave N Shift Values>> N :: 116.3(3.95) G26 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.88 A 0.04 L 0.04 N 0.01 C Shift Assignments>> C :: 175.95(D) CA :: 47.53(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.06(D) HA2 :: 3.82(D) HA3 :: 3.96(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.71(D) Ave N Shift Values>> N :: 109.91(4.29) L27 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.56 K 0.37 G 0.02 R 0.02 C Shift Assignments>> C :: 180.07(D) CA :: 58.29(D) CB :: 42.28(D) CD1 :: 26.60(D) CD2 :: 23.69(D) Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.01(D) HA :: 4.29(D) HB2 :: 1.75(D) HB3 :: 2.06(D) HD1 :: 0.90(D) HD2 :: 0.95(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 124.51(D) Ave N Shift Values>> N :: 121.98(4.07) V28 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> C :: 177.48(D) CA :: 67.40(D) CB :: 31.70(D) CG1 :: 23.20(D) CG2 :: 23.69(D) Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.77(D) HA :: 3.57(D) HB :: 2.23(D) HG1 :: 1.05(D) HG2 :: 1.14(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 119.88(D) Ave N Shift Values>> N :: 121.02(4.96) S29 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.74 S 0.25 C Shift Assignments>> C :: 177.86(D) CA :: 63.32(D) CB :: 65.99(D) Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 9.03(D) HA :: 4.34(D) HB2 :: 4.27(D) HB3 :: 4.27(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 115.57(D) Ave N Shift Values>> N :: 116.3(3.95) T30 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 176.26(D) CA :: 67.00(D) CB :: 68.86(D) CG2 :: 21.56(D) Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.52(D) HA :: 4.09(D) HB :: 4.38(D) HG2 :: 1.38(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 117.11(D) Ave N Shift Values>> N :: 115.7(5.05) T31 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 176.96(D) CA :: 66.00(D) CB :: 67.77(D) CG2 :: 21.14(D) Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.89(D) HA :: 4.16(D) HB :: 4.49(D) HG2 :: 1.39(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 118.65(D) Ave N Shift Values>> N :: 115.7(5.05) M32 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.83 I 0.15 C Shift Assignments>> C :: 177.57(D) CA :: 60.72(D) CB :: 33.53(D) CG :: 31.34(D) CE :: 17.86(D) Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 8.53(D) HA :: 3.98(D) HB2 :: 2.40(D) HB3 :: 2.48(D) HG2 :: 2.99(D) HG3 :: 3.16(D) HE :: 2.10(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 120.19(D) Ave N Shift Values>> N :: 120.1(3.88) Q33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.2 E 0.17 K 0.14 I 0.14 Q 0.13 R 0.12 M 0.02 V 0.02 L 0.01 C Shift Assignments>> C :: 179.07(D) CA :: 59.16(D) CB :: 29.23(D) Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.64(D) HA :: 4.30(D) HB2 :: 2.04(D) HB3 :: 2.26(D) HG2 :: 2.48(D) HG3 :: 2.66(D) HE21 :: 7.01(D) HE22 :: 7.40(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 119.58(D) NE2 :: 111.69(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) N34 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.31 F 0.21 E 0.18 I 0.09 N 0.07 D 0.05 M 0.03 L 0.01 K 0.01 C Shift Assignments>> C :: 178.31(D) CA :: 56.97(D) CB :: 37.90(D) Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.55(D) HA :: 4.59(D) HB2 :: 2.99(D) HB3 :: 3.16(D) HD21 :: 7.06(D) HD22 :: 7.85(D) Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 118.96(D) ND2 :: 112.22(D) Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) E35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.21 E 0.19 R 0.17 Q 0.13 K 0.1 M 0.06 I 0.05 V 0.03 C Shift Assignments>> C :: 177.99(D) CA :: 58.31(D) CB :: 30.21(D) Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.34(D) HA :: 4.60(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 122.66(D) Ave N Shift Values>> N :: 120.68(3.68) A36 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.61 A 0.31 I 0.05 C Shift Assignments>> C :: 179.00(D) CA :: 55.38(D) CB :: 17.87(D) Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.63(D) HA :: 4.03(D) HB :: 1.62(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 121.73(D) Ave N Shift Values>> N :: 123.23(3.7) R37 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.69 K 0.21 G 0.08 C Shift Assignments>> C :: 179.02(D) CA :: 59.39(D) CB :: 30.25(D) CG :: 27.85(D) CD :: 43.00(D) Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.92(D) HA :: 4.01(D) HB2 :: 2.05(D) HB3 :: 2.05(D) HG2 :: 1.70(D) HG3 :: 1.93(D) HD2 :: 2.98(D) HD3 :: 3.31(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 116.80(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) R38 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.59 G 0.29 K 0.05 I 0.04 C Shift Assignments>> C :: 178.90(D) CA :: 59.79(D) CB :: 30.32(D) CD :: 43.85(D) Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.83(D) HA :: 4.10(D) HB2 :: 2.14(D) HB3 :: 2.14(D) HD2 :: 3.31(D) HD3 :: 3.31(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 121.12(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) L39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.7 R 0.25 G 0.01 A 0.01 HN Overlap>> T8 N48 N69 C Shift Assignments>> C :: 176.81(D) CA :: 57.57(D) CB :: 41.90(D) CG :: 27.28(D) CD1 :: 22.60(D) CD2 :: 25.88(D) Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.41(D) HA :: 3.96(D) HB2 :: 1.11(D) HB3 :: 1.76(D) HG :: 1.69(D) HD1 :: 0.68(D) HD2 :: 0.76(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 119.27(D) Ave N Shift Values>> N :: 121.98(4.07) R40 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.27 K 0.24 Q 0.21 R 0.09 W 0.08 E 0.05 V 0.02 C Shift Assignments>> C :: 176.46(D) CA :: 55.75(D) CB :: 33.07(D) Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.29(D) HA :: 4.51(D) HB2 :: 1.88(D) HB3 :: 1.88(D) HG2 :: 1.58(D) HG3 :: 1.58(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 120.50(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) A41 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.65 M 0.3 L 0.02 HN Overlap>> A66 C Shift Assignments>> C :: 178.11(D) CA :: 53.56(D) CB :: 19.78(D) Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.30(D) HA :: 4.34(D) HB :: 1.48(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.82(D) Ave N Shift Values>> N :: 123.23(3.7) E42 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.58 M 0.12 K 0.11 I 0.11 Q 0.05 C Shift Assignments>> CA :: 57.20(D) CB :: 30.17(D) CG :: 36.44(D) Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.34(D) HA :: 4.33(D) HB2 :: 2.05(D) HB3 :: 2.13(D) HG2 :: 2.34(D) HG3 :: 2.34(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 119.64(D) Ave N Shift Values>> N :: 120.68(3.68) R43 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable W44 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.99 C Shift Assignments>> CD1 :: 127.10(D) CE3 :: 121.00(D) CZ2 :: 114.58(D) CZ3 :: 121.93(D) CH2 :: 124.59(D) Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> HD1 :: 7.34(D) HE1 :: 10.19(D) HE3 :: 7.65(D) HZ2 :: 7.51(D) HZ3 :: 7.18(D) HH2 :: 7.26(D) Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> NE1 :: 129.20(D) Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) K45 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable V46 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable E47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> E 0.11 R 0.11 K 0.1 W 0.1 Q 0.09 Y 0.09 F 0.08 M 0.08 S 0.06 L 0.06 D 0.02 I 0.01 V 0.01 C Shift Assignments>> CA :: 57.20 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) N48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.45 D 0.24 Y 0.11 F 0.09 L 0.05 E 0.01 HN Overlap>> T8 L39 N69 C Shift Assignments>> C :: 175.16 CA :: 53.56 CB :: 38.99 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.40 HA :: 4.70 HB2 :: 2.73 HB3 :: 2.80 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 119.27 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) Q49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.33 K 0.29 E 0.17 M 0.12 R 0.05 C Shift Assignments>> C :: 176.34 CA :: 56.50 CB :: 29.61 CG :: 33.89 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.22 HA :: 4.35 HB2 :: 2.06 HB3 :: 2.06 HG2 :: 2.42 HG3 :: 2.42 HE21 :: 6.89 HE22 :: 7.56 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 120.19 NE2 :: 112.31 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) E50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.58 M 0.12 I 0.11 K 0.11 Q 0.05 C Shift Assignments>> C :: 177.26 CA :: 57.29 CB :: 30.19 CG :: 36.44 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.45 HA :: 4.33 HB2 :: 2.06 HB3 :: 2.14 HG2 :: 2.22 HG3 :: 2.36 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 121.43 Ave N Shift Values>> N :: 120.68(3.68) G51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.88 L 0.07 R 0.01 C Shift Assignments>> C :: 174.26 CA :: 45.77 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.40 HA2 :: 4.03 HA3 :: 4.03 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.71 Ave N Shift Values>> N :: 109.91(4.29) M52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.47 A 0.41 I 0.1 HN Overlap>> D67 C Shift Assignments>> C :: 178.52 CA :: 55.81 CB :: 37.80 CG :: 32.43 CE :: 17.01 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 8.10 HA :: 4.51 HB2 :: 2.08 HB3 :: 2.16 HG2 :: 2.58 HG3 :: 2.65 HE :: 2.18 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 119.55 Ave N Shift Values>> N :: 120.1(3.88) V53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.19 W 0.19 R 0.18 Q 0.16 K 0.11 M 0.08 I 0.03 V 0.01 HN Overlap>> R57 C Shift Assignments>> C :: 177.27 CA :: 57.28 CB :: 30.18 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.06 HA :: 4.27 HB :: 1.93 HG1 :: 1.53 HG2 :: 1.53 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 119.27 Ave N Shift Values>> N :: 121.02(4.96) E54 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Anomalous N Shifts: Consistent PRTL>> E 0.19 W 0.19 R 0.18 Q 0.16 K 0.12 M 0.08 I 0.03 V 0.01 HN Overlap>> V55 C Shift Assignments>> C :: 177.03(D) CA :: 57.27(D) CB :: 30.13(D) Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.06 HA :: 4.58 HB2 :: 3.44(M) HB3 :: 3.44(M) HG2 :: 3.06(S) HG3 :: 3.06(S) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 120.51 Ave N Shift Values>> N :: 120.68(3.68) V55 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 HN Overlap>> E54 C Shift Assignments>> C :: 176.20(D) CA :: 63.03(D) CB :: 32.91(D) CG1 :: 21.51 CG2 :: 20.78 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.98(D) HA :: 4.08(D) HB :: 2.16(D) HG1 :: 1.00(D) HG2 :: 1.01(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 120.50(D) Ave N Shift Values>> N :: 121.02(4.96) A56 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.66 M 0.3 L 0.01 C Shift Assignments>> C :: 178.03(D) CA :: 53.54(D) CB :: 19.47(D) Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.21(D) HA :: 4.29(D) HB :: 1.45(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 125.63(D) Ave N Shift Values>> N :: 123.23(3.7) R57 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.67 K 0.19 G 0.11 I 0.01 HN Overlap>> V53 C Shift Assignments>> C :: 176.35 CA :: 56.74(D) CB :: 30.82(D) CD :: 43.36 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.03(D) HA :: 4.29(D) HB2 :: 1.78 HB3 :: 1.78 HD2 :: 3.14 HD3 :: 3.20 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 119.27(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) F58 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> Y 0.35 F 0.32 I 0.19 E 0.04 D 0.03 L 0.03 N 0.01 C Shift Assignments>> C :: 176.01(D) CA :: 58.50 CB :: 38.99 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.13 HA :: 4.61 HB2 :: 3.11 HB3 :: 3.23 HD1 :: 7.28(D) HD2 :: 7.28(D) HE1 :: 7.38(D) HE2 :: 7.38(D) Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 120.81 Ave N Shift Values>> N :: 120.69(4.18) I59 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.99 C Shift Assignments>> C :: 176.27(D) CA :: 61.57(D) CB :: 39.16(D) CG1 :: 27.30 CG2 :: 17.59 CD1 :: 12.76 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.00(D) HA :: 4.08(D) HB :: 1.89 HG2 :: 0.92 HG12 :: 1.21 HG13 :: 1.55 HD1 :: 0.89 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 122.04(D) Ave N Shift Values>> N :: 121.6(4.72) E60 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.58 M 0.12 I 0.11 K 0.11 Q 0.05 C Shift Assignments>> C :: 176.76 CA :: 57.29 CB :: 30.18 CG :: 36.44 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.30(D) HA :: 4.25 HB2 :: 2.06 HB3 :: 2.13 HG2 :: 2.34 HG3 :: 2.34 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 123.58(D) Ave N Shift Values>> N :: 120.68(3.68) M61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.69 I 0.22 A 0.06 HN Overlap>> D21 N62 C Shift Assignments>> C :: 176.56 CA :: 57.27 CE :: 17.00 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 8.17 HA :: 4.28 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 118.03 Ave N Shift Values>> N :: 120.1(3.88) N62 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.43 D 0.26 Y 0.11 F 0.09 L 0.06 E 0.01 HN Overlap>> D21 M61 C Shift Assignments>> C :: 175.71(D) CA :: 53.61 CB :: 39.12 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.08 HA :: 4.72 HB2 :: 2.49 HB3 :: 2.74 HD21 :: 6.78 HD22 :: 7.37 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 117.99 ND2 :: 113.25 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) G63 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.87 L 0.08 R 0.02 C Shift Assignments>> C :: 174.03(D) CA :: 45.59(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.34(D) HA2 :: 4.00(D) HA3 :: 4.00(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.09(D) Ave N Shift Values>> N :: 109.91(4.29) S64 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 174.13(D) CA :: 58.29(D) CB :: 63.93(D) Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.12(D) HA :: 4.48 HB2 :: 3.85 HB3 :: 4.00 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 115.26(D) Ave N Shift Values>> N :: 116.3(3.95) F65 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.32 F 0.32 I 0.1 D 0.09 L 0.07 N 0.03 K 0.02 E 0.02 HN Overlap>> D71 C Shift Assignments>> C :: 175.58(D) CA :: 57.57(D) CB :: 39.57(D) Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.25(D) HA :: 4.69 HB2 :: 3.08 HB3 :: 3.25 HD1 :: 7.32 HD2 :: 7.32 HE1 :: 7.40 HE2 :: 7.40 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 121.73(D) Ave N Shift Values>> N :: 120.69(4.18) A66 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.74 M 0.23 L 0.01 HN Overlap>> A41 C Shift Assignments>> C :: 177.22(D) CA :: 52.83(D) CB :: 19.47(D) Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.20(D) HA :: 4.35(D) HB :: 1.41(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.82(D) Ave N Shift Values>> N :: 123.23(3.7) D67 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.29 L 0.23 K 0.15 N 0.09 F 0.08 Y 0.07 R 0.04 HN Overlap>> M52 C Shift Assignments>> C :: 176.44 CA :: 54.29(D) CB :: 41.35(D) Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.17(D) HA :: 4.62(D) HB2 :: 2.68(D) HB3 :: 2.68(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 119.58(D) Ave N Shift Values>> N :: 120.73(4.2) E68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.58 M 0.16 K 0.1 I 0.08 Q 0.05 C Shift Assignments>> C :: 176.25 CA :: 57.01 CB :: 30.44 CG :: 36.36 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.35 HA :: 4.31 HB2 :: 2.07 HB3 :: 2.15 HG2 :: 2.36 HG3 :: 2.36 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 121.12 Ave N Shift Values>> N :: 120.68(3.68) N69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.47 D 0.24 Y 0.11 F 0.09 L 0.05 E 0.01 HN Overlap>> T8 L39 N48 C Shift Assignments>> C :: 175.54 CA :: 53.51 CB :: 38.93 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.35 HA :: 4.70 HB2 :: 2.73 HB3 :: 2.79 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 119.27 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) K70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.87 R 0.06 I 0.02 E 0.01 M 0.01 C Shift Assignments>> C :: 175.82 CA :: 56.21 CB :: 33.18 CE :: 40.41 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.03 HA :: 4.23 HB2 :: 1.58 HB3 :: 1.65 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 121.43 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) D71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.28 L 0.24 K 0.16 F 0.08 N 0.07 R 0.06 Y 0.06 HN Overlap>> F65 C Shift Assignments>> C :: 174.75 CA :: 54.25 CB :: 41.60 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.15 HA :: 4.69 HB2 :: 2.60 HB3 :: 2.73 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 121.73 Ave N Shift Values>> N :: 120.73(4.2) W72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.99 C Shift Assignments>> CA :: 58.22 CB :: 30.09 CD1 :: 127.09 CE3 :: 121.52 CZ2 :: 114.58 CZ3 :: 121.77 CH2 :: 124.64 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 7.51 HA :: 4.56 HB2 :: 3.28 HB3 :: 3.37 HD1 :: 7.27 HE1 :: 10.14 HE3 :: 7.76 HZ2 :: 7.55 HZ3 :: 7.22 HH2 :: 7.27 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 125.74 NE1 :: 128.80 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) ########################################################################### Overall Results: #Consistent: 17 #Clerical: 52 #Suspicious: 0 #Anomalous: 2 #Mistyped: 1 #Indeterminable: 0 Typing Results: #Consistent: 67 #Suspicious: 0 #Mistyped: 1 #Indeterminable: 4 Shift Relative Order (SRO) Results: #Consistent: 72 #Suspicious: 0 C Shift Results: #Consistent: 62 #Duplicate: 203 #Unknown: 0 #Suspicious: 0 #Anomalous: 1 H Shift Results: #Consistent: 99 #Duplicate: 262 #Unknown: 0 #Suspicious: 2 #Anomalous: 2 N Shift Results: #Consistent: 18 #Duplicate: 56 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: K2 C = 175.74(D), Expected = 176.46, Std = 2.0500, ChiSquare = 7.2542e-01 K2 CA = 55.51(D), Expected = 56.84, Std = 2.2500, ChiSquare = 5.5445e-01 K2 CB = 34.54(D), Expected = 32.83, Std = 1.8800, ChiSquare = 3.6305e-01 K2 CG = 24.78(D), Expected = 24.91, Std = 1.3100, ChiSquare = 9.2095e-01 K2 CD = 29.52(D), Expected = 28.78, Std = 1.3900, ChiSquare = 5.9447e-01 K2 HA = 4.14(D), Expected = 4.28, Std = 0.4500, ChiSquare = 7.5572e-01 K2 HB2 = 1.41(D), Expected = 1.79, Std = 0.2500, ChiSquare = 1.2851e-01 K2 HB3 = 1.61(D), Expected = 1.78, Std = 0.2600, ChiSquare = 5.1321e-01 K2 HG2 = 1.41(D), Expected = 1.38, Std = 0.2700, ChiSquare = 9.1153e-01 K2 HG3 = 1.51(D), Expected = 1.37, Std = 0.2900, ChiSquare = 6.2927e-01 K2 HD2 = 1.74(D), Expected = 1.61, Std = 0.2500, ChiSquare = 6.0306e-01 K2 HD3 = 1.74(D), Expected = 1.61, Std = 0.2500, ChiSquare = 6.0306e-01 K2 HE2 = 3.01(D), Expected = 2.93, Std = 0.2000, ChiSquare = 6.8916e-01 K2 HE3 = 3.01(D), Expected = 2.93, Std = 0.2000, ChiSquare = 6.8916e-01 Q3 C = 173.53(D), Expected = 176.39, Std = 1.9600, ChiSquare = 1.4451e-01 Q3 CA = 54.26(D), Expected = 56.62, Std = 2.1900, ChiSquare = 2.8120e-01 Q3 CG = 32.76(D), Expected = 33.72, Std = 1.1000, ChiSquare = 3.8281e-01 Q3 H = 9.10(D), Expected = 8.22, Std = 0.6200, ChiSquare = 1.5580e-01 Q3 HA = 4.70(D), Expected = 4.28, Std = 0.4400, ChiSquare = 3.3981e-01 Q3 HB2 = 1.53(D), Expected = 2.05, Std = 0.2800, ChiSquare = 6.3291e-02 Q3 HB3 = 1.53(D), Expected = 2.04, Std = 0.2900, ChiSquare = 7.8642e-02 Q3 HG2 = 1.80(D), Expected = 2.32, Std = 0.2900, ChiSquare = 7.2957e-02 Q3 HG3 = 1.96(D), Expected = 2.32, Std = 0.2900, ChiSquare = 2.1447e-01 Q3 HE21 = 6.81(D), Expected = 7.17, Std = 0.4600, ChiSquare = 4.3386e-01 Q3 HE22 = 7.34(D), Expected = 7.07, Std = 0.4900, ChiSquare = 5.8162e-01 Q3 N = 120.19(D), Expected = 119.92, Std = 4.0100, ChiSquare = 9.4632e-01 Q3 NE2 = 110.67(D), Expected = 111.81, Std = 2.2000, ChiSquare = 6.0433e-01 R4 C = 176.44(D), Expected = 176.49, Std = 2.1600, ChiSquare = 9.8153e-01 R4 CA = 55.63(D), Expected = 56.95, Std = 2.4100, ChiSquare = 5.8389e-01 R4 CB = 30.98(D), Expected = 30.66, Std = 1.7700, ChiSquare = 8.5653e-01 R4 CG = 27.33(D), Expected = 27.31, Std = 1.6500, ChiSquare = 9.9033e-01 R4 CD = 43.72(D), Expected = 43.10, Std = 1.1000, ChiSquare = 5.7300e-01 R4 H = 8.69(D), Expected = 8.24, Std = 0.6000, ChiSquare = 4.5325e-01 R4 HA = 5.08(D), Expected = 4.27, Std = 0.4400, ChiSquare = 6.5635e-02 R4 HB2 = 1.73(D), Expected = 1.79, Std = 0.2800, ChiSquare = 8.3032e-01 R4 HB3 = 1.61(D), Expected = 1.78, Std = 0.2800, ChiSquare = 5.4376e-01 R4 HG2 = 1.56(D), Expected = 1.58, Std = 0.2700, ChiSquare = 9.4095e-01 R4 HG3 = 1.56(D), Expected = 1.58, Std = 0.2700, ChiSquare = 9.4095e-01 R4 HD2 = 3.15(D), Expected = 3.13, Std = 0.2300, ChiSquare = 9.3071e-01 R4 HD3 = 3.15(D), Expected = 3.13, Std = 0.2200, ChiSquare = 9.2757e-01 R4 N = 124.82(D), Expected = 120.61, Std = 3.9000, ChiSquare = 2.8037e-01 I5 C = 173.94(D), Expected = 175.82, Std = 1.9500, ChiSquare = 3.3499e-01 I5 CA = 59.26(D), Expected = 61.59, Std = 2.7800, ChiSquare = 4.0196e-01 I5 CB = 41.97(D), Expected = 38.58, Std = 2.0900, ChiSquare = 1.0480e-01 I5 CG1 = 26.24(D), Expected = 27.65, Std = 2.3200, ChiSquare = 5.4335e-01 I5 CG2 = 17.05(D), Expected = 17.36, Std = 1.6000, ChiSquare = 8.4637e-01 I5 CD1 = 14.88(D), Expected = 13.41, Std = 1.9100, ChiSquare = 4.4152e-01 I5 H = 9.01(D), Expected = 8.26, Std = 0.7100, ChiSquare = 2.9081e-01 I5 HA = 4.78(D), Expected = 4.20, Std = 0.5600, ChiSquare = 3.0034e-01 I5 HB = 1.75(D), Expected = 1.80, Std = 0.3100, ChiSquare = 8.7186e-01 I5 HG2 = 0.25(D), Expected = 0.80, Std = 0.2900, ChiSquare = 5.7887e-02 I5 HG12 = 0.85(D), Expected = 1.30, Std = 0.4000, ChiSquare = 2.6059e-01 I5 HG13 = 1.19(D), Expected = 1.24, Std = 0.4000, ChiSquare = 9.0052e-01 I5 HD1 = 0.54(D), Expected = 0.70, Std = 0.3000, ChiSquare = 5.9380e-01 I5 N = 119.88(D), Expected = 121.60, Std = 4.7200, ChiSquare = 7.1555e-01 T6 C = 174.55(D), Expected = 174.60, Std = 1.8000, ChiSquare = 9.7784e-01 T6 CA = 60.79(D), Expected = 62.15, Std = 2.7200, ChiSquare = 6.1707e-01 T6 CB = 69.51(D), Expected = 69.64, Std = 1.7000, ChiSquare = 9.3904e-01 T6 CG2 = 21.90(D), Expected = 21.44, Std = 1.3900, ChiSquare = 7.4069e-01 T6 H = 8.31(D), Expected = 8.27, Std = 0.6200, ChiSquare = 9.4856e-01 T6 HA = 5.47(D), Expected = 4.48, Std = 0.5000, ChiSquare = 4.7704e-02 T6 HB = 3.91(D), Expected = 4.17, Std = 0.3700, ChiSquare = 4.8224e-01 T6 HG2 = 1.14(D), Expected = 1.16, Std = 0.2800, ChiSquare = 9.4306e-01 T6 N = 116.80(D), Expected = 115.70, Std = 5.0500, ChiSquare = 8.2757e-01 V7 C = 173.61(D), Expected = 175.69, Std = 2.0300, ChiSquare = 3.0554e-01 V7 CA = 58.97(D), Expected = 62.48, Std = 3.0400, ChiSquare = 2.4825e-01 V7 CB = 36.43(D), Expected = 32.66, Std = 1.9100, ChiSquare = 4.8402e-02 V7 CG1 = 19.07(D), Expected = 21.38, Std = 1.5300, ChiSquare = 1.3109e-01 V7 CG2 = 21.87(D), Expected = 21.31, Std = 1.7600, ChiSquare = 7.5035e-01 V7 H = 8.90(D), Expected = 8.29, Std = 0.7100, ChiSquare = 3.9026e-01 V7 HA = 4.93(D), Expected = 4.16, Std = 0.5700, ChiSquare = 1.7673e-01 V7 HB = 2.33(D), Expected = 1.99, Std = 0.3300, ChiSquare = 3.0287e-01 V7 HG1 = 0.64(D), Expected = 0.84, Std = 0.2700, ChiSquare = 4.5885e-01 V7 HG2 = 0.84(D), Expected = 0.83, Std = 0.2900, ChiSquare = 9.7249e-01 V7 N = 119.27(D), Expected = 121.02, Std = 4.9600, ChiSquare = 7.2422e-01 T8 C = 174.47(D), Expected = 174.60, Std = 1.8000, ChiSquare = 9.4243e-01 T8 CA = 62.09(D), Expected = 62.15, Std = 2.7200, ChiSquare = 9.8240e-01 T8 CB = 69.47(D), Expected = 69.64, Std = 1.7000, ChiSquare = 9.2034e-01 T8 CG2 = 22.59(D), Expected = 21.44, Std = 1.3900, ChiSquare = 4.0805e-01 T8 H = 8.38(D), Expected = 8.27, Std = 0.6200, ChiSquare = 8.5918e-01 T8 HA = 4.93(D), Expected = 4.48, Std = 0.5000, ChiSquare = 3.6812e-01 T8 HB = 3.99(D), Expected = 4.17, Std = 0.3700, ChiSquare = 6.2662e-01 T8 HG2 = 1.13(D), Expected = 1.16, Std = 0.2800, ChiSquare = 9.1468e-01 T8 N = 119.27(D), Expected = 115.70, Std = 5.0500, ChiSquare = 4.7961e-01 V9 C = 179.13(D), Expected = 175.69, Std = 2.0300, ChiSquare = 9.0155e-02 V9 CA = 58.29(D), Expected = 62.48, Std = 3.0400, ChiSquare = 1.6811e-01 V9 CB = 36.05(D), Expected = 32.66, Std = 1.9100, ChiSquare = 7.5920e-02 V9 CG1 = 19.68(D), Expected = 21.38, Std = 1.5300, ChiSquare = 2.6652e-01 V9 CG2 = 22.96(D), Expected = 21.31, Std = 1.7600, ChiSquare = 3.4850e-01 V9 H = 8.91(D), Expected = 8.29, Std = 0.7100, ChiSquare = 3.8253e-01 V9 HA = 4.70(D), Expected = 4.16, Std = 0.5700, ChiSquare = 3.4345e-01 V9 HB = 2.08(D), Expected = 1.99, Std = 0.3300, ChiSquare = 7.8506e-01 V9 HG1 = 0.78(D), Expected = 0.84, Std = 0.2700, ChiSquare = 8.2414e-01 V9 HG2 = 0.87(D), Expected = 0.83, Std = 0.2900, ChiSquare = 8.9030e-01 V9 N = 117.42(D), Expected = 121.02, Std = 4.9600, ChiSquare = 4.6796e-01 D10 C = 176.22(D), Expected = 176.41, Std = 1.7700, ChiSquare = 9.1452e-01 D10 CA = 62.33(M), Expected = 54.52, Std = 2.1000, ChiSquare = 1.9998e-04 D10 CB = 40.76(D), Expected = 40.70, Std = 1.6700, ChiSquare = 9.7134e-01 D10 H = 8.16(D), Expected = 8.33, Std = 0.5700, ChiSquare = 7.6552e-01 D10 HA = 4.37(D), Expected = 4.61, Std = 0.3100, ChiSquare = 4.3882e-01 D10 HB2 = 2.76(D), Expected = 2.74, Std = 0.2900, ChiSquare = 9.4502e-01 D10 HB3 = 2.87(D), Expected = 2.70, Std = 0.2900, ChiSquare = 5.5774e-01 D10 N = 115.55(D), Expected = 120.73, Std = 4.2000, ChiSquare = 2.1745e-01 S11 C = 174.32(D), Expected = 174.53, Std = 1.7300, ChiSquare = 9.0338e-01 S11 CA = 58.29(D), Expected = 58.57, Std = 2.1200, ChiSquare = 8.9492e-01 S11 CB = 67.88(D), Expected = 63.80, Std = 1.5700, ChiSquare = 9.3570e-03 S11 H = 8.50(D), Expected = 8.29, Std = 0.6200, ChiSquare = 7.3483e-01 S11 HA = 4.46(D), Expected = 4.51, Std = 0.4300, ChiSquare = 9.0743e-01 S11 HB2 = 3.92(D), Expected = 3.88, Std = 0.2900, ChiSquare = 8.9030e-01 S11 HB3 = 3.98(D), Expected = 3.87, Std = 0.3100, ChiSquare = 7.2271e-01 S11 N = 121.10(D), Expected = 116.30, Std = 3.9500, ChiSquare = 2.2429e-01 D12 C = 176.55(D), Expected = 176.41, Std = 1.7700, ChiSquare = 9.3696e-01 D12 CA = 55.02(D), Expected = 54.52, Std = 2.1000, ChiSquare = 8.1181e-01 D12 CB = 43.09(D), Expected = 40.70, Std = 1.6700, ChiSquare = 1.5239e-01 D12 H = 7.91(D), Expected = 8.33, Std = 0.5700, ChiSquare = 4.6122e-01 D12 HB2 = 2.72(D), Expected = 2.74, Std = 0.2900, ChiSquare = 9.4502e-01 D12 HB3 = 2.77(D), Expected = 2.70, Std = 0.2900, ChiSquare = 8.0926e-01 D12 N = 119.88(D), Expected = 120.73, Std = 4.2000, ChiSquare = 8.3962e-01 S13 C = 175.25(D), Expected = 174.53, Std = 1.7300, ChiSquare = 6.7727e-01 S13 CA = 62.29(D), Expected = 58.57, Std = 2.1200, ChiSquare = 7.9308e-02 S13 CB = 63.16(D), Expected = 63.80, Std = 1.5700, ChiSquare = 6.8354e-01 S13 H = 9.07(D), Expected = 8.29, Std = 0.6200, ChiSquare = 2.0837e-01 S13 HA = 4.23(D), Expected = 4.51, Std = 0.4300, ChiSquare = 5.1494e-01 S13 HB2 = 3.90(D), Expected = 3.88, Std = 0.2900, ChiSquare = 9.4502e-01 S13 HB3 = 3.98(D), Expected = 3.87, Std = 0.3100, ChiSquare = 7.2271e-01 S13 N = 122.97(D), Expected = 116.30, Std = 3.9500, ChiSquare = 9.1295e-02 Y14 C = 176.03(D), Expected = 175.39, Std = 1.8900, ChiSquare = 7.3489e-01 Y14 CA = 61.60(D), Expected = 58.02, Std = 2.6400, ChiSquare = 1.7508e-01 Y14 CB = 39.03(D), Expected = 39.16, Std = 2.2300, ChiSquare = 9.5351e-01 Y14 CD1 = 132.61(D), Expected = 132.54, Std = 1.3500, ChiSquare = 9.5865e-01 Y14 CD2 = 132.61(D), Expected = 132.26, Std = 1.9900, ChiSquare = 8.6039e-01 Y14 CE1 = 118.40(D), Expected = 117.81, Std = 2.0900, ChiSquare = 7.7772e-01 Y14 CE2 = 118.40(D), Expected = 117.91, Std = 2.6000, ChiSquare = 8.5051e-01 Y14 H = 7.80(D), Expected = 8.37, Std = 0.7500, ChiSquare = 4.4725e-01 Y14 HA = 4.14(D), Expected = 4.63, Std = 0.5600, ChiSquare = 3.8157e-01 Y14 HB2 = 3.07(D), Expected = 2.91, Std = 0.3700, ChiSquare = 6.6543e-01 Y14 HB3 = 3.14(D), Expected = 2.91, Std = 0.3700, ChiSquare = 5.3419e-01 Y14 HD1 = 7.00(D), Expected = 6.87, Std = 0.6500, ChiSquare = 8.4148e-01 Y14 HD2 = 7.00(D), Expected = 6.86, Std = 0.6800, ChiSquare = 8.3688e-01 Y14 HE1 = 6.83(D), Expected = 6.64, Std = 0.5800, ChiSquare = 7.4322e-01 Y14 HE2 = 6.83(D), Expected = 6.63, Std = 0.6100, ChiSquare = 7.4301e-01 Y14 N = 121.73(D), Expected = 120.79, Std = 4.6900, ChiSquare = 8.4115e-01 Q15 C = 179.13(D), Expected = 176.39, Std = 1.9600, ChiSquare = 1.6213e-01 Q15 CA = 58.66(D), Expected = 56.62, Std = 2.1900, ChiSquare = 3.5159e-01 Q15 CB = 28.11(D), Expected = 29.10, Std = 1.9700, ChiSquare = 6.1529e-01 Q15 CG = 34.25(D), Expected = 33.72, Std = 1.1000, ChiSquare = 6.2993e-01 Q15 H = 8.57(D), Expected = 8.22, Std = 0.6200, ChiSquare = 5.7240e-01 Q15 HA = 3.70(D), Expected = 4.28, Std = 0.4400, ChiSquare = 1.8744e-01 Q15 HB2 = 2.17(D), Expected = 2.05, Std = 0.2800, ChiSquare = 6.6823e-01 Q15 HB3 = 2.21(D), Expected = 2.04, Std = 0.2900, ChiSquare = 5.5774e-01 Q15 HG2 = 2.61(D), Expected = 2.32, Std = 0.2900, ChiSquare = 3.1731e-01 Q15 HG3 = 2.76(D), Expected = 2.32, Std = 0.2900, ChiSquare = 1.2921e-01 Q15 HE21 = 6.98(D), Expected = 7.17, Std = 0.4600, ChiSquare = 6.7957e-01 Q15 HE22 = 7.58(D), Expected = 7.07, Std = 0.4900, ChiSquare = 2.9796e-01 Q15 N = 115.26(D), Expected = 119.92, Std = 4.0100, ChiSquare = 2.4520e-01 Q15 NE2 = 111.46(D), Expected = 111.81, Std = 2.2000, ChiSquare = 8.7360e-01 L16 C = 178.10(D), Expected = 176.97, Std = 2.0900, ChiSquare = 5.8874e-01 L16 CA = 58.22(D), Expected = 55.65, Std = 2.2100, ChiSquare = 2.4487e-01 L16 CB = 42.09(D), Expected = 42.37, Std = 1.8600, ChiSquare = 8.8034e-01 L16 CG = 28.06(D), Expected = 26.77, Std = 1.2500, ChiSquare = 3.0207e-01 L16 CD1 = 25.51(D), Expected = 24.73, Std = 1.7100, ChiSquare = 6.4829e-01 L16 CD2 = 24.78(D), Expected = 24.10, Std = 1.7800, ChiSquare = 7.0244e-01 L16 H = 7.64(D), Expected = 8.22, Std = 0.6500, ChiSquare = 3.7223e-01 L16 HA = 4.15(D), Expected = 4.32, Std = 0.4700, ChiSquare = 7.1757e-01 L16 HB2 = 1.79(D), Expected = 1.63, Std = 0.3400, ChiSquare = 6.3793e-01 L16 HB3 = 1.85(D), Expected = 1.57, Std = 0.3600, ChiSquare = 4.3670e-01 L16 HG = 1.69(D), Expected = 1.54, Std = 0.3300, ChiSquare = 6.4944e-01 L16 HD1 = 0.93(D), Expected = 0.77, Std = 0.2700, ChiSquare = 5.5345e-01 L16 HD2 = 0.95(D), Expected = 0.76, Std = 0.2800, ChiSquare = 4.9741e-01 L16 N = 121.73(D), Expected = 121.98, Std = 4.0700, ChiSquare = 9.5102e-01 L17 C = 179.68(D), Expected = 176.97, Std = 2.0900, ChiSquare = 1.9475e-01 L17 CA = 58.23(D), Expected = 55.65, Std = 2.2100, ChiSquare = 2.4304e-01 L17 CB = 41.90(D), Expected = 42.37, Std = 1.8600, ChiSquare = 8.0051e-01 L17 CD1 = 23.33(D), Expected = 24.73, Std = 1.7100, ChiSquare = 4.1295e-01 L17 CD2 = 25.88(D), Expected = 24.10, Std = 1.7800, ChiSquare = 3.1731e-01 L17 H = 7.92(D), Expected = 8.22, Std = 0.6500, ChiSquare = 6.4441e-01 L17 HA = 3.91(D), Expected = 4.32, Std = 0.4700, ChiSquare = 3.8302e-01 L17 HB2 = 1.27(D), Expected = 1.63, Std = 0.3400, ChiSquare = 2.8968e-01 L17 HB3 = 1.96(D), Expected = 1.57, Std = 0.3600, ChiSquare = 2.7866e-01 L17 HD1 = 0.88(D), Expected = 0.77, Std = 0.2700, ChiSquare = 6.8371e-01 L17 HD2 = 1.02(D), Expected = 0.76, Std = 0.2800, ChiSquare = 3.5311e-01 L17 N = 117.42(D), Expected = 121.98, Std = 4.0700, ChiSquare = 2.6255e-01 K18 C = 178.43(D), Expected = 176.46, Std = 2.0500, ChiSquare = 3.3656e-01 K18 CA = 59.54(D), Expected = 56.84, Std = 2.2500, ChiSquare = 2.3014e-01 K18 CB = 30.54(D), Expected = 32.83, Std = 1.8800, ChiSquare = 2.2319e-01 K18 CG = 24.44(D), Expected = 24.91, Std = 1.3100, ChiSquare = 7.1976e-01 K18 CD = 28.79(D), Expected = 28.78, Std = 1.3900, ChiSquare = 9.9426e-01 K18 CE = 41.54(D), Expected = 41.78, Std = 0.9800, ChiSquare = 8.0654e-01 K18 H = 8.24(D), Expected = 8.22, Std = 0.6400, ChiSquare = 9.7507e-01 K18 HA = 4.11(D), Expected = 4.28, Std = 0.4500, ChiSquare = 7.0560e-01 K18 HB2 = 1.87(D), Expected = 1.79, Std = 0.2500, ChiSquare = 7.4897e-01 K18 HB3 = 1.97(D), Expected = 1.78, Std = 0.2600, ChiSquare = 4.6492e-01 K18 HG2 = 1.21(D), Expected = 1.38, Std = 0.2700, ChiSquare = 5.2894e-01 K18 HG3 = 1.21(D), Expected = 1.37, Std = 0.2900, ChiSquare = 5.8114e-01 K18 HD2 = 1.53(D), Expected = 1.61, Std = 0.2500, ChiSquare = 7.4897e-01 K18 HD3 = 1.53(D), Expected = 1.61, Std = 0.2500, ChiSquare = 7.4897e-01 K18 HE2 = 2.88(D), Expected = 2.93, Std = 0.2000, ChiSquare = 8.0259e-01 K18 HE3 = 3.01(D), Expected = 2.93, Std = 0.2000, ChiSquare = 6.8916e-01 K18 N = 118.96(D), Expected = 121.16, Std = 4.1100, ChiSquare = 5.9246e-01 A19 C = 179.83(D), Expected = 177.80, Std = 2.1800, ChiSquare = 3.5175e-01 A19 CA = 54.79(D), Expected = 53.16, Std = 2.0600, ChiSquare = 4.2879e-01 A19 CB = 18.22(D), Expected = 18.90, Std = 1.8500, ChiSquare = 7.1320e-01 A19 H = 7.76(D), Expected = 8.20, Std = 0.6000, ChiSquare = 4.6336e-01 A19 HA = 4.30(D), Expected = 4.26, Std = 0.4200, ChiSquare = 9.2413e-01 A19 HB = 1.61(D), Expected = 1.38, Std = 0.2500, ChiSquare = 3.5757e-01 A19 N = 120.81(D), Expected = 123.23, Std = 3.7000, ChiSquare = 5.1308e-01 Y20 CA = 58.22(D), Expected = 58.02, Std = 2.6400, ChiSquare = 9.3961e-01 Y20 CB = 39.16(D), Expected = 39.16, Std = 2.2300, ChiSquare = 1.0000e+00 Y20 CD1 = 132.59(D), Expected = 132.54, Std = 1.3500, ChiSquare = 9.7046e-01 Y20 CD2 = 132.59(D), Expected = 132.26, Std = 1.9900, ChiSquare = 8.6829e-01 Y20 CE1 = 117.86(D), Expected = 117.81, Std = 2.0900, ChiSquare = 9.8091e-01 Y20 CE2 = 117.86(D), Expected = 117.91, Std = 2.6000, ChiSquare = 9.8466e-01 Y20 H = 8.07(D), Expected = 8.37, Std = 0.7500, ChiSquare = 6.8916e-01 Y20 HA = 4.20(D), Expected = 4.63, Std = 0.5600, ChiSquare = 4.4257e-01 Y20 HD1 = 7.23(D), Expected = 6.87, Std = 0.6500, ChiSquare = 5.7968e-01 Y20 HD2 = 7.23(D), Expected = 6.86, Std = 0.6800, ChiSquare = 5.8636e-01 Y20 HE1 = 6.77(D), Expected = 6.64, Std = 0.5800, ChiSquare = 8.2265e-01 Y20 HE2 = 6.77(D), Expected = 6.63, Std = 0.6100, ChiSquare = 8.1847e-01 Y20 N = 117.73(D), Expected = 120.79, Std = 4.6900, ChiSquare = 5.1411e-01 D21 C = 175.27(D), Expected = 176.41, Std = 1.7700, ChiSquare = 5.1953e-01 D21 CA = 55.38(D), Expected = 54.52, Std = 2.1000, ChiSquare = 6.8216e-01 D21 CB = 39.43(D), Expected = 40.70, Std = 1.6700, ChiSquare = 4.4697e-01 D21 H = 8.16(D), Expected = 8.33, Std = 0.5700, ChiSquare = 7.6552e-01 D21 HA = 4.48(D), Expected = 4.61, Std = 0.3100, ChiSquare = 6.7496e-01 D21 HB2 = 2.63(D), Expected = 2.74, Std = 0.2900, ChiSquare = 7.0446e-01 D21 HB3 = 3.18(D), Expected = 2.70, Std = 0.2900, ChiSquare = 9.7890e-02 D21 N = 118.03(D), Expected = 120.73, Std = 4.2000, ChiSquare = 5.2032e-01 V22 C = 176.16(D), Expected = 175.69, Std = 2.0300, ChiSquare = 8.1691e-01 V22 CA = 63.03(D), Expected = 62.48, Std = 3.0400, ChiSquare = 8.5643e-01 V22 CB = 32.80(D), Expected = 32.66, Std = 1.9100, ChiSquare = 9.4157e-01 V22 CG1 = 21.14(D), Expected = 21.38, Std = 1.5300, ChiSquare = 8.7535e-01 V22 CG2 = 23.33(D), Expected = 21.31, Std = 1.7600, ChiSquare = 2.5108e-01 V22 H = 7.85(D), Expected = 8.29, Std = 0.7100, ChiSquare = 5.3544e-01 V22 HA = 3.86(D), Expected = 4.16, Std = 0.5700, ChiSquare = 5.9867e-01 V22 HB = 1.84(D), Expected = 1.99, Std = 0.3300, ChiSquare = 6.4944e-01 V22 HG1 = 0.90(D), Expected = 0.84, Std = 0.2700, ChiSquare = 8.2414e-01 V22 HG2 = 1.13(D), Expected = 0.83, Std = 0.2900, ChiSquare = 3.0091e-01 V22 N = 118.96(D), Expected = 121.02, Std = 4.9600, ChiSquare = 6.7791e-01 N23 C = 175.60(D), Expected = 175.16, Std = 1.7600, ChiSquare = 8.0259e-01 N23 CA = 52.41(D), Expected = 53.43, Std = 1.9400, ChiSquare = 5.9905e-01 N23 CB = 37.05(D), Expected = 38.66, Std = 1.7800, ChiSquare = 3.6573e-01 N23 H = 8.77(D), Expected = 8.37, Std = 0.6500, ChiSquare = 5.3830e-01 N23 HA = 4.83(D), Expected = 4.70, Std = 0.3900, ChiSquare = 7.3888e-01 N23 HB2 = 2.98(D), Expected = 2.80, Std = 0.3400, ChiSquare = 5.9652e-01 N23 HB3 = 3.25(D), Expected = 2.78, Std = 0.3400, ChiSquare = 1.6686e-01 N23 HD21 = 7.19(D), Expected = 7.27, Std = 0.5200, ChiSquare = 8.7773e-01 N23 HD22 = 7.89(D), Expected = 7.20, Std = 0.5200, ChiSquare = 1.8453e-01 N23 N = 124.51(D), Expected = 119.13, Std = 4.4200, ChiSquare = 2.2353e-01 N23 ND2 = 112.29(D), Expected = 112.83, Std = 2.6000, ChiSquare = 8.3547e-01 I24 C = 177.57(D), Expected = 175.82, Std = 1.9500, ChiSquare = 3.6949e-01 I24 CA = 64.85(D), Expected = 61.59, Std = 2.7800, ChiSquare = 2.4093e-01 I24 CB = 37.17(D), Expected = 38.58, Std = 2.0900, ChiSquare = 4.9990e-01 I24 CG1 = 28.79(D), Expected = 27.65, Std = 2.3200, ChiSquare = 6.2316e-01 I24 CG2 = 17.87(D), Expected = 17.36, Std = 1.6000, ChiSquare = 7.4992e-01 I24 CD1 = 12.00(D), Expected = 13.41, Std = 1.9100, ChiSquare = 4.6038e-01 I24 H = 8.38(D), Expected = 8.26, Std = 0.7100, ChiSquare = 8.6579e-01 I24 HA = 3.63(D), Expected = 4.20, Std = 0.5600, ChiSquare = 3.0875e-01 I24 HB = 2.22(D), Expected = 1.80, Std = 0.3100, ChiSquare = 1.7547e-01 I24 HG2 = 1.02(D), Expected = 0.80, Std = 0.2900, ChiSquare = 4.4808e-01 I24 HG12 = 1.38(D), Expected = 1.30, Std = 0.4000, ChiSquare = 8.4148e-01 I24 HG13 = 1.84(D), Expected = 1.24, Std = 0.4000, ChiSquare = 1.3361e-01 I24 HD1 = 0.90(D), Expected = 0.70, Std = 0.3000, ChiSquare = 5.0499e-01 I24 N = 130.68(D), Expected = 121.60, Std = 4.7200, ChiSquare = 5.4389e-02 S25 Typing: Mistyped S25 C = 176.50(D), Expected = 174.53, Std = 1.7300, ChiSquare = 2.5482e-01 S25 CA = 63.64(D), Expected = 58.57, Std = 2.1200, ChiSquare = 1.6779e-02 S25 CB = 68.58(D), Expected = 63.80, Std = 1.5700, ChiSquare = 2.3300e-03 S25 H = 8.72(D), Expected = 8.29, Std = 0.6200, ChiSquare = 4.8797e-01 S25 HA = 4.37(D), Expected = 4.51, Std = 0.4300, ChiSquare = 7.4474e-01 S25 HB2 = 4.15(D), Expected = 3.88, Std = 0.2900, ChiSquare = 3.5184e-01 S25 HB3 = 4.22(D), Expected = 3.87, Std = 0.3100, ChiSquare = 2.5888e-01 S25 N = 116.80(D), Expected = 116.30, Std = 3.9500, ChiSquare = 8.9927e-01 G26 C = 175.95(D), Expected = 174.04, Std = 1.9400, ChiSquare = 3.2485e-01 G26 CA = 47.53(D), Expected = 45.33, Std = 1.4200, ChiSquare = 1.2131e-01 G26 H = 8.06(D), Expected = 8.34, Std = 0.7400, ChiSquare = 7.0515e-01 G26 HA2 = 3.82(D), Expected = 3.95, Std = 0.4000, ChiSquare = 7.4518e-01 G26 HA3 = 3.96(D), Expected = 3.93, Std = 0.4000, ChiSquare = 9.4021e-01 G26 N = 109.71(D), Expected = 109.91, Std = 4.2900, ChiSquare = 9.6282e-01 L27 C = 180.07(D), Expected = 176.97, Std = 2.0900, ChiSquare = 1.3801e-01 L27 CA = 58.29(D), Expected = 55.65, Std = 2.2100, ChiSquare = 2.3225e-01 L27 CB = 42.28(D), Expected = 42.37, Std = 1.8600, ChiSquare = 9.6141e-01 L27 CD1 = 26.60(D), Expected = 24.73, Std = 1.7100, ChiSquare = 2.7414e-01 L27 CD2 = 23.69(D), Expected = 24.10, Std = 1.7800, ChiSquare = 8.1783e-01 L27 H = 8.01(D), Expected = 8.22, Std = 0.6500, ChiSquare = 7.4664e-01 L27 HA = 4.29(D), Expected = 4.32, Std = 0.4700, ChiSquare = 9.4911e-01 L27 HB2 = 1.75(D), Expected = 1.63, Std = 0.3400, ChiSquare = 7.2413e-01 L27 HB3 = 2.06(D), Expected = 1.57, Std = 0.3600, ChiSquare = 1.7348e-01 L27 HD1 = 0.90(D), Expected = 0.77, Std = 0.2700, ChiSquare = 6.3017e-01 L27 HD2 = 0.95(D), Expected = 0.76, Std = 0.2800, ChiSquare = 4.9741e-01 L27 N = 124.51(D), Expected = 121.98, Std = 4.0700, ChiSquare = 5.3419e-01 V28 C = 177.48(D), Expected = 175.69, Std = 2.0300, ChiSquare = 3.7790e-01 V28 CA = 67.40(D), Expected = 62.48, Std = 3.0400, ChiSquare = 1.0557e-01 V28 CB = 31.70(D), Expected = 32.66, Std = 1.9100, ChiSquare = 6.1523e-01 V28 CG1 = 23.20(D), Expected = 21.38, Std = 1.5300, ChiSquare = 2.3423e-01 V28 CG2 = 23.69(D), Expected = 21.31, Std = 1.7600, ChiSquare = 1.7629e-01 V28 H = 8.77(D), Expected = 8.29, Std = 0.7100, ChiSquare = 4.9901e-01 V28 HA = 3.57(D), Expected = 4.16, Std = 0.5700, ChiSquare = 3.0063e-01 V28 HB = 2.23(D), Expected = 1.99, Std = 0.3300, ChiSquare = 4.6706e-01 V28 HG1 = 1.05(D), Expected = 0.84, Std = 0.2700, ChiSquare = 4.3670e-01 V28 HG2 = 1.14(D), Expected = 0.83, Std = 0.2900, ChiSquare = 2.8509e-01 V28 N = 119.88(D), Expected = 121.02, Std = 4.9600, ChiSquare = 8.1822e-01 S29 C = 177.86(D), Expected = 174.53, Std = 1.7300, ChiSquare = 5.4248e-02 S29 CA = 63.32(D), Expected = 58.57, Std = 2.1200, ChiSquare = 2.5054e-02 S29 CB = 65.99(D), Expected = 63.80, Std = 1.5700, ChiSquare = 1.6304e-01 S29 H = 9.03(D), Expected = 8.29, Std = 0.6200, ChiSquare = 2.3265e-01 S29 HA = 4.34(D), Expected = 4.51, Std = 0.4300, ChiSquare = 6.9259e-01 S29 HB2 = 4.27(D), Expected = 3.88, Std = 0.2900, ChiSquare = 1.7868e-01 S29 HB3 = 4.27(D), Expected = 3.87, Std = 0.3100, ChiSquare = 1.9694e-01 S29 N = 115.57(D), Expected = 116.30, Std = 3.9500, ChiSquare = 8.5338e-01 T30 C = 176.26(D), Expected = 174.60, Std = 1.8000, ChiSquare = 3.5641e-01 T30 CA = 67.00(D), Expected = 62.15, Std = 2.7200, ChiSquare = 7.4572e-02 T30 CB = 68.86(D), Expected = 69.64, Std = 1.7000, ChiSquare = 6.4636e-01 T30 CG2 = 21.56(D), Expected = 21.44, Std = 1.3900, ChiSquare = 9.3120e-01 T30 H = 8.52(D), Expected = 8.27, Std = 0.6200, ChiSquare = 6.8678e-01 T30 HA = 4.09(D), Expected = 4.48, Std = 0.5000, ChiSquare = 4.3539e-01 T30 HB = 4.38(D), Expected = 4.17, Std = 0.3700, ChiSquare = 5.7033e-01 T30 HG2 = 1.38(D), Expected = 1.16, Std = 0.2800, ChiSquare = 4.3204e-01 T30 N = 117.11(D), Expected = 115.70, Std = 5.0500, ChiSquare = 7.8009e-01 T31 C = 176.96(D), Expected = 174.60, Std = 1.8000, ChiSquare = 1.8982e-01 T31 CA = 66.00(D), Expected = 62.15, Std = 2.7200, ChiSquare = 1.5694e-01 T31 CB = 67.77(D), Expected = 69.64, Std = 1.7000, ChiSquare = 2.7133e-01 T31 CG2 = 21.14(D), Expected = 21.44, Std = 1.3900, ChiSquare = 8.2912e-01 T31 H = 7.89(D), Expected = 8.27, Std = 0.6200, ChiSquare = 5.3994e-01 T31 HA = 4.16(D), Expected = 4.48, Std = 0.5000, ChiSquare = 5.2217e-01 T31 HB = 4.49(D), Expected = 4.17, Std = 0.3700, ChiSquare = 3.8711e-01 T31 HG2 = 1.39(D), Expected = 1.16, Std = 0.2800, ChiSquare = 4.1140e-01 T31 N = 118.65(D), Expected = 115.70, Std = 5.0500, ChiSquare = 5.5911e-01 M32 C = 177.57(D), Expected = 176.30, Std = 2.1300, ChiSquare = 5.5101e-01 M32 CA = 60.72(D), Expected = 56.16, Std = 2.3400, ChiSquare = 5.1329e-02 M32 CB = 33.53(D), Expected = 32.90, Std = 2.2300, ChiSquare = 7.7755e-01 M32 CG = 31.34(D), Expected = 32.07, Std = 1.4500, ChiSquare = 6.1465e-01 M32 CE = 17.86(D), Expected = 17.21, Std = 3.4200, ChiSquare = 8.4926e-01 M32 H = 8.53(D), Expected = 8.26, Std = 0.6000, ChiSquare = 6.5271e-01 M32 HA = 3.98(D), Expected = 4.39, Std = 0.4600, ChiSquare = 3.7277e-01 M32 HB2 = 2.40(D), Expected = 2.03, Std = 0.3800, ChiSquare = 3.3021e-01 M32 HB3 = 2.48(D), Expected = 2.01, Std = 0.3600, ChiSquare = 1.9170e-01 M32 HG2 = 2.99(D), Expected = 2.44, Std = 0.3600, ChiSquare = 1.2657e-01 M32 HG3 = 3.16(D), Expected = 2.41, Std = 0.4000, ChiSquare = 6.0793e-02 M32 HE = 2.10(D), Expected = 1.86, Std = 0.4700, ChiSquare = 6.0960e-01 M32 N = 120.19(D), Expected = 120.10, Std = 3.8800, ChiSquare = 9.8149e-01 Q33 C = 179.07(D), Expected = 176.39, Std = 1.9600, ChiSquare = 1.7152e-01 Q33 CA = 59.16(D), Expected = 56.62, Std = 2.1900, ChiSquare = 2.4612e-01 Q33 CB = 29.23(D), Expected = 29.10, Std = 1.9700, ChiSquare = 9.4739e-01 Q33 H = 8.64(D), Expected = 8.22, Std = 0.6200, ChiSquare = 4.9814e-01 Q33 HA = 4.30(D), Expected = 4.28, Std = 0.4400, ChiSquare = 9.6375e-01 Q33 HB2 = 2.04(D), Expected = 2.05, Std = 0.2800, ChiSquare = 9.7151e-01 Q33 HB3 = 2.26(D), Expected = 2.04, Std = 0.2900, ChiSquare = 4.4808e-01 Q33 HG2 = 2.48(D), Expected = 2.32, Std = 0.2900, ChiSquare = 5.8114e-01 Q33 HG3 = 2.66(D), Expected = 2.32, Std = 0.2900, ChiSquare = 2.4103e-01 Q33 HE21 = 7.01(D), Expected = 7.17, Std = 0.4600, ChiSquare = 7.2797e-01 Q33 HE22 = 7.40(D), Expected = 7.07, Std = 0.4900, ChiSquare = 5.0065e-01 Q33 N = 119.58(D), Expected = 119.92, Std = 4.0100, ChiSquare = 9.3243e-01 Q33 NE2 = 111.69(D), Expected = 111.81, Std = 2.2000, ChiSquare = 9.5650e-01 N34 C = 178.31(D), Expected = 175.16, Std = 1.7600, ChiSquare = 7.3491e-02 N34 CA = 56.97(D), Expected = 53.43, Std = 1.9400, ChiSquare = 6.8040e-02 N34 CB = 37.90(D), Expected = 38.66, Std = 1.7800, ChiSquare = 6.6940e-01 N34 H = 8.55(D), Expected = 8.37, Std = 0.6500, ChiSquare = 7.8184e-01 N34 HA = 4.59(D), Expected = 4.70, Std = 0.3900, ChiSquare = 7.7790e-01 N34 HB2 = 2.99(D), Expected = 2.80, Std = 0.3400, ChiSquare = 5.7628e-01 N34 HB3 = 3.16(D), Expected = 2.78, Std = 0.3400, ChiSquare = 2.6372e-01 N34 HD21 = 7.06(D), Expected = 7.27, Std = 0.5200, ChiSquare = 6.8633e-01 N34 HD22 = 7.85(D), Expected = 7.20, Std = 0.5200, ChiSquare = 2.1130e-01 N34 N = 118.96(D), Expected = 119.13, Std = 4.4200, ChiSquare = 9.6932e-01 N34 ND2 = 112.22(D), Expected = 112.83, Std = 2.6000, ChiSquare = 8.1451e-01 E35 C = 177.99(D), Expected = 176.93, Std = 2.1100, ChiSquare = 6.1541e-01 E35 CA = 58.31(D), Expected = 57.42, Std = 2.1900, ChiSquare = 6.8445e-01 E35 CB = 30.21(D), Expected = 30.07, Std = 1.8400, ChiSquare = 9.3935e-01 E35 H = 8.34(D), Expected = 8.34, Std = 0.6100, ChiSquare = 1.0000e+00 E35 HA = 4.60(D), Expected = 4.26, Std = 0.4300, ChiSquare = 4.2912e-01 E35 N = 122.66(D), Expected = 120.68, Std = 3.6800, ChiSquare = 5.9055e-01 A36 C = 179.00(D), Expected = 177.80, Std = 2.1800, ChiSquare = 5.8200e-01 A36 CA = 55.38(D), Expected = 53.16, Std = 2.0600, ChiSquare = 2.8118e-01 A36 CB = 17.87(D), Expected = 18.90, Std = 1.8500, ChiSquare = 5.7769e-01 A36 H = 8.63(D), Expected = 8.20, Std = 0.6000, ChiSquare = 4.7358e-01 A36 HA = 4.03(D), Expected = 4.26, Std = 0.4200, ChiSquare = 5.8395e-01 A36 HB = 1.62(D), Expected = 1.38, Std = 0.2500, ChiSquare = 3.3706e-01 A36 N = 121.73(D), Expected = 123.23, Std = 3.7000, ChiSquare = 6.8518e-01 R37 C = 179.02(D), Expected = 176.49, Std = 2.1600, ChiSquare = 2.4148e-01 R37 CA = 59.39(D), Expected = 56.95, Std = 2.4100, ChiSquare = 3.1132e-01 R37 CB = 30.25(D), Expected = 30.66, Std = 1.7700, ChiSquare = 8.1682e-01 R37 CG = 27.85(D), Expected = 27.31, Std = 1.6500, ChiSquare = 7.4346e-01 R37 CD = 43.00(D), Expected = 43.10, Std = 1.1000, ChiSquare = 9.2757e-01 R37 H = 7.92(D), Expected = 8.24, Std = 0.6000, ChiSquare = 5.9380e-01 R37 HA = 4.01(D), Expected = 4.27, Std = 0.4400, ChiSquare = 5.5458e-01 R37 HB2 = 2.05(D), Expected = 1.79, Std = 0.2800, ChiSquare = 3.5311e-01 R37 HB3 = 2.05(D), Expected = 1.78, Std = 0.2800, ChiSquare = 3.3490e-01 R37 HG2 = 1.70(D), Expected = 1.58, Std = 0.2700, ChiSquare = 6.5672e-01 R37 HG3 = 1.93(D), Expected = 1.58, Std = 0.2700, ChiSquare = 1.9487e-01 R37 HD2 = 2.98(D), Expected = 3.13, Std = 0.2300, ChiSquare = 5.1429e-01 R37 HD3 = 3.31(D), Expected = 3.13, Std = 0.2200, ChiSquare = 4.1325e-01 R37 N = 116.80(D), Expected = 120.61, Std = 3.9000, ChiSquare = 3.2861e-01 R38 C = 178.90(D), Expected = 176.49, Std = 2.1600, ChiSquare = 2.6453e-01 R38 CA = 59.79(D), Expected = 56.95, Std = 2.4100, ChiSquare = 2.3863e-01 R38 CB = 30.32(D), Expected = 30.66, Std = 1.7700, ChiSquare = 8.4767e-01 R38 CD = 43.85(D), Expected = 43.10, Std = 1.1000, ChiSquare = 4.9535e-01 R38 H = 7.83(D), Expected = 8.24, Std = 0.6000, ChiSquare = 4.9440e-01 R38 HA = 4.10(D), Expected = 4.27, Std = 0.4400, ChiSquare = 6.9923e-01 R38 HB2 = 2.14(D), Expected = 1.79, Std = 0.2800, ChiSquare = 2.1130e-01 R38 HB3 = 2.14(D), Expected = 1.78, Std = 0.2800, ChiSquare = 1.9854e-01 R38 HD2 = 3.31(D), Expected = 3.13, Std = 0.2300, ChiSquare = 4.3386e-01 R38 HD3 = 3.31(D), Expected = 3.13, Std = 0.2200, ChiSquare = 4.1325e-01 R38 N = 121.12(D), Expected = 120.61, Std = 3.9000, ChiSquare = 8.9596e-01 L39 C = 176.81(D), Expected = 176.97, Std = 2.0900, ChiSquare = 9.3898e-01 L39 CA = 57.57(D), Expected = 55.65, Std = 2.2100, ChiSquare = 3.8497e-01 L39 CB = 41.90(D), Expected = 42.37, Std = 1.8600, ChiSquare = 8.0051e-01 L39 CG = 27.28(D), Expected = 26.77, Std = 1.2500, ChiSquare = 6.8327e-01 L39 CD1 = 22.60(D), Expected = 24.73, Std = 1.7100, ChiSquare = 2.1291e-01 L39 CD2 = 25.88(D), Expected = 24.10, Std = 1.7800, ChiSquare = 3.1731e-01 L39 H = 8.41(D), Expected = 8.22, Std = 0.6500, ChiSquare = 7.7005e-01 L39 HA = 3.96(D), Expected = 4.32, Std = 0.4700, ChiSquare = 4.4370e-01 L39 HB2 = 1.11(D), Expected = 1.63, Std = 0.3400, ChiSquare = 1.2616e-01 L39 HB3 = 1.76(D), Expected = 1.57, Std = 0.3600, ChiSquare = 5.9765e-01 L39 HG = 1.69(D), Expected = 1.54, Std = 0.3300, ChiSquare = 6.4944e-01 L39 HD1 = 0.68(D), Expected = 0.77, Std = 0.2700, ChiSquare = 7.3888e-01 L39 HD2 = 0.76(D), Expected = 0.76, Std = 0.2800, ChiSquare = 1.0000e+00 L39 N = 119.27(D), Expected = 121.98, Std = 4.0700, ChiSquare = 5.0551e-01 R40 C = 176.46(D), Expected = 176.49, Std = 2.1600, ChiSquare = 9.8892e-01 R40 CA = 55.75(D), Expected = 56.95, Std = 2.4100, ChiSquare = 6.1854e-01 R40 CB = 33.07(D), Expected = 30.66, Std = 1.7700, ChiSquare = 1.7333e-01 R40 H = 8.29(D), Expected = 8.24, Std = 0.6000, ChiSquare = 9.3359e-01 R40 HA = 4.51(D), Expected = 4.27, Std = 0.4400, ChiSquare = 5.8544e-01 R40 HB2 = 1.88(D), Expected = 1.79, Std = 0.2800, ChiSquare = 7.4789e-01 R40 HB3 = 1.88(D), Expected = 1.78, Std = 0.2800, ChiSquare = 7.2098e-01 R40 HG2 = 1.58(D), Expected = 1.58, Std = 0.2700, ChiSquare = 1.0000e+00 R40 HG3 = 1.58(D), Expected = 1.58, Std = 0.2700, ChiSquare = 1.0000e+00 R40 N = 120.50(D), Expected = 120.61, Std = 3.9000, ChiSquare = 9.7750e-01 A41 C = 178.11(D), Expected = 177.80, Std = 2.1800, ChiSquare = 8.8692e-01 A41 CA = 53.56(D), Expected = 53.16, Std = 2.0600, ChiSquare = 8.4604e-01 A41 CB = 19.78(D), Expected = 18.90, Std = 1.8500, ChiSquare = 6.3431e-01 A41 H = 8.30(D), Expected = 8.20, Std = 0.6000, ChiSquare = 8.6763e-01 A41 HA = 4.34(D), Expected = 4.26, Std = 0.4200, ChiSquare = 8.4894e-01 A41 HB = 1.48(D), Expected = 1.38, Std = 0.2500, ChiSquare = 6.8916e-01 A41 N = 124.82(D), Expected = 123.23, Std = 3.7000, ChiSquare = 6.6739e-01 E42 CA = 57.20(D), Expected = 57.42, Std = 2.1900, ChiSquare = 9.1998e-01 E42 CB = 30.17(D), Expected = 30.07, Std = 1.8400, ChiSquare = 9.5666e-01 E42 CG = 36.44(D), Expected = 36.01, Std = 1.5100, ChiSquare = 7.7582e-01 E42 H = 8.34(D), Expected = 8.34, Std = 0.6100, ChiSquare = 1.0000e+00 E42 HA = 4.33(D), Expected = 4.26, Std = 0.4300, ChiSquare = 8.7068e-01 E42 HB2 = 2.05(D), Expected = 2.04, Std = 0.2200, ChiSquare = 9.6375e-01 E42 HB3 = 2.13(D), Expected = 2.04, Std = 0.2300, ChiSquare = 6.9557e-01 E42 HG2 = 2.34(D), Expected = 2.31, Std = 0.2100, ChiSquare = 8.8640e-01 E42 HG3 = 2.34(D), Expected = 2.31, Std = 0.2100, ChiSquare = 8.8640e-01 E42 N = 119.64(D), Expected = 120.68, Std = 3.6800, ChiSquare = 7.7748e-01 W44 CD1 = 127.10(D), Expected = 126.16, Std = 1.7600, ChiSquare = 5.9328e-01 W44 CE3 = 121.00(D), Expected = 120.38, Std = 1.5000, ChiSquare = 6.7936e-01 W44 CZ2 = 114.58(D), Expected = 114.19, Std = 1.0900, ChiSquare = 7.2049e-01 W44 CZ3 = 121.93(D), Expected = 121.57, Std = 1.7600, ChiSquare = 8.3793e-01 W44 CH2 = 124.59(D), Expected = 123.75, Std = 1.3400, ChiSquare = 5.3075e-01 W44 HD1 = 7.34(D), Expected = 7.16, Std = 0.3400, ChiSquare = 5.9652e-01 W44 HE1 = 10.19(D), Expected = 10.13, Std = 0.5300, ChiSquare = 9.0987e-01 W44 HE3 = 7.65(D), Expected = 7.17, Std = 1.0300, ChiSquare = 6.4120e-01 W44 HZ2 = 7.51(D), Expected = 7.14, Std = 0.8900, ChiSquare = 6.7761e-01 W44 HZ3 = 7.18(D), Expected = 6.68, Std = 1.0200, ChiSquare = 6.2399e-01 W44 HH2 = 7.26(D), Expected = 6.82, Std = 0.9400, ChiSquare = 6.3972e-01 W44 NE1 = 129.20(D), Expected = 129.48, Std = 2.5600, ChiSquare = 9.1291e-01 E54 C = 177.03(D), Expected = 176.93, Std = 2.1100, ChiSquare = 9.6220e-01 E54 CA = 57.27(D), Expected = 57.42, Std = 2.1900, ChiSquare = 9.4539e-01 E54 CB = 30.13(D), Expected = 30.07, Std = 1.8400, ChiSquare = 9.7399e-01 E54 HB2 = 3.44(M), Expected = 2.04, Std = 0.2200, ChiSquare = 1.9703e-10 E54 HB3 = 3.44(M), Expected = 2.04, Std = 0.2300, ChiSquare = 1.1508e-09 E54 HG2 = 3.06(S), Expected = 2.31, Std = 0.2100, ChiSquare = 3.5504e-04 E54 HG3 = 3.06(S), Expected = 2.31, Std = 0.2100, ChiSquare = 3.5504e-04 V55 C = 176.20(D), Expected = 175.69, Std = 2.0300, ChiSquare = 8.0164e-01 V55 CA = 63.03(D), Expected = 62.48, Std = 3.0400, ChiSquare = 8.5643e-01 V55 CB = 32.91(D), Expected = 32.66, Std = 1.9100, ChiSquare = 8.9586e-01 V55 H = 7.98(D), Expected = 8.29, Std = 0.7100, ChiSquare = 6.6239e-01 V55 HA = 4.08(D), Expected = 4.16, Std = 0.5700, ChiSquare = 8.8838e-01 V55 HB = 2.16(D), Expected = 1.99, Std = 0.3300, ChiSquare = 6.0645e-01 V55 HG1 = 1.00(D), Expected = 0.84, Std = 0.2700, ChiSquare = 5.5345e-01 V55 HG2 = 1.01(D), Expected = 0.83, Std = 0.2900, ChiSquare = 5.3480e-01 V55 N = 120.50(D), Expected = 121.02, Std = 4.9600, ChiSquare = 9.1650e-01 A56 C = 178.03(D), Expected = 177.80, Std = 2.1800, ChiSquare = 9.1598e-01 A56 CA = 53.54(D), Expected = 53.16, Std = 2.0600, ChiSquare = 8.5365e-01 A56 CB = 19.47(D), Expected = 18.90, Std = 1.8500, ChiSquare = 7.5800e-01 A56 H = 8.21(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.8670e-01 A56 HA = 4.29(D), Expected = 4.26, Std = 0.4200, ChiSquare = 9.4306e-01 A56 HB = 1.45(D), Expected = 1.38, Std = 0.2500, ChiSquare = 7.7948e-01 A56 N = 125.63(D), Expected = 123.23, Std = 3.7000, ChiSquare = 5.1657e-01 R57 CA = 56.74(D), Expected = 56.95, Std = 2.4100, ChiSquare = 9.3056e-01 R57 CB = 30.82(D), Expected = 30.66, Std = 1.7700, ChiSquare = 9.2797e-01 R57 H = 8.03(D), Expected = 8.24, Std = 0.6000, ChiSquare = 7.2634e-01 R57 HA = 4.29(D), Expected = 4.27, Std = 0.4400, ChiSquare = 9.6375e-01 R57 N = 119.27(D), Expected = 120.61, Std = 3.9000, ChiSquare = 7.3115e-01 F58 C = 176.01(D), Expected = 175.49, Std = 2.1300, ChiSquare = 8.0713e-01 F58 HD1 = 7.28(D), Expected = 6.91, Std = 0.8200, ChiSquare = 6.5183e-01 F58 HD2 = 7.28(D), Expected = 6.89, Std = 0.8600, ChiSquare = 6.5020e-01 F58 HE1 = 7.38(D), Expected = 6.95, Std = 0.8200, ChiSquare = 6.0001e-01 F58 HE2 = 7.38(D), Expected = 6.94, Std = 0.8600, ChiSquare = 6.0891e-01 I59 C = 176.27(D), Expected = 175.82, Std = 1.9500, ChiSquare = 8.1749e-01 I59 CA = 61.57(D), Expected = 61.59, Std = 2.7800, ChiSquare = 9.9426e-01 I59 CB = 39.16(D), Expected = 38.58, Std = 2.0900, ChiSquare = 7.8139e-01 I59 H = 8.00(D), Expected = 8.26, Std = 0.7100, ChiSquare = 7.1422e-01 I59 HA = 4.08(D), Expected = 4.20, Std = 0.5600, ChiSquare = 8.3032e-01 I59 N = 122.04(D), Expected = 121.60, Std = 4.7200, ChiSquare = 9.2573e-01 E60 H = 8.30(D), Expected = 8.34, Std = 0.6100, ChiSquare = 9.4772e-01 E60 N = 123.58(D), Expected = 120.68, Std = 3.6800, ChiSquare = 4.3067e-01 N62 C = 175.71(D), Expected = 175.16, Std = 1.7600, ChiSquare = 7.5466e-01 G63 C = 174.03(D), Expected = 174.04, Std = 1.9400, ChiSquare = 9.9589e-01 G63 CA = 45.59(D), Expected = 45.33, Std = 1.4200, ChiSquare = 8.5472e-01 G63 H = 8.34(D), Expected = 8.34, Std = 0.7400, ChiSquare = 1.0000e+00 G63 HA2 = 4.00(D), Expected = 3.95, Std = 0.4000, ChiSquare = 9.0052e-01 G63 HA3 = 4.00(D), Expected = 3.93, Std = 0.4000, ChiSquare = 8.6108e-01 G63 N = 109.09(D), Expected = 109.91, Std = 4.2900, ChiSquare = 8.4841e-01 S64 C = 174.13(D), Expected = 174.53, Std = 1.7300, ChiSquare = 8.1715e-01 S64 CA = 58.29(D), Expected = 58.57, Std = 2.1200, ChiSquare = 8.9492e-01 S64 CB = 63.93(D), Expected = 63.80, Std = 1.5700, ChiSquare = 9.3401e-01 S64 H = 8.12(D), Expected = 8.29, Std = 0.6200, ChiSquare = 7.8394e-01 S64 N = 115.26(D), Expected = 116.30, Std = 3.9500, ChiSquare = 7.9233e-01 F65 C = 175.58(D), Expected = 175.49, Std = 2.1300, ChiSquare = 9.6630e-01 F65 CA = 57.57(D), Expected = 58.25, Std = 2.7300, ChiSquare = 8.0330e-01 F65 CB = 39.57(D), Expected = 39.95, Std = 2.0400, ChiSquare = 8.5223e-01 F65 H = 8.25(D), Expected = 8.42, Std = 0.7400, ChiSquare = 8.1830e-01 F65 N = 121.73(D), Expected = 120.69, Std = 4.1800, ChiSquare = 8.0351e-01 A66 C = 177.22(D), Expected = 177.80, Std = 2.1800, ChiSquare = 7.9020e-01 A66 CA = 52.83(D), Expected = 53.16, Std = 2.0600, ChiSquare = 8.7273e-01 A66 CB = 19.47(D), Expected = 18.90, Std = 1.8500, ChiSquare = 7.5800e-01 A66 H = 8.20(D), Expected = 8.20, Std = 0.6000, ChiSquare = 1.0000e+00 A66 HA = 4.35(D), Expected = 4.26, Std = 0.4200, ChiSquare = 8.3032e-01 A66 HB = 1.41(D), Expected = 1.38, Std = 0.2500, ChiSquare = 9.0448e-01 A66 N = 124.82(D), Expected = 123.23, Std = 3.7000, ChiSquare = 6.6739e-01 D67 CA = 54.29(D), Expected = 54.52, Std = 2.1000, ChiSquare = 9.1279e-01 D67 CB = 41.35(D), Expected = 40.70, Std = 1.6700, ChiSquare = 6.9711e-01 D67 H = 8.17(D), Expected = 8.33, Std = 0.5700, ChiSquare = 7.7894e-01 D67 HA = 4.62(D), Expected = 4.61, Std = 0.3100, ChiSquare = 9.7427e-01 D67 HB2 = 2.68(D), Expected = 2.74, Std = 0.2900, ChiSquare = 8.3609e-01 D67 HB3 = 2.68(D), Expected = 2.70, Std = 0.2900, ChiSquare = 9.4502e-01 D67 N = 119.58(D), Expected = 120.73, Std = 4.2000, ChiSquare = 7.8423e-01