Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.S1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.T2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.E3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.A4 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S5 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.A6 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.R7 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.P8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.75 C 0.06 L 0.05 R 0.03 H 0.02 Q 0.02 W 0.01 K 0.01 C Shift Assignments>> CG :: 27.77(D) CD :: 50.89(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) 1.L9 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> L 0.32 R 0.31 D 0.09 G 0.06 F 0.05 C 0.05 K 0.04 Y 0.03 C Shift Assignments>> C :: 175.81(D) CA :: 55.47(D) CB :: 43.51(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) N Shift Assignments>> N :: 122.69(D) Ave N Shift Values>> N :: 121.86(3.9) 1.R10 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> H 0.2 R 0.19 C 0.17 W 0.12 K 0.11 Q 0.1 E 0.09 C Shift Assignments>> C :: 175.67(D) CA :: 54.01(D) CB :: 31.22(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) N Shift Assignments>> N :: 122.39(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.V11 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> V 0.89 C 0.1 C Shift Assignments>> C :: 177.62(D) CA :: 66.35(D) CB :: 31.16(D) CG1 :: 22.95(D) CG2 :: 21.62(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) N Shift Assignments>> N :: 121.61(D) Ave N Shift Values>> N :: 121.14(4.54) 1.G12 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> G 0.82 L 0.1 C 0.03 R 0.01 F 0.01 C Shift Assignments>> C :: 174.61(D) CA :: 45.23(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) N Shift Assignments>> N :: 117.22(D) Ave N Shift Values>> N :: 109.67(3.87) 1.S13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 173.27(D) CA :: 61.84(D) CB :: 63.83(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) N Shift Assignments>> N :: 119.06(D) Ave N Shift Values>> N :: 116.28(3.52) 1.R14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.55 K 0.21 R 0.19 L 0.03 C Shift Assignments>> C :: 176.27(D) CA :: 53.17(D) CB :: 29.53(D) CG :: 28.03(D) CD :: 41.27(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) N Shift Assignments>> N :: 125.45(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.V15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.87 I 0.06 A 0.05 C Shift Assignments>> C :: 174.33(D) CA :: 58.11(D) CB :: 37.80(D) CG1 :: 23.18(D) CG2 :: 18.23(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) N Shift Assignments>> N :: 112.33(D) Ave N Shift Values>> N :: 121.14(4.54) 1.E16 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> Q 0.3 C 0.29 K 0.19 H 0.05 R 0.05 W 0.02 N 0.02 Y 0.01 C Shift Assignments>> C :: 176.09(D) CA :: 53.82(D) CB :: 34.26(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) N Shift Assignments>> N :: 118.46(D) Ave N Shift Values>> N :: 120.67(3.48) 1.V17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> V 0.73 C 0.26 C Shift Assignments>> C :: 176.18(D) CA :: 63.16(D) CB :: 32.06(D) CG1 :: 22.18(D) CG2 :: 21.14(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) N Shift Assignments>> N :: 124.99(D) Ave N Shift Values>> N :: 121.14(4.54) 1.I18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> I 0.82 C 0.17 C Shift Assignments>> C :: 178.30(D) CA :: 64.23(D) CB :: 38.38(D) CG1 :: 29.15(D) CG2 :: 17.12(D) CD1 :: 14.11(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) N Shift Assignments>> N :: 132.31(D) Ave N Shift Values>> N :: 121.46(4.28) 1.G19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> G 0.87 L 0.07 C 0.03 C Shift Assignments>> C :: 174.61(D) CA :: 45.66(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) N Shift Assignments>> N :: 117.58(D) Ave N Shift Values>> N :: 109.67(3.87) 1.K20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.26 Q 0.24 K 0.18 E 0.14 H 0.03 R 0.03 Y 0.02 W 0.01 V 0.01 N 0.01 F 0.01 C Shift Assignments>> C :: 177.59(D) CA :: 55.80(D) CB :: 34.73(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) N Shift Assignments>> N :: 116.97(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.G21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> G 0.87 L 0.07 C 0.03 C Shift Assignments>> C :: 173.86(D) CA :: 45.82(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) N Shift Assignments>> N :: 105.71(D) Ave N Shift Values>> N :: 109.67(3.87) 1.H22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.41 W 0.34 H 0.23 C Shift Assignments>> C :: 175.51(D) CA :: 55.26(D) CB :: 32.21(D) CG :: 136.07(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) N Shift Assignments>> N :: 116.73(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.R23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> K 0.33 Q 0.25 C 0.25 R 0.15 C Shift Assignments>> C :: 177.59(D) CA :: 55.23(D) CB :: 32.60(D) CG :: 28.66(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) N Shift Assignments>> N :: 122.83(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.G24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> G 0.84 C 0.07 L 0.04 A 0.01 P 0.01 C Shift Assignments>> C :: 171.07(D) CA :: 47.25(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) N Shift Assignments>> N :: 107.51(D) Ave N Shift Values>> N :: 109.67(3.87) 1.T25 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> T 0.63 C 0.36 C Shift Assignments>> C :: 174.66(D) CA :: 60.65(D) CB :: 71.40(D) CG2 :: 22.96(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) N Shift Assignments>> N :: 116.95(D) Ave N Shift Values>> N :: 115.42(4.75) 1.V26 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> V 0.55 C 0.44 C Shift Assignments>> C :: 176.01(D) CA :: 65.22(D) CB :: 31.67(D) CG1 :: 24.24(D) CG2 :: 23.16(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) N Shift Assignments>> N :: 127.88(D) Ave N Shift Values>> N :: 121.14(4.54) 1.A27 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> A 0.61 L 0.27 C 0.09 C Shift Assignments>> C :: 176.28(D) CA :: 51.69(D) CB :: 22.01(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) N Shift Assignments>> N :: 131.89(D) Ave N Shift Values>> N :: 123.23(3.54) 1.Y28 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> F 0.37 Y 0.23 C 0.21 G 0.17 C Shift Assignments>> C :: 173.21(D) CA :: 58.72(D) CB :: 43.41(D) CG :: 128.65(D) CD1 :: 132.25(D) CD2 :: 135.11(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) N Shift Assignments>> N :: 120.22(D) Ave N Shift Values>> N :: 120.52(4.2) 1.V29 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.51 V 0.47 C Shift Assignments>> C :: 174.75(D) CA :: 61.82(D) CB :: 35.54(D) CG1 :: 21.72(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) N Shift Assignments>> N :: 128.29(D) Ave N Shift Values>> N :: 121.14(4.54) 1.G30 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> G 0.85 L 0.08 C 0.02 C Shift Assignments>> C :: 172.10(D) CA :: 45.39(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) N Shift Assignments>> N :: 113.20(D) Ave N Shift Values>> N :: 109.67(3.87) 1.A31 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> A 0.92 L 0.03 C 0.03 C Shift Assignments>> C :: 178.70(D) CA :: 51.84(D) CB :: 20.53(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) N Shift Assignments>> N :: 123.77(D) Ave N Shift Values>> N :: 123.23(3.54) 1.T32 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> T 0.51 C 0.48 C Shift Assignments>> C :: 173.50(D) CA :: 59.60(D) CB :: 72.52(D) CG2 :: 22.23(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) N Shift Assignments>> N :: 112.42(D) Ave N Shift Values>> N :: 115.42(4.75) 1.L33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> L 0.39 K 0.21 C 0.19 R 0.17 I 0.01 C Shift Assignments>> C :: 177.80(D) CA :: 54.73(D) CB :: 41.83(D) CG :: 27.62(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) N Shift Assignments>> N :: 113.03(D) Ave N Shift Values>> N :: 121.86(3.9) 1.F34 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> F 0.46 C 0.26 Y 0.26 C Shift Assignments>> C :: 174.56(D) CA :: 56.37(D) CB :: 38.73(D) CG :: 138.03(D) CD1 :: 132.35(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) N Shift Assignments>> N :: 111.44(D) Ave N Shift Values>> N :: 120.45(4.18) 1.A35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> L 0.48 A 0.34 C 0.12 K 0.03 C Shift Assignments>> C :: 176.33(D) CA :: 52.14(D) CB :: 22.59(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) N Shift Assignments>> N :: 123.08(D) Ave N Shift Values>> N :: 123.23(3.54) 1.T36 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> T 0.86 C 0.13 C Shift Assignments>> C :: 176.64(D) CA :: 62.18(D) CB :: 71.07(D) CG2 :: 22.31(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) N Shift Assignments>> N :: 110.25(D) Ave N Shift Values>> N :: 115.42(4.75) 1.G37 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> G 0.84 L 0.09 C 0.02 R 0.01 C Shift Assignments>> C :: 172.50(D) CA :: 45.33(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) N Shift Assignments>> N :: 109.16(D) Ave N Shift Values>> N :: 109.67(3.87) 1.K38 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.39 K 0.39 Q 0.1 R 0.08 C Shift Assignments>> C :: 176.60(D) CA :: 57.03(D) CB :: 33.73(D) CG :: 25.53(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) N Shift Assignments>> N :: 121.46(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.W39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.74 W 0.23 H 0.01 C Shift Assignments>> C :: 173.96(D) CA :: 56.86(D) CB :: 34.23(D) CG :: 111.89(D) CD1 :: 127.07(D) Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) N Shift Assignments>> N :: 130.11(D) Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.V40 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.57 V 0.42 C Shift Assignments>> C :: 176.43(D) CA :: 61.01(D) CB :: 33.41(D) CG1 :: 23.75(D) CG2 :: 20.82(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) N Shift Assignments>> N :: 119.65(D) Ave N Shift Values>> N :: 121.14(4.54) 1.G41 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> G 0.87 L 0.07 C 0.03 C Shift Assignments>> C :: 172.33(D) CA :: 45.88(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) N Shift Assignments>> N :: 115.70(D) Ave N Shift Values>> N :: 109.67(3.87) 1.V42 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.55 V 0.44 C Shift Assignments>> C :: 173.36(D) CA :: 60.72(D) CB :: 35.12(D) CG1 :: 22.69(D) CG2 :: 21.68(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) N Shift Assignments>> N :: 128.40(D) Ave N Shift Values>> N :: 121.14(4.54) 1.I43 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> I 0.6 C 0.39 C Shift Assignments>> C :: 177.79(D) CA :: 60.63(D) CB :: 38.88(D) CG1 :: 28.36(D) CG2 :: 17.95(D) CD1 :: 14.77(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) N Shift Assignments>> N :: 124.69(D) Ave N Shift Values>> N :: 121.46(4.28) 1.L44 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> L 0.52 C 0.35 A 0.06 K 0.04 C Shift Assignments>> C :: 177.92(D) CA :: 55.61(D) CB :: 41.67(D) CG :: 26.93(D) CD1 :: 22.39(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) N Shift Assignments>> N :: 133.06(D) Ave N Shift Values>> N :: 121.86(3.9) 1.D45 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> D 0.52 C 0.45 N 0.01 C Shift Assignments>> C :: 177.87(D) CA :: 57.44(D) CB :: 40.08(D) CG :: 180.07(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) N Shift Assignments>> N :: 125.11(D) Ave N Shift Values>> N :: 120.65(3.86) 1.E46 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.59 D 0.16 E 0.13 N 0.1 C Shift Assignments>> C :: 176.81(D) CA :: 54.38(D) CB :: 32.96(D) CG :: 37.16(D) CD :: 179.98(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) N Shift Assignments>> N :: 118.09(D) Ave N Shift Values>> N :: 120.67(3.48) 1.A47 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> A 0.98 C 0.01 C Shift Assignments>> C :: 178.01(D) CA :: 51.11(D) CB :: 15.75(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) N Shift Assignments>> N :: 125.05(D) Ave N Shift Values>> N :: 123.23(3.54) 1.K48 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> K 0.43 C 0.35 R 0.1 Q 0.1 C Shift Assignments>> C :: 176.33(D) CA :: 53.79(D) CB :: 33.38(D) CG :: 25.47(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) N Shift Assignments>> N :: 122.67(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.G49 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> G 0.46 L 0.25 R 0.14 C 0.04 F 0.03 D 0.02 Y 0.01 C Shift Assignments>> C :: 172.93(D) CA :: 44.41(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) N Shift Assignments>> N :: 109.20(D) Ave N Shift Values>> N :: 109.67(3.87) 1.K50 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.5 R 0.3 K 0.15 G 0.02 C Shift Assignments>> C :: 175.84(D) CA :: 56.19(D) CB :: 37.24(D) CG :: 25.34(D) CD :: 29.10(D) CE :: 42.46(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) N Shift Assignments>> N :: 116.29(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.N51 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> D 0.36 N 0.19 L 0.18 F 0.07 Y 0.05 C 0.05 K 0.05 C Shift Assignments>> C :: 173.42(D) CA :: 53.43(D) CB :: 40.82(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) N Shift Assignments>> N :: 117.30(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.D52 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> D 0.76 C 0.22 C Shift Assignments>> C :: 178.13(D) CA :: 53.13(D) CB :: 41.00(D) CG :: 182.03(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) N Shift Assignments>> N :: 119.00(D) Ave N Shift Values>> N :: 120.65(3.86) 1.G53 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> R 0.39 L 0.29 G 0.08 D 0.06 F 0.05 C 0.03 Y 0.02 K 0.02 C Shift Assignments>> C :: 174.38(D) CA :: 43.47(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) N Shift Assignments>> N :: 110.99(D) Ave N Shift Values>> N :: 109.67(3.87) 1.T54 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> T 0.89 C 0.1 C Shift Assignments>> C :: 174.69(D) CA :: 61.61(D) CB :: 69.35(D) CG2 :: 20.22(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) N Shift Assignments>> N :: 118.00(D) Ave N Shift Values>> N :: 115.42(4.75) 1.V55 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.59 V 0.4 C Shift Assignments>> C :: 176.84(D) CA :: 61.71(D) CB :: 36.43(D) CG1 :: 22.20(D) CG2 :: 21.52(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) N Shift Assignments>> N :: 123.29(D) Ave N Shift Values>> N :: 121.14(4.54) 1.Q56 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.9 Q 0.07 N 0.02 C Shift Assignments>> C :: 176.11(D) CA :: 56.88(D) CB :: 26.98(D) CG :: 34.39(D) CD :: 176.31(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) N Shift Assignments>> N :: 130.21(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.G57 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> G 0.87 L 0.07 C 0.03 C Shift Assignments>> C :: 173.01(D) CA :: 45.72(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) N Shift Assignments>> N :: 103.65(D) Ave N Shift Values>> N :: 109.67(3.87) 1.R58 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> H 0.2 R 0.18 C 0.16 Q 0.13 W 0.13 E 0.09 K 0.07 C Shift Assignments>> C :: 172.85(D) CA :: 53.84(D) CB :: 30.63(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) N Shift Assignments>> N :: 122.07(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.K59 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> K 0.52 C 0.46 C Shift Assignments>> C :: 176.04(D) CA :: 56.55(D) CB :: 32.72(D) CG :: 24.45(D) CD :: 29.48(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) N Shift Assignments>> N :: 128.26(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.Y60 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> I 0.33 Y 0.24 F 0.23 C 0.16 C Shift Assignments>> C :: 175.16(D) CA :: 60.53(D) CB :: 39.42(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) N Shift Assignments>> N :: 127.69(D) Ave N Shift Values>> N :: 120.52(4.2) 1.F61 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> Y 0.23 F 0.21 C 0.15 N 0.14 D 0.12 L 0.05 I 0.03 E 0.02 C Shift Assignments>> C :: 172.50(D) CA :: 56.04(D) CB :: 38.79(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) N Shift Assignments>> N :: 114.21(D) Ave N Shift Values>> N :: 120.45(4.18) 1.T62 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> T 0.91 C 0.08 C Shift Assignments>> C :: 172.78(D) CA :: 62.82(D) CB :: 71.34(D) CG2 :: 21.53(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) N Shift Assignments>> N :: 115.34(D) Ave N Shift Values>> N :: 115.42(4.75) 1.C63 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> K 0.21 C 0.19 R 0.15 H 0.13 W 0.1 Q 0.1 E 0.08 V 0.02 C Shift Assignments>> C :: 172.33(D) CA :: 56.21(D) CB :: 32.33(D) Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) N Shift Assignments>> N :: 120.70(D) Ave N Shift Values>> N :: 120.17(4.64) 1.D64 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> D 0.28 L 0.23 K 0.13 F 0.1 Y 0.07 N 0.07 C 0.05 R 0.02 C Shift Assignments>> C :: 176.72(D) CA :: 54.71(D) CB :: 41.31(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) N Shift Assignments>> N :: 118.44(D) Ave N Shift Values>> N :: 120.65(3.86) 1.E65 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> E 0.5 C 0.49 C Shift Assignments>> C :: 177.91(D) CA :: 58.43(D) CB :: 29.94(D) CG :: 36.05(D) CD :: 183.77(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) N Shift Assignments>> N :: 121.23(D) Ave N Shift Values>> N :: 120.67(3.48) 1.G66 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> G 0.86 L 0.08 C 0.02 C Shift Assignments>> C :: 174.55(D) CA :: 45.51(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) N Shift Assignments>> N :: 112.19(D) Ave N Shift Values>> N :: 109.67(3.87) 1.H67 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> H 0.37 W 0.31 C 0.3 C Shift Assignments>> C :: 174.19(D) CA :: 56.66(D) CB :: 29.48(D) CG :: 132.53(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) N Shift Assignments>> N :: 113.93(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.G68 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> G 0.87 L 0.07 C 0.03 C Shift Assignments>> C :: 174.58(D) CA :: 45.66(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) N Shift Assignments>> N :: 112.30(D) Ave N Shift Values>> N :: 109.67(3.87) 1.I69 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.59 G 0.28 I 0.12 C Shift Assignments>> C :: 172.70(D) CA :: 60.61(D) CB :: 43.82(D) CG1 :: 27.21(D) CG2 :: 19.17(D) CD1 :: 14.80(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) N Shift Assignments>> N :: 118.46(D) Ave N Shift Values>> N :: 121.46(4.28) 1.F70 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> K 0.23 F 0.16 R 0.16 L 0.15 Y 0.11 C 0.07 D 0.05 I 0.02 C Shift Assignments>> C :: 175.78(D) CA :: 58.04(D) CB :: 42.31(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) N Shift Assignments>> N :: 122.47(D) Ave N Shift Values>> N :: 120.45(4.18) 1.V71 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.87 I 0.08 V 0.02 A 0.01 C Shift Assignments>> C :: 175.69(D) CA :: 59.08(D) CB :: 37.05(D) CG1 :: 23.66(D) CG2 :: 19.04(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) N Shift Assignments>> N :: 114.84(D) Ave N Shift Values>> N :: 121.14(4.54) 1.R72 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> K 0.44 C 0.31 R 0.22 G 0.01 C Shift Assignments>> C :: 179.07(D) CA :: 53.42(D) CB :: 31.66(D) CG :: 25.51(D) CD :: 42.25(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) N Shift Assignments>> N :: 117.65(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.Q73 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.57 Q 0.38 E 0.04 C Shift Assignments>> C :: 176.70(D) CA :: 59.72(D) CB :: 28.07(D) CG :: 34.04(D) CD :: 179.18(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) N Shift Assignments>> N :: 122.57(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.S74 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 175.94(D) CA :: 59.66(D) CB :: 62.87(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) N Shift Assignments>> N :: 109.71(D) Ave N Shift Values>> N :: 116.28(3.52) 1.Q75 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.49 E 0.45 Q 0.02 I 0.01 K 0.01 C Shift Assignments>> C :: 176.09(D) CA :: 56.76(D) CB :: 31.42(D) CG :: 36.65(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) N Shift Assignments>> N :: 117.98(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.I76 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.57 G 0.24 L 0.14 A 0.02 C Shift Assignments>> C :: 173.85(D) CA :: 58.43(D) CB :: 43.63(D) CG1 :: 25.02(D) CG2 :: 20.18(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) N Shift Assignments>> N :: 112.97(D) Ave N Shift Values>> N :: 121.46(4.28) 1.Q77 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> C 0.35 K 0.28 H 0.11 R 0.1 W 0.05 E 0.02 Q 0.02 C Shift Assignments>> C :: 175.00(D) CA :: 53.80(D) CB :: 33.62(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) N Shift Assignments>> N :: 118.57(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.V78 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> V 0.73 C 0.26 C Shift Assignments>> C :: 176.00(D) CA :: 63.04(D) CB :: 32.58(D) CG1 :: 21.18(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) N Shift Assignments>> N :: 126.73(D) Ave N Shift Values>> N :: 121.14(4.54) 1.F79 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Duplicate PRTL>> F 0.28 Y 0.26 C 0.12 D 0.1 L 0.1 I 0.06 N 0.02 K 0.02 C Shift Assignments>> CA :: 57.36(D) CB :: 40.08(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) N Shift Assignments>> N :: 124.97(D) Ave N Shift Values>> N :: 120.45(4.18) 1.E80 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.D81 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G82 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.A83 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.D84 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.T85 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.T86 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S87 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.P88 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.E89 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable ########################################################################### Overall Results: #Consistent: 17 #Clerical: 72 #Suspicious: 0 #Anomalous: 0 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 72 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 17 Shift Relative Order (SRO) Results: #Consistent: 89 #Suspicious: 0 C Shift Results: #Consistent: 0 #Duplicate: 271 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 0 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 N Shift Results: #Consistent: 0 #Duplicate: 71 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.P8 CG = 27.77(D), Expected = 27.17, Std = 1.0900, ChiSquare = 5.8200e-01 1.P8 CD = 50.89(D), Expected = 50.32, Std = 0.9900, ChiSquare = 5.6478e-01 1.L9 C = 175.81(D), Expected = 176.99, Std = 1.9800, ChiSquare = 5.5120e-01 1.L9 CA = 55.47(D), Expected = 55.62, Std = 2.1300, ChiSquare = 9.4386e-01 1.L9 CB = 43.51(D), Expected = 42.31, Std = 1.8800, ChiSquare = 5.2328e-01 1.L9 N = 122.69(D), Expected = 121.86, Std = 3.9000, ChiSquare = 8.3147e-01 1.R10 C = 175.67(D), Expected = 176.41, Std = 2.0300, ChiSquare = 7.1546e-01 1.R10 CA = 54.01(D), Expected = 56.77, Std = 2.3100, ChiSquare = 2.3216e-01 1.R10 CB = 31.22(D), Expected = 30.70, Std = 1.8300, ChiSquare = 7.7629e-01 1.R10 N = 122.39(D), Expected = 120.80, Std = 3.6800, ChiSquare = 6.6569e-01 1.V11 C = 177.62(D), Expected = 175.62, Std = 1.9000, ChiSquare = 2.9251e-01 1.V11 CA = 66.35(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.7713e-01 1.V11 CB = 31.16(D), Expected = 32.73, Std = 1.7900, ChiSquare = 3.8044e-01 1.V11 CG1 = 22.95(D), Expected = 21.49, Std = 1.3600, ChiSquare = 2.8303e-01 1.V11 CG2 = 21.62(D), Expected = 21.26, Std = 1.5600, ChiSquare = 8.1749e-01 1.V11 N = 121.61(D), Expected = 121.14, Std = 4.5400, ChiSquare = 9.1755e-01 1.G12 C = 174.61(D), Expected = 173.87, Std = 1.8800, ChiSquare = 6.9386e-01 1.G12 CA = 45.23(D), Expected = 45.35, Std = 1.3400, ChiSquare = 9.2864e-01 1.G12 N = 117.22(D), Expected = 109.67, Std = 3.8700, ChiSquare = 5.1068e-02 1.S13 C = 173.27(D), Expected = 174.62, Std = 1.7200, ChiSquare = 4.3252e-01 1.S13 CA = 61.84(D), Expected = 58.72, Std = 2.0700, ChiSquare = 1.3175e-01 1.S13 CB = 63.83(D), Expected = 63.80, Std = 1.4800, ChiSquare = 9.8383e-01 1.S13 N = 119.06(D), Expected = 116.28, Std = 3.5200, ChiSquare = 4.2966e-01 1.R14 C = 176.27(D), Expected = 176.41, Std = 2.0300, ChiSquare = 9.4502e-01 1.R14 CA = 53.17(D), Expected = 56.77, Std = 2.3100, ChiSquare = 1.1913e-01 1.R14 CB = 29.53(D), Expected = 30.70, Std = 1.8300, ChiSquare = 5.2260e-01 1.R14 CG = 28.03(D), Expected = 27.21, Std = 1.2000, ChiSquare = 4.9440e-01 1.R14 CD = 41.27(D), Expected = 43.16, Std = 0.8800, ChiSquare = 3.1735e-02 1.R14 N = 125.45(D), Expected = 120.80, Std = 3.6800, ChiSquare = 2.0638e-01 1.V15 C = 174.33(D), Expected = 175.62, Std = 1.9000, ChiSquare = 4.9717e-01 1.V15 CA = 58.11(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.2565e-01 1.V15 CB = 37.80(D), Expected = 32.73, Std = 1.7900, ChiSquare = 4.6200e-03 1.V15 CG1 = 23.18(D), Expected = 21.49, Std = 1.3600, ChiSquare = 2.1400e-01 1.V15 CG2 = 18.23(D), Expected = 21.26, Std = 1.5600, ChiSquare = 5.2100e-02 1.V15 N = 112.33(D), Expected = 121.14, Std = 4.5400, ChiSquare = 5.2316e-02 1.E16 C = 176.09(D), Expected = 176.87, Std = 1.9500, ChiSquare = 6.8916e-01 1.E16 CA = 53.82(D), Expected = 57.32, Std = 2.0900, ChiSquare = 9.4005e-02 1.E16 CB = 34.26(D), Expected = 30.01, Std = 1.7200, ChiSquare = 1.3476e-02 1.E16 N = 118.46(D), Expected = 120.67, Std = 3.4800, ChiSquare = 5.2539e-01 1.V17 C = 176.18(D), Expected = 175.62, Std = 1.9000, ChiSquare = 7.6819e-01 1.V17 CA = 63.16(D), Expected = 62.49, Std = 2.8600, ChiSquare = 8.1478e-01 1.V17 CB = 32.06(D), Expected = 32.73, Std = 1.7900, ChiSquare = 7.0818e-01 1.V17 CG1 = 22.18(D), Expected = 21.49, Std = 1.3600, ChiSquare = 6.1191e-01 1.V17 CG2 = 21.14(D), Expected = 21.26, Std = 1.5600, ChiSquare = 9.3868e-01 1.V17 N = 124.99(D), Expected = 121.14, Std = 4.5400, ChiSquare = 3.9643e-01 1.I18 C = 178.30(D), Expected = 175.85, Std = 1.9200, ChiSquare = 2.0194e-01 1.I18 CA = 64.23(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.2827e-01 1.I18 CB = 38.38(D), Expected = 38.63, Std = 2.0200, ChiSquare = 9.0150e-01 1.I18 CG1 = 29.15(D), Expected = 27.71, Std = 1.6800, ChiSquare = 3.9137e-01 1.I18 CG2 = 17.12(D), Expected = 17.53, Std = 1.3600, ChiSquare = 7.6306e-01 1.I18 CD1 = 14.11(D), Expected = 13.43, Std = 1.6700, ChiSquare = 6.8387e-01 1.I18 N = 132.31(D), Expected = 121.46, Std = 4.2800, ChiSquare = 1.1243e-02 1.G19 C = 174.61(D), Expected = 173.87, Std = 1.8800, ChiSquare = 6.9386e-01 1.G19 CA = 45.66(D), Expected = 45.35, Std = 1.3400, ChiSquare = 8.1705e-01 1.G19 N = 117.58(D), Expected = 109.67, Std = 3.8700, ChiSquare = 4.0961e-02 1.K20 C = 177.59(D), Expected = 176.64, Std = 2.0000, ChiSquare = 6.3479e-01 1.K20 CA = 55.80(D), Expected = 56.95, Std = 2.2000, ChiSquare = 6.0116e-01 1.K20 CB = 34.73(D), Expected = 32.79, Std = 1.7800, ChiSquare = 2.7576e-01 1.K20 N = 116.97(D), Expected = 121.05, Std = 3.7700, ChiSquare = 2.7915e-01 1.G21 C = 173.86(D), Expected = 173.87, Std = 1.8800, ChiSquare = 9.9576e-01 1.G21 CA = 45.82(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.2578e-01 1.G21 N = 105.71(D), Expected = 109.67, Std = 3.8700, ChiSquare = 3.0619e-01 1.H22 C = 175.51(D), Expected = 175.25, Std = 1.9700, ChiSquare = 8.9500e-01 1.H22 CA = 55.26(D), Expected = 56.52, Std = 2.3100, ChiSquare = 5.8544e-01 1.H22 CB = 32.21(D), Expected = 30.24, Std = 2.0700, ChiSquare = 3.4125e-01 1.H22 CG = 136.07(D), Expected = 131.52, Std = 3.2700, ChiSquare = 1.6409e-01 1.H22 N = 116.73(D), Expected = 119.69, Std = 4.0000, ChiSquare = 4.5930e-01 1.R23 C = 177.59(D), Expected = 176.41, Std = 2.0300, ChiSquare = 5.6105e-01 1.R23 CA = 55.23(D), Expected = 56.77, Std = 2.3100, ChiSquare = 5.0499e-01 1.R23 CB = 32.60(D), Expected = 30.70, Std = 1.8300, ChiSquare = 2.9915e-01 1.R23 CG = 28.66(D), Expected = 27.21, Std = 1.2000, ChiSquare = 2.2692e-01 1.R23 N = 122.83(D), Expected = 120.80, Std = 3.6800, ChiSquare = 5.8120e-01 1.G24 C = 171.07(D), Expected = 173.87, Std = 1.8800, ChiSquare = 1.3639e-01 1.G24 CA = 47.25(D), Expected = 45.35, Std = 1.3400, ChiSquare = 1.5622e-01 1.G24 N = 107.51(D), Expected = 109.67, Std = 3.8700, ChiSquare = 5.7675e-01 1.T25 C = 174.66(D), Expected = 174.54, Std = 1.7600, ChiSquare = 9.4564e-01 1.T25 CA = 60.65(D), Expected = 62.22, Std = 2.5900, ChiSquare = 5.4440e-01 1.T25 CB = 71.40(D), Expected = 69.73, Std = 1.6300, ChiSquare = 3.0558e-01 1.T25 CG2 = 22.96(D), Expected = 21.55, Std = 1.1100, ChiSquare = 2.0399e-01 1.T25 N = 116.95(D), Expected = 115.42, Std = 4.7500, ChiSquare = 7.4737e-01 1.V26 C = 176.01(D), Expected = 175.62, Std = 1.9000, ChiSquare = 8.3737e-01 1.V26 CA = 65.22(D), Expected = 62.49, Std = 2.8600, ChiSquare = 3.3981e-01 1.V26 CB = 31.67(D), Expected = 32.73, Std = 1.7900, ChiSquare = 5.5373e-01 1.V26 CG1 = 24.24(D), Expected = 21.49, Std = 1.3600, ChiSquare = 4.3170e-02 1.V26 CG2 = 23.16(D), Expected = 21.26, Std = 1.5600, ChiSquare = 2.2324e-01 1.V26 N = 127.88(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.3765e-01 1.A27 C = 176.28(D), Expected = 177.74, Std = 2.1300, ChiSquare = 4.9306e-01 1.A27 CA = 51.69(D), Expected = 53.14, Std = 1.9800, ChiSquare = 4.6397e-01 1.A27 CB = 22.01(D), Expected = 19.01, Std = 1.8300, ChiSquare = 1.0114e-01 1.A27 N = 131.89(D), Expected = 123.23, Std = 3.5400, ChiSquare = 1.4432e-02 1.Y28 C = 173.21(D), Expected = 175.40, Std = 1.9900, ChiSquare = 2.7111e-01 1.Y28 CA = 58.72(D), Expected = 58.13, Std = 2.5100, ChiSquare = 8.1416e-01 1.Y28 CB = 43.41(D), Expected = 39.32, Std = 2.1600, ChiSquare = 5.8289e-02 1.Y28 CG = 128.65(D), Expected = 129.75, Std = 4.9600, ChiSquare = 8.2449e-01 1.Y28 CD1 = 132.25(D), Expected = 132.77, Std = 1.1700, ChiSquare = 6.5672e-01 1.Y28 CD2 = 135.11(D), Expected = 132.73, Std = 1.3000, ChiSquare = 6.7135e-02 1.Y28 N = 120.22(D), Expected = 120.52, Std = 4.2000, ChiSquare = 9.4306e-01 1.V29 C = 174.75(D), Expected = 175.62, Std = 1.9000, ChiSquare = 6.4703e-01 1.V29 CA = 61.82(D), Expected = 62.49, Std = 2.8600, ChiSquare = 8.1478e-01 1.V29 CB = 35.54(D), Expected = 32.73, Std = 1.7900, ChiSquare = 1.1645e-01 1.V29 CG1 = 21.72(D), Expected = 21.49, Std = 1.3600, ChiSquare = 8.6570e-01 1.V29 N = 128.29(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.1528e-01 1.G30 C = 172.10(D), Expected = 173.87, Std = 1.8800, ChiSquare = 3.4645e-01 1.G30 CA = 45.39(D), Expected = 45.35, Std = 1.3400, ChiSquare = 9.7619e-01 1.G30 N = 113.20(D), Expected = 109.67, Std = 3.8700, ChiSquare = 3.6169e-01 1.A31 C = 178.70(D), Expected = 177.74, Std = 2.1300, ChiSquare = 6.5220e-01 1.A31 CA = 51.84(D), Expected = 53.14, Std = 1.9800, ChiSquare = 5.1146e-01 1.A31 CB = 20.53(D), Expected = 19.01, Std = 1.8300, ChiSquare = 4.0620e-01 1.A31 N = 123.77(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.7876e-01 1.T32 C = 173.50(D), Expected = 174.54, Std = 1.7600, ChiSquare = 5.5458e-01 1.T32 CA = 59.60(D), Expected = 62.22, Std = 2.5900, ChiSquare = 3.1174e-01 1.T32 CB = 72.52(D), Expected = 69.73, Std = 1.6300, ChiSquare = 8.6960e-02 1.T32 CG2 = 22.23(D), Expected = 21.55, Std = 1.1100, ChiSquare = 5.4013e-01 1.T32 N = 112.42(D), Expected = 115.42, Std = 4.7500, ChiSquare = 5.2766e-01 1.L33 C = 177.80(D), Expected = 176.99, Std = 1.9800, ChiSquare = 6.8247e-01 1.L33 CA = 54.73(D), Expected = 55.62, Std = 2.1300, ChiSquare = 6.7606e-01 1.L33 CB = 41.83(D), Expected = 42.31, Std = 1.8800, ChiSquare = 7.9848e-01 1.L33 CG = 27.62(D), Expected = 26.78, Std = 1.1000, ChiSquare = 4.4508e-01 1.L33 N = 113.03(D), Expected = 121.86, Std = 3.9000, ChiSquare = 2.3568e-02 1.F34 C = 174.56(D), Expected = 175.42, Std = 1.9900, ChiSquare = 6.6562e-01 1.F34 CA = 56.37(D), Expected = 58.08, Std = 2.5700, ChiSquare = 5.0581e-01 1.F34 CB = 38.73(D), Expected = 39.99, Std = 2.0900, ChiSquare = 5.4659e-01 1.F34 CG = 138.03(D), Expected = 138.41, Std = 2.0400, ChiSquare = 8.5223e-01 1.F34 CD1 = 132.35(D), Expected = 131.58, Std = 1.1800, ChiSquare = 5.1405e-01 1.F34 N = 111.44(D), Expected = 120.45, Std = 4.1800, ChiSquare = 3.1123e-02 1.A35 C = 176.33(D), Expected = 177.74, Std = 2.1300, ChiSquare = 5.0799e-01 1.A35 CA = 52.14(D), Expected = 53.14, Std = 1.9800, ChiSquare = 6.1352e-01 1.A35 CB = 22.59(D), Expected = 19.01, Std = 1.8300, ChiSquare = 5.0432e-02 1.A35 N = 123.08(D), Expected = 123.23, Std = 3.5400, ChiSquare = 9.6620e-01 1.T36 C = 176.64(D), Expected = 174.54, Std = 1.7600, ChiSquare = 2.3280e-01 1.T36 CA = 62.18(D), Expected = 62.22, Std = 2.5900, ChiSquare = 9.8768e-01 1.T36 CB = 71.07(D), Expected = 69.73, Std = 1.6300, ChiSquare = 4.1103e-01 1.T36 CG2 = 22.31(D), Expected = 21.55, Std = 1.1100, ChiSquare = 4.9354e-01 1.T36 N = 110.25(D), Expected = 115.42, Std = 4.7500, ChiSquare = 2.7641e-01 1.G37 C = 172.50(D), Expected = 173.87, Std = 1.8800, ChiSquare = 4.6617e-01 1.G37 CA = 45.33(D), Expected = 45.35, Std = 1.3400, ChiSquare = 9.8809e-01 1.G37 N = 109.16(D), Expected = 109.67, Std = 3.8700, ChiSquare = 8.9516e-01 1.K38 C = 176.60(D), Expected = 176.64, Std = 2.0000, ChiSquare = 9.8404e-01 1.K38 CA = 57.03(D), Expected = 56.95, Std = 2.2000, ChiSquare = 9.7099e-01 1.K38 CB = 33.73(D), Expected = 32.79, Std = 1.7800, ChiSquare = 5.9744e-01 1.K38 CG = 25.53(D), Expected = 24.89, Std = 1.1300, ChiSquare = 5.7114e-01 1.K38 N = 121.46(D), Expected = 121.05, Std = 3.7700, ChiSquare = 9.1340e-01 1.W39 C = 173.96(D), Expected = 176.12, Std = 2.0100, ChiSquare = 2.8254e-01 1.W39 CA = 56.86(D), Expected = 57.66, Std = 2.5800, ChiSquare = 7.5650e-01 1.W39 CB = 34.23(D), Expected = 30.01, Std = 2.0100, ChiSquare = 3.5773e-02 1.W39 CG = 111.89(D), Expected = 110.59, Std = 1.8800, ChiSquare = 4.8926e-01 1.W39 CD1 = 127.07(D), Expected = 126.51, Std = 1.8300, ChiSquare = 7.5960e-01 1.W39 N = 130.11(D), Expected = 121.68, Std = 4.1800, ChiSquare = 4.3722e-02 1.V40 C = 176.43(D), Expected = 175.62, Std = 1.9000, ChiSquare = 6.6988e-01 1.V40 CA = 61.01(D), Expected = 62.49, Std = 2.8600, ChiSquare = 6.0482e-01 1.V40 CB = 33.41(D), Expected = 32.73, Std = 1.7900, ChiSquare = 7.0403e-01 1.V40 CG1 = 23.75(D), Expected = 21.49, Std = 1.3600, ChiSquare = 9.6560e-02 1.V40 CG2 = 20.82(D), Expected = 21.26, Std = 1.5600, ChiSquare = 7.7790e-01 1.V40 N = 119.65(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.4276e-01 1.G41 C = 172.33(D), Expected = 173.87, Std = 1.8800, ChiSquare = 4.1270e-01 1.G41 CA = 45.88(D), Expected = 45.35, Std = 1.3400, ChiSquare = 6.9246e-01 1.G41 N = 115.70(D), Expected = 109.67, Std = 3.8700, ChiSquare = 1.1920e-01 1.V42 C = 173.36(D), Expected = 175.62, Std = 1.9000, ChiSquare = 2.3425e-01 1.V42 CA = 60.72(D), Expected = 62.49, Std = 2.8600, ChiSquare = 5.3599e-01 1.V42 CB = 35.12(D), Expected = 32.73, Std = 1.7900, ChiSquare = 1.8181e-01 1.V42 CG1 = 22.69(D), Expected = 21.49, Std = 1.3600, ChiSquare = 3.7759e-01 1.V42 CG2 = 21.68(D), Expected = 21.26, Std = 1.5600, ChiSquare = 7.8775e-01 1.V42 N = 128.40(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.0979e-01 1.I43 C = 177.79(D), Expected = 175.85, Std = 1.9200, ChiSquare = 3.1230e-01 1.I43 CA = 60.63(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.1461e-01 1.I43 CB = 38.88(D), Expected = 38.63, Std = 2.0200, ChiSquare = 9.0150e-01 1.I43 CG1 = 28.36(D), Expected = 27.71, Std = 1.6800, ChiSquare = 6.9883e-01 1.I43 CG2 = 17.95(D), Expected = 17.53, Std = 1.3600, ChiSquare = 7.5746e-01 1.I43 CD1 = 14.77(D), Expected = 13.43, Std = 1.6700, ChiSquare = 4.2232e-01 1.I43 N = 124.69(D), Expected = 121.46, Std = 4.2800, ChiSquare = 4.5045e-01 1.L44 C = 177.92(D), Expected = 176.99, Std = 1.9800, ChiSquare = 6.3857e-01 1.L44 CA = 55.61(D), Expected = 55.62, Std = 2.1300, ChiSquare = 9.9625e-01 1.L44 CB = 41.67(D), Expected = 42.31, Std = 1.8800, ChiSquare = 7.3354e-01 1.L44 CG = 26.93(D), Expected = 26.78, Std = 1.1000, ChiSquare = 8.9153e-01 1.L44 CD1 = 22.39(D), Expected = 24.72, Std = 1.5900, ChiSquare = 1.4281e-01 1.L44 N = 133.06(D), Expected = 121.86, Std = 3.9000, ChiSquare = 4.0815e-03 1.D45 C = 177.87(D), Expected = 176.40, Std = 1.7500, ChiSquare = 4.0091e-01 1.D45 CA = 57.44(D), Expected = 54.69, Std = 2.0300, ChiSquare = 1.7552e-01 1.D45 CB = 40.08(D), Expected = 40.88, Std = 1.6200, ChiSquare = 6.2143e-01 1.D45 CG = 180.07(D), Expected = 179.17, Std = 1.7900, ChiSquare = 6.1511e-01 1.D45 N = 125.11(D), Expected = 120.65, Std = 3.8600, ChiSquare = 2.4791e-01 1.E46 C = 176.81(D), Expected = 176.87, Std = 1.9500, ChiSquare = 9.7545e-01 1.E46 CA = 54.38(D), Expected = 57.32, Std = 2.0900, ChiSquare = 1.5952e-01 1.E46 CB = 32.96(D), Expected = 30.01, Std = 1.7200, ChiSquare = 8.6324e-02 1.E46 CG = 37.16(D), Expected = 36.11, Std = 1.1900, ChiSquare = 3.7759e-01 1.E46 CD = 179.98(D), Expected = 182.40, Std = 1.7800, ChiSquare = 1.7397e-01 1.E46 N = 118.09(D), Expected = 120.67, Std = 3.4800, ChiSquare = 4.5846e-01 1.A47 C = 178.01(D), Expected = 177.74, Std = 2.1300, ChiSquare = 8.9913e-01 1.A47 CA = 51.11(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.0524e-01 1.A47 CB = 15.75(D), Expected = 19.01, Std = 1.8300, ChiSquare = 7.4844e-02 1.A47 N = 125.05(D), Expected = 123.23, Std = 3.5400, ChiSquare = 6.0716e-01 1.K48 C = 176.33(D), Expected = 176.64, Std = 2.0000, ChiSquare = 8.7682e-01 1.K48 CA = 53.79(D), Expected = 56.95, Std = 2.2000, ChiSquare = 1.5090e-01 1.K48 CB = 33.38(D), Expected = 32.79, Std = 1.7800, ChiSquare = 7.4030e-01 1.K48 CG = 25.47(D), Expected = 24.89, Std = 1.1300, ChiSquare = 6.0776e-01 1.K48 N = 122.67(D), Expected = 121.05, Std = 3.7700, ChiSquare = 6.6741e-01 1.G49 C = 172.93(D), Expected = 173.87, Std = 1.8800, ChiSquare = 6.1707e-01 1.G49 CA = 44.41(D), Expected = 45.35, Std = 1.3400, ChiSquare = 4.8300e-01 1.G49 N = 109.20(D), Expected = 109.67, Std = 3.8700, ChiSquare = 9.0334e-01 1.K50 C = 175.84(D), Expected = 176.64, Std = 2.0000, ChiSquare = 6.8916e-01 1.K50 CA = 56.19(D), Expected = 56.95, Std = 2.2000, ChiSquare = 7.2975e-01 1.K50 CB = 37.24(D), Expected = 32.79, Std = 1.7800, ChiSquare = 1.2419e-02 1.K50 CG = 25.34(D), Expected = 24.89, Std = 1.1300, ChiSquare = 6.9046e-01 1.K50 CD = 29.10(D), Expected = 28.96, Std = 1.0800, ChiSquare = 8.9686e-01 1.K50 CE = 42.46(D), Expected = 41.89, Std = 0.8200, ChiSquare = 4.8698e-01 1.K50 N = 116.29(D), Expected = 121.05, Std = 3.7700, ChiSquare = 2.0673e-01 1.N51 C = 173.42(D), Expected = 175.27, Std = 1.7900, ChiSquare = 3.0136e-01 1.N51 CA = 53.43(D), Expected = 53.54, Std = 1.8800, ChiSquare = 9.5334e-01 1.N51 CB = 40.82(D), Expected = 38.69, Std = 1.6900, ChiSquare = 2.0754e-01 1.N51 N = 117.30(D), Expected = 118.93, Std = 4.0300, ChiSquare = 6.8587e-01 1.D52 C = 178.13(D), Expected = 176.40, Std = 1.7500, ChiSquare = 3.2287e-01 1.D52 CA = 53.13(D), Expected = 54.69, Std = 2.0300, ChiSquare = 4.4221e-01 1.D52 CB = 41.00(D), Expected = 40.88, Std = 1.6200, ChiSquare = 9.4095e-01 1.D52 CG = 182.03(D), Expected = 179.17, Std = 1.7900, ChiSquare = 1.1010e-01 1.D52 N = 119.00(D), Expected = 120.65, Std = 3.8600, ChiSquare = 6.6904e-01 1.G53 C = 174.38(D), Expected = 173.87, Std = 1.8800, ChiSquare = 7.8618e-01 1.G53 CA = 43.47(D), Expected = 45.35, Std = 1.3400, ChiSquare = 1.6062e-01 1.G53 N = 110.99(D), Expected = 109.67, Std = 3.8700, ChiSquare = 7.3304e-01 1.T54 C = 174.69(D), Expected = 174.54, Std = 1.7600, ChiSquare = 9.3208e-01 1.T54 CA = 61.61(D), Expected = 62.22, Std = 2.5900, ChiSquare = 8.1380e-01 1.T54 CB = 69.35(D), Expected = 69.73, Std = 1.6300, ChiSquare = 8.1566e-01 1.T54 CG2 = 20.22(D), Expected = 21.55, Std = 1.1100, ChiSquare = 2.3084e-01 1.T54 N = 118.00(D), Expected = 115.42, Std = 4.7500, ChiSquare = 5.8702e-01 1.V55 C = 176.84(D), Expected = 175.62, Std = 1.9000, ChiSquare = 5.2080e-01 1.V55 CA = 61.71(D), Expected = 62.49, Std = 2.8600, ChiSquare = 7.8506e-01 1.V55 CB = 36.43(D), Expected = 32.73, Std = 1.7900, ChiSquare = 3.8730e-02 1.V55 CG1 = 22.20(D), Expected = 21.49, Std = 1.3600, ChiSquare = 6.0163e-01 1.V55 CG2 = 21.52(D), Expected = 21.26, Std = 1.5600, ChiSquare = 8.6763e-01 1.V55 N = 123.29(D), Expected = 121.14, Std = 4.5400, ChiSquare = 6.3581e-01 1.Q56 C = 176.11(D), Expected = 176.31, Std = 1.9500, ChiSquare = 9.1831e-01 1.Q56 CA = 56.88(D), Expected = 56.57, Std = 2.1400, ChiSquare = 8.8482e-01 1.Q56 CB = 26.98(D), Expected = 29.19, Std = 1.8200, ChiSquare = 2.2464e-01 1.Q56 CG = 34.39(D), Expected = 33.76, Std = 1.1100, ChiSquare = 5.7033e-01 1.Q56 CD = 176.31(D), Expected = 179.69, Std = 1.2900, ChiSquare = 8.7890e-03 1.Q56 N = 130.21(D), Expected = 119.89, Std = 3.6000, ChiSquare = 4.1482e-03 1.G57 C = 173.01(D), Expected = 173.87, Std = 1.8800, ChiSquare = 6.4735e-01 1.G57 CA = 45.72(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.8246e-01 1.G57 N = 103.65(D), Expected = 109.67, Std = 3.8700, ChiSquare = 1.1981e-01 1.R58 C = 172.85(D), Expected = 176.41, Std = 2.0300, ChiSquare = 7.9483e-02 1.R58 CA = 53.84(D), Expected = 56.77, Std = 2.3100, ChiSquare = 2.0466e-01 1.R58 CB = 30.63(D), Expected = 30.70, Std = 1.8300, ChiSquare = 9.6949e-01 1.R58 N = 122.07(D), Expected = 120.80, Std = 3.6800, ChiSquare = 7.3001e-01 1.K59 C = 176.04(D), Expected = 176.64, Std = 2.0000, ChiSquare = 7.6418e-01 1.K59 CA = 56.55(D), Expected = 56.95, Std = 2.2000, ChiSquare = 8.5573e-01 1.K59 CB = 32.72(D), Expected = 32.79, Std = 1.7800, ChiSquare = 9.6863e-01 1.K59 CG = 24.45(D), Expected = 24.89, Std = 1.1300, ChiSquare = 6.9699e-01 1.K59 CD = 29.48(D), Expected = 28.96, Std = 1.0800, ChiSquare = 6.3017e-01 1.K59 N = 128.26(D), Expected = 121.05, Std = 3.7700, ChiSquare = 5.5816e-02 1.Y60 C = 175.16(D), Expected = 175.40, Std = 1.9900, ChiSquare = 9.0401e-01 1.Y60 CA = 60.53(D), Expected = 58.13, Std = 2.5100, ChiSquare = 3.3898e-01 1.Y60 CB = 39.42(D), Expected = 39.32, Std = 2.1600, ChiSquare = 9.6307e-01 1.Y60 N = 127.69(D), Expected = 120.52, Std = 4.2000, ChiSquare = 8.7796e-02 1.F61 C = 172.50(D), Expected = 175.42, Std = 1.9900, ChiSquare = 1.4228e-01 1.F61 CA = 56.04(D), Expected = 58.08, Std = 2.5700, ChiSquare = 4.2733e-01 1.F61 CB = 38.79(D), Expected = 39.99, Std = 2.0900, ChiSquare = 5.6586e-01 1.F61 N = 114.21(D), Expected = 120.45, Std = 4.1800, ChiSquare = 1.3548e-01 1.T62 C = 172.78(D), Expected = 174.54, Std = 1.7600, ChiSquare = 3.1731e-01 1.T62 CA = 62.82(D), Expected = 62.22, Std = 2.5900, ChiSquare = 8.1680e-01 1.T62 CB = 71.34(D), Expected = 69.73, Std = 1.6300, ChiSquare = 3.2329e-01 1.T62 CG2 = 21.53(D), Expected = 21.55, Std = 1.1100, ChiSquare = 9.8562e-01 1.T62 N = 115.34(D), Expected = 115.42, Std = 4.7500, ChiSquare = 9.8656e-01 1.C63 C = 172.33(D), Expected = 174.95, Std = 2.0700, ChiSquare = 2.0562e-01 1.C63 CA = 56.21(D), Expected = 58.30, Std = 3.3300, ChiSquare = 5.3025e-01 1.C63 CB = 32.33(D), Expected = 32.49, Std = 6.0100, ChiSquare = 9.7876e-01 1.C63 N = 120.70(D), Expected = 120.17, Std = 4.6400, ChiSquare = 9.0906e-01 1.D64 C = 176.72(D), Expected = 176.40, Std = 1.7500, ChiSquare = 8.5491e-01 1.D64 CA = 54.71(D), Expected = 54.69, Std = 2.0300, ChiSquare = 9.9214e-01 1.D64 CB = 41.31(D), Expected = 40.88, Std = 1.6200, ChiSquare = 7.9068e-01 1.D64 N = 118.44(D), Expected = 120.65, Std = 3.8600, ChiSquare = 5.6696e-01 1.E65 C = 177.91(D), Expected = 176.87, Std = 1.9500, ChiSquare = 5.9380e-01 1.E65 CA = 58.43(D), Expected = 57.32, Std = 2.0900, ChiSquare = 5.9535e-01 1.E65 CB = 29.94(D), Expected = 30.01, Std = 1.7200, ChiSquare = 9.6754e-01 1.E65 CG = 36.05(D), Expected = 36.11, Std = 1.1900, ChiSquare = 9.5979e-01 1.E65 CD = 183.77(D), Expected = 182.40, Std = 1.7800, ChiSquare = 4.4150e-01 1.E65 N = 121.23(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.7216e-01 1.G66 C = 174.55(D), Expected = 173.87, Std = 1.8800, ChiSquare = 7.1757e-01 1.G66 CA = 45.51(D), Expected = 45.35, Std = 1.3400, ChiSquare = 9.0496e-01 1.G66 N = 112.19(D), Expected = 109.67, Std = 3.8700, ChiSquare = 5.1494e-01 1.H67 C = 174.19(D), Expected = 175.25, Std = 1.9700, ChiSquare = 5.9053e-01 1.H67 CA = 56.66(D), Expected = 56.52, Std = 2.3100, ChiSquare = 9.5167e-01 1.H67 CB = 29.48(D), Expected = 30.24, Std = 2.0700, ChiSquare = 7.1351e-01 1.H67 CG = 132.53(D), Expected = 131.52, Std = 3.2700, ChiSquare = 7.5742e-01 1.H67 N = 113.93(D), Expected = 119.69, Std = 4.0000, ChiSquare = 1.4987e-01 1.G68 C = 174.58(D), Expected = 173.87, Std = 1.8800, ChiSquare = 7.0568e-01 1.G68 CA = 45.66(D), Expected = 45.35, Std = 1.3400, ChiSquare = 8.1705e-01 1.G68 N = 112.30(D), Expected = 109.67, Std = 3.8700, ChiSquare = 4.9677e-01 1.I69 C = 172.70(D), Expected = 175.85, Std = 1.9200, ChiSquare = 1.0088e-01 1.I69 CA = 60.61(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.0905e-01 1.I69 CB = 43.82(D), Expected = 38.63, Std = 2.0200, ChiSquare = 1.0190e-02 1.I69 CG1 = 27.21(D), Expected = 27.71, Std = 1.6800, ChiSquare = 7.6599e-01 1.I69 CG2 = 19.17(D), Expected = 17.53, Std = 1.3600, ChiSquare = 2.2786e-01 1.I69 CD1 = 14.80(D), Expected = 13.43, Std = 1.6700, ChiSquare = 4.1201e-01 1.I69 N = 118.46(D), Expected = 121.46, Std = 4.2800, ChiSquare = 4.8334e-01 1.F70 C = 175.78(D), Expected = 175.42, Std = 1.9900, ChiSquare = 8.5644e-01 1.F70 CA = 58.04(D), Expected = 58.08, Std = 2.5700, ChiSquare = 9.8758e-01 1.F70 CB = 42.31(D), Expected = 39.99, Std = 2.0900, ChiSquare = 2.6698e-01 1.F70 N = 122.47(D), Expected = 120.45, Std = 4.1800, ChiSquare = 6.2892e-01 1.V71 C = 175.69(D), Expected = 175.62, Std = 1.9000, ChiSquare = 9.7061e-01 1.V71 CA = 59.08(D), Expected = 62.49, Std = 2.8600, ChiSquare = 2.3314e-01 1.V71 CB = 37.05(D), Expected = 32.73, Std = 1.7900, ChiSquare = 1.5804e-02 1.V71 CG1 = 23.66(D), Expected = 21.49, Std = 1.3600, ChiSquare = 1.1058e-01 1.V71 CG2 = 19.04(D), Expected = 21.26, Std = 1.5600, ChiSquare = 1.5471e-01 1.V71 N = 114.84(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.6524e-01 1.R72 C = 179.07(D), Expected = 176.41, Std = 2.0300, ChiSquare = 1.9008e-01 1.R72 CA = 53.42(D), Expected = 56.77, Std = 2.3100, ChiSquare = 1.4700e-01 1.R72 CB = 31.66(D), Expected = 30.70, Std = 1.8300, ChiSquare = 5.9987e-01 1.R72 CG = 25.51(D), Expected = 27.21, Std = 1.2000, ChiSquare = 1.5658e-01 1.R72 CD = 42.25(D), Expected = 43.16, Std = 0.8800, ChiSquare = 3.0109e-01 1.R72 N = 117.65(D), Expected = 120.80, Std = 3.6800, ChiSquare = 3.9201e-01 1.Q73 C = 176.70(D), Expected = 176.31, Std = 1.9500, ChiSquare = 8.4148e-01 1.Q73 CA = 59.72(D), Expected = 56.57, Std = 2.1400, ChiSquare = 1.4103e-01 1.Q73 CB = 28.07(D), Expected = 29.19, Std = 1.8200, ChiSquare = 5.3830e-01 1.Q73 CG = 34.04(D), Expected = 33.76, Std = 1.1100, ChiSquare = 8.0085e-01 1.Q73 CD = 179.18(D), Expected = 179.69, Std = 1.2900, ChiSquare = 6.9259e-01 1.Q73 N = 122.57(D), Expected = 119.89, Std = 3.6000, ChiSquare = 4.5661e-01 1.S74 C = 175.94(D), Expected = 174.62, Std = 1.7200, ChiSquare = 4.4282e-01 1.S74 CA = 59.66(D), Expected = 58.72, Std = 2.0700, ChiSquare = 6.4975e-01 1.S74 CB = 62.87(D), Expected = 63.80, Std = 1.4800, ChiSquare = 5.2976e-01 1.S74 N = 109.71(D), Expected = 116.28, Std = 3.5200, ChiSquare = 6.1975e-02 1.Q75 C = 176.09(D), Expected = 176.31, Std = 1.9500, ChiSquare = 9.1017e-01 1.Q75 CA = 56.76(D), Expected = 56.57, Std = 2.1400, ChiSquare = 9.2925e-01 1.Q75 CB = 31.42(D), Expected = 29.19, Std = 1.8200, ChiSquare = 2.2047e-01 1.Q75 CG = 36.65(D), Expected = 33.76, Std = 1.1100, ChiSquare = 9.2249e-03 1.Q75 N = 117.98(D), Expected = 119.89, Std = 3.6000, ChiSquare = 5.9573e-01 1.I76 C = 173.85(D), Expected = 175.85, Std = 1.9200, ChiSquare = 2.9757e-01 1.I76 CA = 58.43(D), Expected = 61.61, Std = 2.6800, ChiSquare = 2.3540e-01 1.I76 CB = 43.63(D), Expected = 38.63, Std = 2.0200, ChiSquare = 1.3314e-02 1.I76 CG1 = 25.02(D), Expected = 27.71, Std = 1.6800, ChiSquare = 1.0933e-01 1.I76 CG2 = 20.18(D), Expected = 17.53, Std = 1.3600, ChiSquare = 5.1352e-02 1.I76 N = 112.97(D), Expected = 121.46, Std = 4.2800, ChiSquare = 4.7295e-02 1.Q77 C = 175.00(D), Expected = 176.31, Std = 1.9500, ChiSquare = 5.0171e-01 1.Q77 CA = 53.80(D), Expected = 56.57, Std = 2.1400, ChiSquare = 1.9553e-01 1.Q77 CB = 33.62(D), Expected = 29.19, Std = 1.8200, ChiSquare = 1.4930e-02 1.Q77 N = 118.57(D), Expected = 119.89, Std = 3.6000, ChiSquare = 7.1387e-01 1.V78 C = 176.00(D), Expected = 175.62, Std = 1.9000, ChiSquare = 8.4148e-01 1.V78 CA = 63.04(D), Expected = 62.49, Std = 2.8600, ChiSquare = 8.4750e-01 1.V78 CB = 32.58(D), Expected = 32.73, Std = 1.7900, ChiSquare = 9.3322e-01 1.V78 CG1 = 21.18(D), Expected = 21.49, Std = 1.3600, ChiSquare = 8.1969e-01 1.V78 N = 126.73(D), Expected = 121.14, Std = 4.5400, ChiSquare = 2.1822e-01 1.F79 CA = 57.36(D), Expected = 58.08, Std = 2.5700, ChiSquare = 7.7936e-01 1.F79 CB = 40.08(D), Expected = 39.99, Std = 2.0900, ChiSquare = 9.6565e-01 1.F79 N = 124.97(D), Expected = 120.45, Std = 4.1800, ChiSquare = 2.7955e-01