Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.M1 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> M 0.21 K 0.15 C 0.15 R 0.12 H 0.12 W 0.07 Q 0.07 E 0.05 C Shift Assignments>> C :: 172.3160 CA :: 54.7286(D) CB :: 32.2529(D) Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) 1.Q2 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.17 K 0.16 H 0.13 W 0.12 C 0.11 E 0.11 R 0.09 L 0.04 M 0.02 I 0.01 C Shift Assignments>> C :: 175.3409 CA :: 56.0643(D) CB :: 28.6520(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.9679(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 123.8193(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.S3 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.87 T 0.12 HN Overlap>> 1.H65 1.H65 C Shift Assignments>> C :: 169.8507 CA :: 57.3458(D) CB :: 66.4754(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.2127(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 120.3031(D) Ave N Shift Values>> N :: 116.28(3.52) 1.W4 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.14 R 0.14 E 0.14 W 0.14 C 0.13 Q 0.12 K 0.06 M 0.06 I 0.01 C Shift Assignments>> C :: 174.8345 CA :: 56.9544(D) CB :: 30.3024(D) Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 8.4146(D) Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 120.0040(D) Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.Y5 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.22 L 0.21 D 0.15 F 0.14 Y 0.1 C 0.06 R 0.05 N 0.01 I 0.01 C Shift Assignments>> C :: 174.3048 CA :: 56.4267(D) CB :: 41.6371(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 10.0496(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 120.3385(D) Ave N Shift Values>> N :: 120.52(4.2) 1.L6 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.7 L 0.18 C 0.03 R 0.03 D 0.02 F 0.01 C Shift Assignments>> C :: 173.5871 CA :: 53.7741(D) CB :: 45.0949(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 10.0807(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 123.3173(D) Ave N Shift Values>> N :: 121.86(3.9) 1.L7 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.3 G 0.21 D 0.17 R 0.17 C 0.04 F 0.02 K 0.02 N 0.02 Y 0.01 C Shift Assignments>> C :: 175.0819 CA :: 52.1120(D) CB :: 43.4407(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.1152(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 124.0319(D) Ave N Shift Values>> N :: 121.86(3.9) 1.Y8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.24 F 0.22 C 0.14 D 0.13 N 0.11 L 0.07 I 0.04 E 0.01 HN Overlap>> 1.F81 1.F81 C Shift Assignments>> C :: 175.7676 CA :: 56.2160(D) CB :: 39.1265(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.7480(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 121.5912(D) Ave N Shift Values>> N :: 120.52(4.2) 1.C9 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.16 W 0.14 K 0.13 Q 0.11 E 0.11 I 0.1 H 0.09 R 0.08 L 0.02 M 0.01 HN Overlap>> 1.I118 1.I118 C Shift Assignments>> C :: 172.2171 CA :: 58.7738(D) CB :: 28.4808(D) Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.3595(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 125.9239(D) Ave N Shift Values>> N :: 120.17(4.64) 1.K10 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.18 K 0.15 C 0.14 R 0.13 H 0.12 W 0.09 E 0.07 Q 0.05 V 0.01 C Shift Assignments>> C :: 177.3749 CA :: 55.9603(D) CB :: 31.9661(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.0420(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 118.4292(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.R11 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.15 W 0.14 C 0.14 Q 0.13 E 0.13 H 0.11 R 0.09 I 0.05 M 0.02 L 0.01 C Shift Assignments>> C :: 177.9388 CA :: 57.9401(D) CB :: 28.8680(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.3780(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 124.0062(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.G12 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.85 L 0.08 C 0.02 C Shift Assignments>> C :: 175.9445 CA :: 45.4261(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.7161(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 113.8863(D) Ave N Shift Values>> N :: 109.67(3.87) 1.Q13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.17 K 0.15 H 0.15 C 0.11 W 0.11 R 0.1 E 0.1 M 0.04 L 0.03 C Shift Assignments>> C :: 175.4314 CA :: 54.9128(D) CB :: 28.9493(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.1255(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 116.4181(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.29 Y 0.24 I 0.16 C 0.13 K 0.09 L 0.04 D 0.01 C Shift Assignments>> C :: 177.9039 CA :: 59.7650(D) CB :: 40.9381(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.8224(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.9083(D) Ave N Shift Values>> N :: 121.86(3.9) 1.Q15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.22 R 0.19 I 0.19 L 0.09 W 0.07 K 0.06 Q 0.06 H 0.04 E 0.03 C Shift Assignments>> C :: 178.5617 CA :: 59.1149(D) CB :: 26.6228(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.5443(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 116.6623(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.R16 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.14 W 0.14 C 0.14 E 0.13 Q 0.13 H 0.11 R 0.09 I 0.04 M 0.02 L 0.01 C Shift Assignments>> C :: 178.8325 CA :: 58.0035(D) CB :: 29.0179(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.5630(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 119.4249(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.A17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.64 A 0.3 I 0.03 C 0.01 C Shift Assignments>> C :: 179.1415 CA :: 55.0101(D) CB :: 17.2929(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1668(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.1053(D) Ave N Shift Values>> N :: 123.23(3.54) 1.Q18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.21 R 0.19 I 0.19 L 0.08 W 0.08 Q 0.07 H 0.04 E 0.04 K 0.04 C Shift Assignments>> C :: 177.8131 CA :: 59.1057(D) CB :: 26.8839(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.8705(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 117.6272(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.17 W 0.14 K 0.13 I 0.12 E 0.1 Q 0.1 H 0.08 R 0.07 L 0.01 M 0.01 C Shift Assignments>> C :: 179.6007 CA :: 59.0047(D) CB :: 28.5115(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.1506(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 117.6840(D) Ave N Shift Values>> N :: 120.67(3.48) 1.H20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.18 W 0.17 E 0.12 K 0.09 H 0.09 R 0.09 Q 0.08 I 0.08 V 0.02 M 0.02 HN Overlap>> 1.A25 1.A25 C Shift Assignments>> C :: 178.8308 CA :: 59.4381(D) CB :: 29.5922(D) Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 7.9267(D) Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 116.7870(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.L21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.29 Y 0.29 C 0.14 I 0.09 D 0.06 L 0.06 N 0.01 C Shift Assignments>> C :: 179.7199 CA :: 57.8682(D) CB :: 39.7198(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.8004(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.1417(D) Ave N Shift Values>> N :: 121.86(3.9) 1.E22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.18 I 0.17 W 0.12 R 0.11 K 0.09 Q 0.09 E 0.08 H 0.06 L 0.03 C Shift Assignments>> C :: 181.5013 CA :: 59.3161(D) CB :: 27.9733(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.0704(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 121.3022(D) Ave N Shift Values>> N :: 120.67(3.48) 1.R23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.15 C 0.14 E 0.13 K 0.13 Q 0.12 H 0.11 R 0.1 I 0.04 M 0.02 C Shift Assignments>> C :: 177.3962 CA :: 58.1376(D) CB :: 29.2461(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.5630(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 118.7641(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.Q24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.17 H 0.15 K 0.14 C 0.11 W 0.11 R 0.11 E 0.09 M 0.04 L 0.02 C Shift Assignments>> C :: 173.9562 CA :: 54.7107(D) CB :: 29.0739(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.4423(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 117.6826(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A25 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.58 A 0.39 C 0.01 HN Overlap>> 1.H20 1.H20 C Shift Assignments>> C :: 175.9731 CA :: 52.8436(D) CB :: 15.2172(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.8429(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 116.7200(D) Ave N Shift Values>> N :: 123.23(3.54) 1.V26 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.27 C 0.23 P 0.19 W 0.09 R 0.04 I 0.03 E 0.03 K 0.02 H 0.02 M 0.01 Q 0.01 C Shift Assignments>> C :: 175.5117 CA :: 61.6170(D) CB :: 31.3686(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.5657(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 120.4848(D) Ave N Shift Values>> N :: 121.14(4.54) 1.N27 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.58 D 0.14 C 0.09 Y 0.06 F 0.05 L 0.03 C Shift Assignments>> C :: 174.3552 CA :: 52.7518(D) CB :: 38.5303(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.7546(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 124.6600(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.C28 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.16 R 0.13 K 0.13 M 0.13 H 0.11 W 0.11 E 0.1 Q 0.05 V 0.03 C Shift Assignments>> C :: 174.6288 CA :: 57.5428(D) CB :: 31.7162(D) Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.8752(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 119.4267(D) Ave N Shift Values>> N :: 120.17(4.64) 1.L29 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.72 L 0.17 C 0.04 R 0.01 D 0.01 F 0.01 C Shift Assignments>> C :: 174.3008 CA :: 55.0701(D) CB :: 45.6113(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.4706(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 123.7647(D) Ave N Shift Values>> N :: 121.86(3.9) 1.A30 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.87 G 0.08 M 0.03 C 0.01 C Shift Assignments>> CA :: 48.8638(D) CB :: 18.4093(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.1104(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 128.9631(D) Ave N Shift Values>> N :: 123.23(3.54) 1.P31 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.35 V 0.34 C 0.17 W 0.04 I 0.02 R 0.01 K 0.01 E 0.01 H 0.01 C Shift Assignments>> C :: 176.3226 CA :: 62.5473(D) CB :: 31.6867(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.M32 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.27 C 0.2 Q 0.19 K 0.13 H 0.06 R 0.05 W 0.02 E 0.01 C Shift Assignments>> C :: 174.5963 CA :: 53.1202(D) CB :: 33.6640(D) Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.7834(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 121.4156(D) Ave N Shift Values>> N :: 120.09(3.57) 1.I33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.26 Y 0.21 K 0.17 C 0.11 I 0.09 L 0.07 D 0.02 R 0.02 C Shift Assignments>> C :: 172.5219 CA :: 59.2274(D) CB :: 41.3761(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.2998(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.2447(D) Ave N Shift Values>> N :: 121.46(4.28) 1.T34 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 HN Overlap>> 1.V116 1.V116 C Shift Assignments>> C :: 173.4469 CA :: 61.0782(D) CB :: 69.0649(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.1703(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 121.8888(D) Ave N Shift Values>> N :: 115.42(4.75) 1.L35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.4 L 0.29 R 0.13 D 0.08 C 0.04 F 0.01 C Shift Assignments>> C :: 174.9711 CA :: 53.0100(D) CB :: 44.2078(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.9525(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 127.4218(D) Ave N Shift Values>> N :: 121.86(3.9) 1.E36 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.16 Q 0.14 R 0.14 W 0.12 E 0.12 C 0.11 K 0.09 M 0.06 C Shift Assignments>> C :: 175.9007 CA :: 55.3563(D) CB :: 29.9178(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.5188(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.3632(D) Ave N Shift Values>> N :: 120.67(3.48) 1.K37 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.24 M 0.21 E 0.17 N 0.1 Q 0.08 K 0.07 Y 0.03 F 0.02 H 0.01 C Shift Assignments>> C :: 174.6302 CA :: 54.1454(D) CB :: 35.5969(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.8785(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 124.7289(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I38 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.35 E 0.13 V 0.12 I 0.08 K 0.07 M 0.06 Q 0.05 Y 0.04 F 0.02 W 0.01 C Shift Assignments>> C :: 176.1573 CA :: 60.0056(D) CB :: 35.0916(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.6488(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 121.7167(D) Ave N Shift Values>> N :: 121.46(4.28) 1.V39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.38 C 0.27 P 0.1 K 0.05 W 0.04 Q 0.02 M 0.02 R 0.02 H 0.01 E 0.01 C Shift Assignments>> C :: 176.0187 CA :: 61.3729(D) CB :: 33.0641(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.6679(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 129.6892(D) Ave N Shift Values>> N :: 121.14(4.54) 1.R40 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.26 C 0.18 Q 0.14 W 0.09 H 0.08 E 0.06 K 0.05 I 0.05 R 0.03 C Shift Assignments>> C :: 176.7273 CA :: 56.8222(D) CB :: 26.9537(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 9.6594(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 128.5146(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.G41 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.74 L 0.14 C 0.03 R 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 173.6562 CA :: 44.9949(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.2039(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 102.1044(D) Ave N Shift Values>> N :: 109.67(3.87) 1.K42 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.26 Q 0.22 C 0.19 K 0.14 H 0.04 R 0.04 E 0.03 W 0.02 N 0.01 C Shift Assignments>> C :: 176.1673 CA :: 54.0390(D) CB :: 34.0909(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.7712(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.7186(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.R43 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.15 Q 0.14 W 0.13 E 0.13 C 0.12 H 0.12 R 0.09 I 0.03 M 0.02 L 0.01 HN Overlap>> 1.A108 1.A108 C Shift Assignments>> C :: 175.9110 CA :: 57.2344(D) CB :: 28.9758(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.9995(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 127.7293(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.T44 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 HN Overlap>> 1.V46 1.V46 C Shift Assignments>> C :: 171.5356 CA :: 61.1906(D) CB :: 71.5450(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 9.1936(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 123.6127(D) Ave N Shift Values>> N :: 115.42(4.75) 1.A45 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.85 M 0.13 C Shift Assignments>> C :: 176.7236 CA :: 51.3323(D) CB :: 17.9682(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.5062(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 128.2312(D) Ave N Shift Values>> N :: 123.23(3.54) 1.V46 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.34 V 0.25 K 0.09 Q 0.07 M 0.05 E 0.03 I 0.03 W 0.02 R 0.02 H 0.01 Y 0.01 P 0.01 HN Overlap>> 1.T44 1.T44 C Shift Assignments>> C :: 174.3526 CA :: 60.4764(D) CB :: 34.1526(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.0990(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 123.6562(D) Ave N Shift Values>> N :: 121.14(4.54) 1.S47 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 173.9789 CA :: 56.4169(D) CB :: 63.3051(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.5230(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 119.7945(D) Ave N Shift Values>> N :: 116.28(3.52) 1.E48 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.19 C 0.16 R 0.15 Q 0.12 W 0.11 M 0.11 E 0.06 K 0.05 P 0.01 C Shift Assignments>> CA :: 52.7678(D) CB :: 30.3295(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.2399(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 124.2049(D) Ave N Shift Values>> N :: 120.67(3.48) 1.P49 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.37 V 0.3 C 0.17 I 0.05 W 0.04 R 0.01 C Shift Assignments>> C :: 177.5184 CA :: 63.0100(D) CB :: 31.0665(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.L50 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.21 K 0.19 Y 0.16 L 0.15 D 0.1 C 0.08 I 0.03 R 0.02 C Shift Assignments>> C :: 176.5130 CA :: 57.4164(D) CB :: 41.2706(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.6865(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 127.0182(D) Ave N Shift Values>> N :: 121.86(3.9) 1.F51 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.69 C 0.12 D 0.07 Y 0.03 F 0.03 M 0.01 L 0.01 E 0.01 C Shift Assignments>> CA :: 51.5843(D) CB :: 37.8106(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.9056(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 115.2229(D) Ave N Shift Values>> N :: 120.45(4.18) 1.P52 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.37 V 0.31 C 0.15 I 0.11 W 0.02 C Shift Assignments>> C :: 176.9946 CA :: 64.2407(D) CB :: 30.5772(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.N53 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.22 E 0.22 Y 0.16 N 0.11 F 0.1 M 0.07 I 0.03 D 0.02 K 0.01 C Shift Assignments>> C :: 172.1168 CA :: 55.9261(D) CB :: 37.1085(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 9.1130(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 113.4118(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.Y54 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.3 F 0.27 C 0.17 I 0.13 D 0.03 L 0.03 E 0.01 N 0.01 C Shift Assignments>> C :: 174.7537 CA :: 58.1605(D) CB :: 38.9500(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.8420(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 118.0031(D) Ave N Shift Values>> N :: 120.52(4.2) 1.L55 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.84 L 0.08 C 0.05 C Shift Assignments>> C :: 175.5135 CA :: 53.1465(D) CB :: 46.9127(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.1135(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.8989(D) Ave N Shift Values>> N :: 121.86(3.9) 1.F56 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.3 F 0.27 C 0.16 I 0.1 D 0.05 L 0.04 N 0.02 E 0.01 C Shift Assignments>> C :: 176.7183 CA :: 57.6928(D) CB :: 39.0221(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.7901(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 125.7675(D) Ave N Shift Values>> N :: 120.45(4.18) 1.V57 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.28 E 0.18 M 0.11 K 0.1 Q 0.1 V 0.04 Y 0.04 I 0.03 F 0.01 H 0.01 R 0.01 W 0.01 C Shift Assignments>> C :: 173.0200 CA :: 58.4132(D) CB :: 35.0857(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.2183(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 115.3653(D) Ave N Shift Values>> N :: 121.14(4.54) 1.E58 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.18 C 0.16 Q 0.14 R 0.13 W 0.11 K 0.09 M 0.08 E 0.06 C Shift Assignments>> C :: 176.0107 CA :: 52.6875(D) CB :: 29.7182(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.8306(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 125.9613(D) Ave N Shift Values>> N :: 120.67(3.48) 1.F59 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.21 Y 0.21 D 0.17 C 0.12 N 0.11 L 0.09 I 0.03 C Shift Assignments>> C :: 171.6354 CA :: 55.9991(D) CB :: 39.4876(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.6086(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 121.0343(D) Ave N Shift Values>> N :: 120.45(4.18) 1.D60 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.3 G 0.17 N 0.16 L 0.14 C 0.1 K 0.02 F 0.02 R 0.02 Y 0.01 C Shift Assignments>> CA :: 49.0696(D) CB :: 41.9081(D) Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.8412(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 119.9810(D) Ave N Shift Values>> N :: 120.65(3.86) 1.P61 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.4 V 0.32 C 0.15 I 0.04 W 0.04 R 0.01 C Shift Assignments>> C :: 177.9664 CA :: 63.0943(D) CB :: 31.2664(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.E62 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.16 K 0.16 H 0.12 W 0.12 C 0.12 E 0.11 R 0.09 L 0.03 M 0.02 I 0.02 HN Overlap>> 1.I146 1.I146 C Shift Assignments>> C :: 176.8223 CA :: 56.6343(D) CB :: 28.6869(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.4879(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 117.0218(D) Ave N Shift Values>> N :: 120.67(3.48) 1.V63 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.27 C 0.27 K 0.08 W 0.08 P 0.05 R 0.05 M 0.04 H 0.04 E 0.03 Q 0.03 C Shift Assignments>> CA :: 60.5739(D) CB :: 32.5037 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.1435(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 120.9721(D) Ave N Shift Values>> N :: 121.14(4.54) 1.I64 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.28 F 0.24 I 0.23 C 0.18 E 0.01 L 0.01 C Shift Assignments>> C :: 172.6600 CA :: 59.4164(D) CB :: 38.7763(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.2085(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 134.9833(D) Ave N Shift Values>> N :: 121.46(4.28) 1.H65 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.16 H 0.15 K 0.14 W 0.11 C 0.11 R 0.11 E 0.1 M 0.04 L 0.01 HN Overlap>> 1.S3 1.K115 1.S3 1.K115 C Shift Assignments>> C :: 178.1333 CA :: 55.1726(D) CB :: 29.1549(D) Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 8.1508(D) Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 120.3798(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.T66 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 177.3713 CA :: 65.9977(D) CB :: 67.0398(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 9.0064(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.1009(D) Ave N Shift Values>> N :: 115.42(4.75) 1.T67 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 177.0612 CA :: 64.5327(D) CB :: 67.6806(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.2411(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 112.9264(D) Ave N Shift Values>> N :: 115.42(4.75) 1.T68 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 176.8583 CA :: 65.1368(D) CB :: 67.6895(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.2905(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 120.5884(D) Ave N Shift Values>> N :: 115.42(4.75) 1.I69 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.46 C 0.3 I 0.06 P 0.06 K 0.02 Q 0.01 W 0.01 E 0.01 M 0.01 Y 0.01 C Shift Assignments>> C :: 178.8979 CA :: 62.3432(D) CB :: 34.2967(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.2931(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 121.7335(D) Ave N Shift Values>> N :: 121.46(4.28) 1.N70 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.3 D 0.21 F 0.13 Y 0.13 C 0.1 L 0.08 I 0.01 C Shift Assignments>> C :: 175.0826 CA :: 54.5977(D) CB :: 39.1861(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.3687(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 116.5561(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.A71 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.83 M 0.15 C Shift Assignments>> C :: 177.2469 CA :: 51.5692(D) CB :: 17.8360(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.1688(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 116.7929(D) Ave N Shift Values>> N :: 123.23(3.54) 1.T72 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 173.9250 CA :: 64.1113(D) CB :: 68.5493(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.3212(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 118.4879(D) Ave N Shift Values>> N :: 115.42(4.75) 1.R73 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.15 Q 0.14 C 0.14 W 0.13 E 0.11 H 0.11 R 0.07 I 0.05 L 0.03 M 0.01 C Shift Assignments>> C :: 175.3569 CA :: 57.6779(D) CB :: 28.4352(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.6410(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 129.3125(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.G74 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.62 L 0.2 R 0.07 C 0.04 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.8793 CA :: 44.7008(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.4680(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.4151(D) Ave N Shift Values>> N :: 109.67(3.87) 1.V75 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.44 V 0.34 C 0.13 I 0.02 W 0.02 C Shift Assignments>> C :: 175.7657 CA :: 63.5563(D) CB :: 31.4930(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.7420(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 121.1565(D) Ave N Shift Values>> N :: 121.14(4.54) 1.S76 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 174.9110 CA :: 58.9112(D) CB :: 62.1459(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.9328(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 119.8262(D) Ave N Shift Values>> N :: 116.28(3.52) 1.H77 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.16 R 0.16 C 0.12 W 0.12 E 0.11 Q 0.11 M 0.11 K 0.08 C Shift Assignments>> C :: 173.7892 CA :: 55.5834(D) CB :: 30.7963(D) Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 7.7496(D) Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 110.5564(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.F78 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.3 F 0.29 C 0.15 I 0.1 D 0.05 L 0.05 N 0.01 C Shift Assignments>> C :: 177.7288 CA :: 57.9687(D) CB :: 39.5443(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.9229(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 116.6547(D) Ave N Shift Values>> N :: 120.45(4.18) 1.V79 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.41 V 0.32 C 0.14 I 0.07 W 0.02 C Shift Assignments>> C :: 176.2077 CA :: 64.0178(D) CB :: 30.8485(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.2250(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.8793(D) Ave N Shift Values>> N :: 121.14(4.54) 1.R80 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.21 K 0.18 C 0.15 Q 0.14 R 0.09 H 0.09 W 0.05 E 0.03 V 0.01 C Shift Assignments>> C :: 174.8406 CA :: 55.5497(D) CB :: 32.8580(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.7046(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 128.1996(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.F81 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.29 F 0.26 C 0.16 I 0.08 D 0.07 L 0.04 N 0.04 E 0.01 HN Overlap>> 1.Y8 1.Y8 C Shift Assignments>> C :: 175.9107 CA :: 57.2636(D) CB :: 38.9844(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.7238(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 121.5458(D) Ave N Shift Values>> N :: 120.45(4.18) 1.G82 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.8 L 0.11 C 0.03 R 0.02 F 0.01 C Shift Assignments>> C :: 174.0700 CA :: 45.1568(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.4000(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 114.1821(D) Ave N Shift Values>> N :: 109.67(3.87) 1.A83 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.77 M 0.2 C 0.01 C Shift Assignments>> C :: 178.1902 CA :: 53.0891(D) CB :: 18.5508(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.7773(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 126.2488(D) Ave N Shift Values>> N :: 123.23(3.54) 1.S84 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> CA :: 56.3847(D) CB :: 63.1997(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.7882(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 113.3357(D) Ave N Shift Values>> N :: 116.28(3.52) 1.P85 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> V 0.47 C 0.21 P 0.21 W 0.02 K 0.01 I 0.01 C Shift Assignments>> C :: 175.8331 CA :: 62.5919(D) CB :: 33.2756(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.A86 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.82 M 0.16 C 0.01 C Shift Assignments>> CA :: 52.0224(D) CB :: 18.1302(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.5847(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.9832(D) Ave N Shift Values>> N :: 123.23(3.54) 1.I87 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.27 I 0.19 Y 0.18 E 0.17 F 0.11 M 0.02 V 0.01 K 0.01 HN Overlap>> 1.R160 1.R160 C Shift Assignments>> C :: 177.0230 CA :: 59.4797(D) CB :: 36.9822(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.0873(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 123.1867(D) Ave N Shift Values>> N :: 121.46(4.28) 1.V88 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.24 V 0.15 W 0.14 R 0.09 E 0.08 K 0.07 H 0.07 M 0.05 Q 0.03 P 0.02 I 0.01 C Shift Assignments>> CA :: 60.0534(D) CB :: 31.4585(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.9360(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 130.3954(D) Ave N Shift Values>> N :: 121.14(4.54) 1.P89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> V 0.36 P 0.34 C 0.17 W 0.04 I 0.01 K 0.01 R 0.01 C Shift Assignments>> CA :: 62.5168 CB :: 31.9573 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.S90 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 176.4778 CA :: 61.5946(D) CB :: 61.8835 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.2034 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 122.1418 Ave N Shift Values>> N :: 116.28(3.52) 1.A91 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.48 A 0.46 I 0.02 C 0.02 C Shift Assignments>> C :: 180.5247 CA :: 54.7156(D) CB :: 18.1090(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.9626(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.7554(D) Ave N Shift Values>> N :: 123.23(3.54) 1.V92 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.35 P 0.25 I 0.2 C 0.16 W 0.01 C Shift Assignments>> C :: 176.3979 CA :: 65.2956(D) CB :: 30.1929(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.2391(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 115.8254(D) Ave N Shift Values>> N :: 121.14(4.54) 1.I93 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.33 V 0.31 K 0.08 Q 0.06 M 0.04 W 0.03 I 0.02 P 0.02 R 0.02 E 0.02 H 0.01 Y 0.01 C Shift Assignments>> C :: 178.9383 CA :: 60.8206(D) CB :: 33.8955(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 6.6325(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.7523(D) Ave N Shift Values>> N :: 121.46(4.28) 1.H94 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.16 W 0.13 K 0.13 Q 0.12 E 0.1 I 0.09 R 0.09 H 0.09 L 0.02 M 0.01 C Shift Assignments>> C :: 177.4146 CA :: 58.5353(D) CB :: 28.3627(D) Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 8.3251(D) Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 117.6098(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.Q95 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.15 K 0.14 H 0.13 W 0.12 E 0.12 C 0.11 R 0.11 M 0.03 I 0.01 L 0.01 C Shift Assignments>> C :: 176.3611 CA :: 56.4265(D) CB :: 29.2079(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.4164(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 116.3898(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L96 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.33 L 0.18 N 0.17 F 0.09 Y 0.07 C 0.06 K 0.05 HN Overlap>> 1.D103 1.D103 C Shift Assignments>> C :: 177.7790 CA :: 54.0332(D) CB :: 40.6867(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.3133(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.7927(D) Ave N Shift Values>> N :: 121.86(3.9) 1.S97 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> CA :: 60.0382(D) CB :: 62.8262(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.6533(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 112.4958(D) Ave N Shift Values>> N :: 116.28(3.52) 1.V98 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.26 C 0.23 P 0.19 W 0.09 I 0.05 R 0.03 E 0.03 H 0.02 K 0.02 M 0.01 Q 0.01 C Shift Assignments>> C :: 175.9785 CA :: 61.7276(D) CB :: 31.1484(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.1752(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 115.0022(D) Ave N Shift Values>> N :: 121.14(4.54) 1.Y99 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.24 Y 0.22 E 0.16 F 0.15 I 0.14 M 0.02 C Shift Assignments>> C :: 174.6505 CA :: 58.5207(D) CB :: 37.4064(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.5199(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 122.0869(D) Ave N Shift Values>> N :: 120.52(4.2) 1.K100 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.24 C 0.18 H 0.12 K 0.12 R 0.12 W 0.06 Q 0.06 E 0.03 P 0.02 C Shift Assignments>> CA :: 52.8611(D) CB :: 32.2244(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.4957(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 125.3257(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P101 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.33 V 0.31 C 0.18 W 0.05 I 0.03 R 0.01 E 0.01 K 0.01 H 0.01 C Shift Assignments>> C :: 174.7320 CA :: 62.4561(D) CB :: 31.4265 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.K102 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.18 K 0.15 C 0.14 R 0.13 H 0.12 W 0.09 E 0.08 Q 0.05 V 0.01 HN Overlap>> 1.K161 1.K161 C Shift Assignments>> C :: 176.2781 CA :: 56.0036(D) CB :: 31.9497(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.2474(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.7900(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.D103 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.33 N 0.18 L 0.18 F 0.1 Y 0.08 C 0.06 K 0.04 HN Overlap>> 1.L96 1.L96 C Shift Assignments>> C :: 175.9167 CA :: 54.0875(D) CB :: 40.5919(D) Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.2514(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.7116(D) Ave N Shift Values>> N :: 120.65(3.86) 1.I104 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.37 C 0.23 Y 0.19 F 0.13 E 0.04 C Shift Assignments>> C :: 175.9759 CA :: 60.7311(D) CB :: 37.6768(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.9445(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.0657(D) Ave N Shift Values>> N :: 121.46(4.28) 1.V105 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.32 C 0.22 P 0.21 W 0.07 R 0.03 K 0.03 E 0.02 H 0.02 I 0.01 M 0.01 C Shift Assignments>> C :: 175.4216 CA :: 61.7000(D) CB :: 31.8089(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.1451(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 123.9316(D) Ave N Shift Values>> N :: 121.14(4.54) 1.D106 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.37 N 0.31 L 0.14 C 0.06 F 0.04 Y 0.03 K 0.02 C Shift Assignments>> CA :: 51.5290(D) CB :: 40.8232(D) Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.3644(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 125.1722(D) Ave N Shift Values>> N :: 120.65(3.86) 1.P107 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.45 V 0.35 C 0.12 I 0.02 W 0.02 C Shift Assignments>> C :: 175.7311 CA :: 63.6907(D) CB :: 31.5813(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.A108 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.82 M 0.16 C 0.01 HN Overlap>> 1.R43 1.R43 C Shift Assignments>> C :: 177.7727 CA :: 52.1134(D) CB :: 18.1508(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.0354(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 127.7792(D) Ave N Shift Values>> N :: 123.23(3.54) 1.T109 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> CA :: 59.2919(D) CB :: 69.3366(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.8287(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.2501(D) Ave N Shift Values>> N :: 115.42(4.75) 1.P110 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.33 V 0.29 C 0.18 I 0.06 W 0.06 R 0.01 E 0.01 H 0.01 C Shift Assignments>> C :: 176.2865 CA :: 62.6995(D) CB :: 31.0220(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.Y111 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.23 C 0.2 Y 0.15 E 0.13 F 0.11 M 0.05 D 0.05 I 0.02 L 0.01 C Shift Assignments>> CA :: 55.2070(D) CB :: 37.5265(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.3073(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 121.8578(D) Ave N Shift Values>> N :: 120.52(4.2) 1.P112 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.36 V 0.29 C 0.17 I 0.07 W 0.05 R 0.01 C Shift Assignments>> C :: 177.3343 CA :: 63.1364(D) CB :: 30.8419 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.G113 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.66 L 0.18 R 0.06 C 0.03 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.8017 CA :: 44.7871(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.8162(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.2331(D) Ave N Shift Values>> N :: 109.67(3.87) 1.D114 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.33 N 0.21 L 0.16 F 0.09 Y 0.07 C 0.06 K 0.03 C Shift Assignments>> C :: 176.1666 CA :: 53.8783(D) CB :: 40.4568(D) Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.1696(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 119.8062(D) Ave N Shift Values>> N :: 120.65(3.86) 1.K115 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.18 K 0.14 C 0.14 R 0.14 H 0.13 W 0.09 E 0.08 Q 0.06 V 0.01 HN Overlap>> 1.H65 1.H65 C Shift Assignments>> C :: 176.2350 CA :: 55.7530(D) CB :: 31.8792(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.1140(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.4288(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V116 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.32 P 0.27 C 0.2 W 0.06 I 0.02 R 0.02 K 0.02 E 0.01 H 0.01 M 0.01 HN Overlap>> 1.T34 1.T34 C Shift Assignments>> C :: 175.7169 CA :: 62.0759(D) CB :: 31.6514(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.0697(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 121.8930(D) Ave N Shift Values>> N :: 121.14(4.54) 1.I117 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.31 C 0.24 Y 0.19 F 0.13 E 0.07 C Shift Assignments>> C :: 175.9301 CA :: 60.3505(D) CB :: 37.4789(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.2278(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 125.5438(D) Ave N Shift Values>> N :: 121.46(4.28) 1.I118 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.3 C 0.25 Y 0.19 F 0.12 E 0.09 V 0.01 M 0.01 HN Overlap>> 1.C9 1.C9 C Shift Assignments>> C :: 176.2539 CA :: 60.2780(D) CB :: 37.3279(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.3123(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 125.8475(D) Ave N Shift Values>> N :: 121.46(4.28) 1.T119 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 174.4734 CA :: 61.2579(D) CB :: 69.3448(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.2086(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 117.9747(D) Ave N Shift Values>> N :: 115.42(4.75) 1.E120 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.15 K 0.14 H 0.13 E 0.13 W 0.13 C 0.11 R 0.11 M 0.03 I 0.01 C Shift Assignments>> C :: 177.1242 CA :: 56.6231(D) CB :: 29.3245(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.3832(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.9175(D) Ave N Shift Values>> N :: 120.67(3.48) 1.G121 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.83 L 0.1 C 0.02 R 0.01 F 0.01 C Shift Assignments>> C :: 176.4489 CA :: 45.2594(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.6011(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.3217(D) Ave N Shift Values>> N :: 109.67(3.87) 1.A122 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.74 M 0.23 C 0.01 HN Overlap>> 1.K161 1.K161 C Shift Assignments>> C :: 177.7949 CA :: 52.7819(D) CB :: 18.0678(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2447(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.6765(D) Ave N Shift Values>> N :: 123.23(3.54) 1.F123 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.29 F 0.23 C 0.2 I 0.14 E 0.05 D 0.02 L 0.01 N 0.01 M 0.01 C Shift Assignments>> C :: 176.4711 CA :: 58.2478(D) CB :: 38.3526(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.2972(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 118.3329(D) Ave N Shift Values>> N :: 120.45(4.18) 1.E124 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.15 C 0.14 W 0.14 Q 0.13 E 0.12 H 0.1 R 0.08 I 0.06 M 0.02 L 0.01 C Shift Assignments>> C :: 177.9713 CA :: 58.0361(D) CB :: 28.7402(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.4988(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.5164(D) Ave N Shift Values>> N :: 120.67(3.48) 1.G125 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.86 L 0.08 C 0.02 C Shift Assignments>> C :: 175.4753 CA :: 45.5579(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.4366(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.2290(D) Ave N Shift Values>> N :: 109.67(3.87) 1.F126 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.38 C 0.22 Y 0.19 F 0.14 E 0.03 C Shift Assignments>> C :: 176.9052 CA :: 60.8063(D) CB :: 37.8114(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.2552(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 120.1014(D) Ave N Shift Values>> N :: 120.45(4.18) 1.Q127 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.2 R 0.2 I 0.17 L 0.09 W 0.08 Q 0.08 H 0.05 E 0.04 K 0.04 C Shift Assignments>> C :: 178.3236 CA :: 58.8926(D) CB :: 26.8985(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.4210(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 118.4032(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A128 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.54 M 0.42 C 0.01 I 0.01 C Shift Assignments>> C :: 179.4022 CA :: 53.7425(D) CB :: 17.5481(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.5951(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.6675(D) Ave N Shift Values>> N :: 123.23(3.54) 1.I129 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.68 C 0.19 V 0.08 Y 0.02 F 0.01 C Shift Assignments>> C :: 176.1269 CA :: 65.5459(D) CB :: 37.0472(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.3931(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.4198(D) Ave N Shift Values>> N :: 121.46(4.28) 1.F130 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.25 C 0.23 I 0.19 F 0.18 E 0.09 M 0.01 C Shift Assignments>> C :: 176.1291 CA :: 59.0073(D) CB :: 37.7562(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.5432(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 111.4574(D) Ave N Shift Values>> N :: 120.45(4.18) 1.T131 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 173.5290 CA :: 60.8138(D) CB :: 69.2075(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.2731(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 106.1368(D) Ave N Shift Values>> N :: 115.42(4.75) 1.E132 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.18 H 0.17 R 0.12 Q 0.12 W 0.11 M 0.07 K 0.07 P 0.06 E 0.04 C Shift Assignments>> CA :: 51.9339(D) CB :: 29.7084(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.1915(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 127.6562(D) Ave N Shift Values>> N :: 120.67(3.48) 1.P133 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.45 V 0.37 C 0.11 I 0.02 W 0.01 C Shift Assignments>> C :: 176.6384 CA :: 64.0203(D) CB :: 31.6750(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.D134 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.29 L 0.27 K 0.13 R 0.07 N 0.06 F 0.05 C 0.04 Y 0.03 C Shift Assignments>> C :: 177.1247 CA :: 53.5062(D) CB :: 42.0486(D) Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 9.6264(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 122.5344(D) Ave N Shift Values>> N :: 120.65(3.86) 1.G135 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.78 C 0.09 L 0.04 P 0.03 A 0.03 C Shift Assignments>> C :: 175.3584 CA :: 47.5143(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.4618(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 116.4038(D) Ave N Shift Values>> N :: 109.67(3.87) 1.E136 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.18 I 0.16 R 0.15 W 0.11 Q 0.09 K 0.07 E 0.07 H 0.06 L 0.05 HN Overlap>> 1.I150 1.I150 C Shift Assignments>> C :: 179.9410 CA :: 58.9992(D) CB :: 27.5859(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.2462(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 121.1479(D) Ave N Shift Values>> N :: 120.67(3.48) 1.A137 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.62 A 0.33 I 0.02 C 0.01 C Shift Assignments>> C :: 181.2860 CA :: 54.5596(D) CB :: 16.9996(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.9684(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.4317(D) Ave N Shift Values>> N :: 123.23(3.54) 1.R138 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.25 I 0.17 V 0.16 W 0.12 P 0.1 E 0.04 R 0.03 H 0.03 K 0.02 Q 0.01 C Shift Assignments>> CA :: 61.8973(D) CB :: 30.1134(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.5560(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 119.4613(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.S139 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.3416 CA :: 61.7836(D) CB :: 62.1367 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.6926 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 116.5624 Ave N Shift Values>> N :: 116.28(3.52) 1.M140 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.16 W 0.14 R 0.14 E 0.13 H 0.12 K 0.08 Q 0.08 M 0.07 V 0.03 I 0.01 C Shift Assignments>> C :: 179.3339 CA :: 58.0578(D) CB :: 30.9680(D) Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 7.7586 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 120.0565 Ave N Shift Values>> N :: 120.09(3.57) 1.L141 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.21 K 0.19 Y 0.17 L 0.15 D 0.09 C 0.09 I 0.03 R 0.02 C Shift Assignments>> C :: 180.4634 CA :: 57.6199(D) CB :: 41.2950(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.9260(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.8101(D) Ave N Shift Values>> N :: 121.86(3.9) 1.L142 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.3 F 0.27 C 0.17 I 0.09 D 0.05 L 0.04 N 0.03 E 0.01 HN Overlap>> 1.V154 1.V154 C Shift Assignments>> C :: 177.8671 CA :: 57.5644(D) CB :: 38.9622(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.0771(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.4530(D) Ave N Shift Values>> N :: 121.86(3.9) 1.L143 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.3 F 0.29 C 0.15 I 0.11 D 0.05 L 0.05 N 0.01 C Shift Assignments>> C :: 179.7148 CA :: 57.9924(D) CB :: 39.4880(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.1139(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.1462(D) Ave N Shift Values>> N :: 121.86(3.9) 1.N144 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.2 Y 0.19 N 0.18 F 0.14 E 0.11 D 0.05 M 0.04 I 0.03 L 0.02 C Shift Assignments>> C :: 177.1399 CA :: 55.6295(D) CB :: 37.7722(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.7093(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 116.4224(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.L145 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.25 Y 0.21 K 0.14 L 0.12 C 0.1 D 0.07 I 0.05 R 0.01 C Shift Assignments>> C :: 179.1058 CA :: 57.9749(D) CB :: 41.0129(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.9235(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.2474(D) Ave N Shift Values>> N :: 121.86(3.9) 1.I146 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.65 C 0.2 V 0.09 Y 0.02 F 0.01 HN Overlap>> 1.E62 1.E62 C Shift Assignments>> C :: 176.7374 CA :: 65.1018(D) CB :: 36.9383(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.4852(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 116.9118(D) Ave N Shift Values>> N :: 121.46(4.28) 1.N147 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.2 N 0.19 C 0.18 F 0.16 D 0.08 E 0.06 L 0.03 I 0.03 M 0.02 C Shift Assignments>> C :: 176.4625 CA :: 55.6689(D) CB :: 38.1173(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.7303(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 117.2984(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.K148 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.18 W 0.13 R 0.12 K 0.11 H 0.1 E 0.1 M 0.1 V 0.05 Q 0.05 C Shift Assignments>> C :: 178.4942 CA :: 58.4863(D) CB :: 31.5980(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.8638(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 118.6341(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E149 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.15 Q 0.14 W 0.13 C 0.13 E 0.12 H 0.11 R 0.09 I 0.04 M 0.02 L 0.02 C Shift Assignments>> C :: 178.9202 CA :: 57.4766(D) CB :: 28.7584(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.2301(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.7551(D) Ave N Shift Values>> N :: 120.67(3.48) 1.I150 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.63 C 0.21 V 0.05 Y 0.05 F 0.03 HN Overlap>> 1.E136 1.E136 C Shift Assignments>> C :: 178.1569 CA :: 63.9123(D) CB :: 37.1172(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.2770(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 121.2309(D) Ave N Shift Values>> N :: 121.46(4.28) 1.K151 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.16 R 0.13 W 0.12 K 0.11 H 0.11 M 0.11 E 0.11 Q 0.06 V 0.03 C Shift Assignments>> C :: 177.7570 CA :: 57.8684(D) CB :: 31.5069(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.0260(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.9175(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.H152 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.16 K 0.16 H 0.13 W 0.12 C 0.11 E 0.11 R 0.09 L 0.03 M 0.02 I 0.01 C Shift Assignments>> C :: 175.3682 CA :: 56.2052(D) CB :: 28.7385(D) Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 8.0617(D) Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 117.2096(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.S153 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 174.8654 CA :: 58.9038(D) CB :: 63.2361(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.0857(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 115.7257(D) Ave N Shift Values>> N :: 116.28(3.52) 1.V154 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.34 V 0.31 C 0.18 W 0.05 I 0.03 R 0.01 E 0.01 H 0.01 K 0.01 HN Overlap>> 1.L142 1.L142 C Shift Assignments>> C :: 176.8014 CA :: 62.5850 CB :: 31.3632 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.0159 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 121.4746 Ave N Shift Values>> N :: 121.14(4.54) 1.K155 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.18 K 0.15 C 0.14 R 0.13 H 0.12 W 0.09 E 0.08 Q 0.05 V 0.01 C Shift Assignments>> C :: 176.5331 CA :: 55.9918 CB :: 31.9646 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.3276 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.6090 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.N156 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.55 D 0.11 C 0.11 Y 0.07 F 0.06 L 0.02 E 0.01 M 0.01 C Shift Assignments>> C :: 175.5897 CA :: 53.2496 CB :: 38.2244 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.4064 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.6073 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.T157 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.5470 CA :: 61.8592 CB :: 69.0723 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.1340 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 114.2010 Ave N Shift Values>> N :: 115.42(4.75) 1.E158 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.15 K 0.14 H 0.14 W 0.12 E 0.12 R 0.11 C 0.11 M 0.04 I 0.01 L 0.01 C Shift Assignments>> C :: 176.0786 CA :: 56.1524 CB :: 29.2734(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.3107 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.7736 Ave N Shift Values>> N :: 120.67(3.48) 1.F159 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.29 F 0.24 C 0.18 I 0.09 D 0.04 E 0.03 N 0.03 L 0.03 M 0.01 C Shift Assignments>> C :: 175.4120 CA :: 57.4567(D) CB :: 38.5492(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.2241(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 121.3754(D) Ave N Shift Values>> N :: 120.45(4.18) 1.R160 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.16 R 0.14 Q 0.14 W 0.12 E 0.12 C 0.11 K 0.08 M 0.07 HN Overlap>> 1.I87 1.I87 C Shift Assignments>> C :: 175.2093 CA :: 55.3290(D) CB :: 30.0815(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.0817(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 123.2037(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.K161 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.18 K 0.14 C 0.14 R 0.14 H 0.13 W 0.09 E 0.07 Q 0.05 V 0.01 HN Overlap>> 1.A122 1.K102 1.A122 1.K102 C Shift Assignments>> C :: 175.4291 CA :: 55.8123(D) CB :: 31.9196(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.2892(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.7365(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L162 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.22 L 0.22 D 0.16 F 0.13 Y 0.1 C 0.06 R 0.05 N 0.01 I 0.01 C Shift Assignments>> CA :: 56.25(D) CB :: 41.6512 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.9515(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 130.0535(D) Ave N Shift Values>> N :: 121.86(3.9) ########################################################################### Overall Results: #Consistent: 5 #Clerical: 157 #Suspicious: 0 #Anomalous: 0 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 162 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 0 Shift Relative Order (SRO) Results: #Consistent: 162 #Suspicious: 0 C Shift Results: #Consistent: 162 #Duplicate: 299 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 8 #Duplicate: 142 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 N Shift Results: #Consistent: 8 #Duplicate: 142 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.M1 CA = 54.7286(D), Expected = 56.11, Std = 2.2300, ChiSquare = 5.3561e-01 1.M1 CB = 32.2529(D), Expected = 32.99, Std = 2.2400, ChiSquare = 7.4211e-01 1.Q2 CA = 56.0643(D), Expected = 56.57, Std = 2.1400, ChiSquare = 8.1319e-01 1.Q2 CB = 28.6520(D), Expected = 29.19, Std = 1.8200, ChiSquare = 7.6753e-01 1.Q2 H = 8.9679(D), Expected = 8.22, Std = 0.5900, ChiSquare = 2.0493e-01 1.Q2 N = 123.8193(D), Expected = 119.89, Std = 3.6000, ChiSquare = 2.7507e-01 1.S3 CA = 57.3458(D), Expected = 58.72, Std = 2.0700, ChiSquare = 5.0678e-01 1.S3 CB = 66.4754(D), Expected = 63.80, Std = 1.4800, ChiSquare = 7.0653e-02 1.S3 H = 8.2127(D), Expected = 8.28, Std = 0.5900, ChiSquare = 9.0918e-01 1.S3 N = 120.3031(D), Expected = 116.28, Std = 3.5200, ChiSquare = 2.5307e-01 1.W4 CA = 56.9544(D), Expected = 57.66, Std = 2.5800, ChiSquare = 7.8448e-01 1.W4 CB = 30.3024(D), Expected = 30.01, Std = 2.0100, ChiSquare = 8.8434e-01 1.W4 H = 8.4146(D), Expected = 8.29, Std = 0.7900, ChiSquare = 8.7468e-01 1.W4 N = 120.0040(D), Expected = 121.68, Std = 4.1800, ChiSquare = 6.8845e-01 1.Y5 CA = 56.4267(D), Expected = 58.13, Std = 2.5100, ChiSquare = 4.9739e-01 1.Y5 CB = 41.6371(D), Expected = 39.32, Std = 2.1600, ChiSquare = 2.8339e-01 1.Y5 H = 10.0496(D), Expected = 8.32, Std = 0.7300, ChiSquare = 1.7821e-02 1.Y5 N = 120.3385(D), Expected = 120.52, Std = 4.2000, ChiSquare = 9.6553e-01 1.L6 CA = 53.7741(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.8615e-01 1.L6 CB = 45.0949(D), Expected = 42.31, Std = 1.8800, ChiSquare = 1.3852e-01 1.L6 H = 10.0807(D), Expected = 8.23, Std = 0.6500, ChiSquare = 4.4101e-03 1.L6 N = 123.3173(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.0865e-01 1.L7 CA = 52.1120(D), Expected = 55.62, Std = 2.1300, ChiSquare = 9.9569e-02 1.L7 CB = 43.4407(D), Expected = 42.31, Std = 1.8800, ChiSquare = 5.4755e-01 1.L7 H = 9.1152(D), Expected = 8.23, Std = 0.6500, ChiSquare = 1.7325e-01 1.L7 N = 124.0319(D), Expected = 121.86, Std = 3.9000, ChiSquare = 5.7760e-01 1.Y8 CA = 56.2160(D), Expected = 58.13, Std = 2.5100, ChiSquare = 4.4573e-01 1.Y8 CB = 39.1265(D), Expected = 39.32, Std = 2.1600, ChiSquare = 9.2862e-01 1.Y8 H = 8.7480(D), Expected = 8.32, Std = 0.7300, ChiSquare = 5.5767e-01 1.Y8 N = 121.5912(D), Expected = 120.52, Std = 4.2000, ChiSquare = 7.9869e-01 1.C9 CA = 58.7738(D), Expected = 58.30, Std = 3.3300, ChiSquare = 8.8686e-01 1.C9 CB = 28.4808(D), Expected = 32.49, Std = 6.0100, ChiSquare = 5.0472e-01 1.C9 H = 8.3595(D), Expected = 8.39, Std = 0.6700, ChiSquare = 9.6369e-01 1.C9 N = 125.9239(D), Expected = 120.17, Std = 4.6400, ChiSquare = 2.1495e-01 1.K10 CA = 55.9603(D), Expected = 56.95, Std = 2.2000, ChiSquare = 6.5281e-01 1.K10 CB = 31.9661(D), Expected = 32.79, Std = 1.7800, ChiSquare = 6.4346e-01 1.K10 H = 8.0420(D), Expected = 8.19, Std = 0.6000, ChiSquare = 8.0517e-01 1.K10 N = 118.4292(D), Expected = 121.05, Std = 3.7700, ChiSquare = 4.8695e-01 1.R11 CA = 57.9401(D), Expected = 56.77, Std = 2.3100, ChiSquare = 6.1248e-01 1.R11 CB = 28.8680(D), Expected = 30.70, Std = 1.8300, ChiSquare = 3.1678e-01 1.R11 H = 8.3780(D), Expected = 8.24, Std = 0.6100, ChiSquare = 8.2102e-01 1.R11 N = 124.0062(D), Expected = 120.80, Std = 3.6800, ChiSquare = 3.8362e-01 1.G12 CA = 45.4261(D), Expected = 45.35, Std = 1.3400, ChiSquare = 9.5471e-01 1.G12 H = 8.7161(D), Expected = 8.33, Std = 0.6500, ChiSquare = 5.5251e-01 1.G12 N = 113.8863(D), Expected = 109.67, Std = 3.8700, ChiSquare = 2.7594e-01 1.Q13 CA = 54.9128(D), Expected = 56.57, Std = 2.1400, ChiSquare = 4.3870e-01 1.Q13 CB = 28.9493(D), Expected = 29.19, Std = 1.8200, ChiSquare = 8.9478e-01 1.Q13 H = 8.1255(D), Expected = 8.22, Std = 0.5900, ChiSquare = 8.7275e-01 1.Q13 N = 116.4181(D), Expected = 119.89, Std = 3.6000, ChiSquare = 3.3484e-01 1.L14 CA = 59.7650(D), Expected = 55.62, Std = 2.1300, ChiSquare = 5.1654e-02 1.L14 CB = 40.9381(D), Expected = 42.31, Std = 1.8800, ChiSquare = 4.6555e-01 1.L14 H = 7.8224(D), Expected = 8.23, Std = 0.6500, ChiSquare = 5.3061e-01 1.L14 N = 122.9083(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.8809e-01 1.Q15 CA = 59.1149(D), Expected = 56.57, Std = 2.1400, ChiSquare = 2.3436e-01 1.Q15 CB = 26.6228(D), Expected = 29.19, Std = 1.8200, ChiSquare = 1.5838e-01 1.Q15 H = 8.5443(D), Expected = 8.22, Std = 0.5900, ChiSquare = 5.8255e-01 1.Q15 N = 116.6623(D), Expected = 119.89, Std = 3.6000, ChiSquare = 3.6994e-01 1.R16 CA = 58.0035(D), Expected = 56.77, Std = 2.3100, ChiSquare = 5.9335e-01 1.R16 CB = 29.0179(D), Expected = 30.70, Std = 1.8300, ChiSquare = 3.5800e-01 1.R16 H = 7.5630(D), Expected = 8.24, Std = 0.6100, ChiSquare = 2.6707e-01 1.R16 N = 119.4249(D), Expected = 120.80, Std = 3.6800, ChiSquare = 7.0865e-01 1.A17 CA = 55.0101(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.4492e-01 1.A17 CB = 17.2929(D), Expected = 19.01, Std = 1.8300, ChiSquare = 3.4809e-01 1.A17 H = 8.1668(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.5587e-01 1.A17 N = 124.1053(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.0471e-01 1.Q18 CA = 59.1057(D), Expected = 56.57, Std = 2.1400, ChiSquare = 2.3605e-01 1.Q18 CB = 26.8839(D), Expected = 29.19, Std = 1.8200, ChiSquare = 2.0512e-01 1.Q18 H = 8.8705(D), Expected = 8.22, Std = 0.5900, ChiSquare = 2.7023e-01 1.Q18 N = 117.6272(D), Expected = 119.89, Std = 3.6000, ChiSquare = 5.2964e-01 1.E19 CA = 59.0047(D), Expected = 57.32, Std = 2.0900, ChiSquare = 4.2020e-01 1.E19 CB = 28.5115(D), Expected = 30.01, Std = 1.7200, ChiSquare = 3.8363e-01 1.E19 H = 8.1506(D), Expected = 8.33, Std = 0.5900, ChiSquare = 7.6108e-01 1.E19 N = 117.6840(D), Expected = 120.67, Std = 3.4800, ChiSquare = 3.9087e-01 1.H20 CA = 59.4381(D), Expected = 56.52, Std = 2.3100, ChiSquare = 2.0650e-01 1.H20 CB = 29.5922(D), Expected = 30.24, Std = 2.0700, ChiSquare = 7.5432e-01 1.H20 H = 7.9267(D), Expected = 8.24, Std = 0.6800, ChiSquare = 6.4499e-01 1.H20 N = 116.7870(D), Expected = 119.69, Std = 4.0000, ChiSquare = 4.6799e-01 1.L21 CA = 57.8682(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.9120e-01 1.L21 CB = 39.7198(D), Expected = 42.31, Std = 1.8800, ChiSquare = 1.6828e-01 1.L21 H = 8.8004(D), Expected = 8.23, Std = 0.6500, ChiSquare = 3.8019e-01 1.L21 N = 122.1417(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.4242e-01 1.E22 CA = 59.3161(D), Expected = 57.32, Std = 2.0900, ChiSquare = 3.3954e-01 1.E22 CB = 27.9733(D), Expected = 30.01, Std = 1.7200, ChiSquare = 2.3636e-01 1.E22 H = 9.0704(D), Expected = 8.33, Std = 0.5900, ChiSquare = 2.0951e-01 1.E22 N = 121.3022(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.5584e-01 1.R23 CA = 58.1376(D), Expected = 56.77, Std = 2.3100, ChiSquare = 5.5383e-01 1.R23 CB = 29.2461(D), Expected = 30.70, Std = 1.8300, ChiSquare = 4.2692e-01 1.R23 H = 7.5630(D), Expected = 8.24, Std = 0.6100, ChiSquare = 2.6707e-01 1.R23 N = 118.7641(D), Expected = 120.80, Std = 3.6800, ChiSquare = 5.8010e-01 1.Q24 CA = 54.7107(D), Expected = 56.57, Std = 2.1400, ChiSquare = 3.8494e-01 1.Q24 CB = 29.0739(D), Expected = 29.19, Std = 1.8200, ChiSquare = 9.4914e-01 1.Q24 H = 7.4423(D), Expected = 8.22, Std = 0.5900, ChiSquare = 1.8746e-01 1.Q24 N = 117.6826(D), Expected = 119.89, Std = 3.6000, ChiSquare = 5.3977e-01 1.A25 CA = 52.8436(D), Expected = 53.14, Std = 1.9800, ChiSquare = 8.8100e-01 1.A25 CB = 15.2172(D), Expected = 19.01, Std = 1.8300, ChiSquare = 3.8212e-02 1.A25 H = 7.8429(D), Expected = 8.20, Std = 0.6000, ChiSquare = 5.5173e-01 1.A25 N = 116.7200(D), Expected = 123.23, Std = 3.5400, ChiSquare = 6.5918e-02 1.V26 CA = 61.6170(D), Expected = 62.49, Std = 2.8600, ChiSquare = 7.6018e-01 1.V26 CB = 31.3686(D), Expected = 32.73, Std = 1.7900, ChiSquare = 4.4692e-01 1.V26 H = 7.5657(D), Expected = 8.29, Std = 0.6700, ChiSquare = 2.7968e-01 1.V26 N = 120.4848(D), Expected = 121.14, Std = 4.5400, ChiSquare = 8.8525e-01 1.N27 CA = 52.7518(D), Expected = 53.54, Std = 1.8800, ChiSquare = 6.7503e-01 1.N27 CB = 38.5303(D), Expected = 38.69, Std = 1.6900, ChiSquare = 9.2471e-01 1.N27 H = 7.7546(D), Expected = 8.34, Std = 0.6300, ChiSquare = 3.5278e-01 1.N27 N = 124.6600(D), Expected = 118.93, Std = 4.0300, ChiSquare = 1.5507e-01 1.C28 CA = 57.5428(D), Expected = 58.30, Std = 3.3300, ChiSquare = 8.2012e-01 1.C28 CB = 31.7162(D), Expected = 32.49, Std = 6.0100, ChiSquare = 8.9755e-01 1.C28 H = 8.8752(D), Expected = 8.39, Std = 0.6700, ChiSquare = 4.6896e-01 1.C28 N = 119.4267(D), Expected = 120.17, Std = 4.6400, ChiSquare = 8.7273e-01 1.L29 CA = 55.0701(D), Expected = 55.62, Std = 2.1300, ChiSquare = 7.9628e-01 1.L29 CB = 45.6113(D), Expected = 42.31, Std = 1.8800, ChiSquare = 7.9087e-02 1.L29 H = 9.4706(D), Expected = 8.23, Std = 0.6500, ChiSquare = 5.6312e-02 1.L29 N = 123.7647(D), Expected = 121.86, Std = 3.9000, ChiSquare = 6.2528e-01 1.A30 CA = 48.8638(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.0796e-02 1.A30 CB = 18.4093(D), Expected = 19.01, Std = 1.8300, ChiSquare = 7.4272e-01 1.A30 H = 9.1104(D), Expected = 8.20, Std = 0.6000, ChiSquare = 1.2918e-01 1.A30 N = 128.9631(D), Expected = 123.23, Std = 3.5400, ChiSquare = 1.0534e-01 1.P31 CA = 62.5473(D), Expected = 63.33, Std = 1.5200, ChiSquare = 6.0660e-01 1.P31 CB = 31.6867(D), Expected = 31.85, Std = 1.1800, ChiSquare = 8.8993e-01 1.M32 CA = 53.1202(D), Expected = 56.11, Std = 2.2300, ChiSquare = 1.8001e-01 1.M32 CB = 33.6640(D), Expected = 32.99, Std = 2.2400, ChiSquare = 7.6350e-01 1.M32 H = 8.7834(D), Expected = 8.26, Std = 0.6000, ChiSquare = 3.8303e-01 1.M32 N = 121.4156(D), Expected = 120.09, Std = 3.5700, ChiSquare = 7.1040e-01 1.I33 CA = 59.2274(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.7399e-01 1.I33 CB = 41.3761(D), Expected = 38.63, Std = 2.0200, ChiSquare = 1.7400e-01 1.I33 H = 9.2998(D), Expected = 8.28, Std = 0.6800, ChiSquare = 1.3369e-01 1.I33 N = 120.2447(D), Expected = 121.46, Std = 4.2800, ChiSquare = 7.7645e-01 1.T34 CA = 61.0782(D), Expected = 62.22, Std = 2.5900, ChiSquare = 6.5932e-01 1.T34 CB = 69.0649(D), Expected = 69.73, Std = 1.6300, ChiSquare = 6.8325e-01 1.T34 H = 8.1703(D), Expected = 8.24, Std = 0.6200, ChiSquare = 9.1049e-01 1.T34 N = 121.8888(D), Expected = 115.42, Std = 4.7500, ChiSquare = 1.7324e-01 1.L35 CA = 53.0100(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.2044e-01 1.L35 CB = 44.2078(D), Expected = 42.31, Std = 1.8800, ChiSquare = 3.1275e-01 1.L35 H = 8.9525(D), Expected = 8.23, Std = 0.6500, ChiSquare = 2.6634e-01 1.L35 N = 127.4218(D), Expected = 121.86, Std = 3.9000, ChiSquare = 1.5384e-01 1.E36 CA = 55.3563(D), Expected = 57.32, Std = 2.0900, ChiSquare = 3.4744e-01 1.E36 CB = 29.9178(D), Expected = 30.01, Std = 1.7200, ChiSquare = 9.5725e-01 1.E36 H = 8.5188(D), Expected = 8.33, Std = 0.5900, ChiSquare = 7.4897e-01 1.E36 N = 120.3632(D), Expected = 120.67, Std = 3.4800, ChiSquare = 9.2975e-01 1.K37 CA = 54.1454(D), Expected = 56.95, Std = 2.2000, ChiSquare = 2.0237e-01 1.K37 CB = 35.5969(D), Expected = 32.79, Std = 1.7800, ChiSquare = 1.1482e-01 1.K37 H = 8.8785(D), Expected = 8.19, Std = 0.6000, ChiSquare = 2.5117e-01 1.K37 N = 124.7289(D), Expected = 121.05, Std = 3.7700, ChiSquare = 3.2915e-01 1.I38 CA = 60.0056(D), Expected = 61.61, Std = 2.6800, ChiSquare = 5.4940e-01 1.I38 CB = 35.0916(D), Expected = 38.63, Std = 2.0200, ChiSquare = 7.9828e-02 1.I38 H = 8.6488(D), Expected = 8.28, Std = 0.6800, ChiSquare = 5.8758e-01 1.I38 N = 121.7167(D), Expected = 121.46, Std = 4.2800, ChiSquare = 9.5217e-01 1.V39 CA = 61.3729(D), Expected = 62.49, Std = 2.8600, ChiSquare = 6.9610e-01 1.V39 CB = 33.0641(D), Expected = 32.73, Std = 1.7900, ChiSquare = 8.5194e-01 1.V39 H = 8.6679(D), Expected = 8.29, Std = 0.6700, ChiSquare = 5.7273e-01 1.V39 N = 129.6892(D), Expected = 121.14, Std = 4.5400, ChiSquare = 5.9689e-02 1.R40 CA = 56.8222(D), Expected = 56.77, Std = 2.3100, ChiSquare = 9.8197e-01 1.R40 CB = 26.9537(D), Expected = 30.70, Std = 1.8300, ChiSquare = 4.0643e-02 1.R40 H = 9.6594(D), Expected = 8.24, Std = 0.6100, ChiSquare = 1.9971e-02 1.R40 N = 128.5146(D), Expected = 120.80, Std = 3.6800, ChiSquare = 3.6050e-02 1.G41 CA = 44.9949(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.9101e-01 1.G41 H = 8.2039(D), Expected = 8.33, Std = 0.6500, ChiSquare = 8.4618e-01 1.G41 N = 102.1044(D), Expected = 109.67, Std = 3.8700, ChiSquare = 5.0591e-02 1.K42 CA = 54.0390(D), Expected = 56.95, Std = 2.2000, ChiSquare = 1.8577e-01 1.K42 CB = 34.0909(D), Expected = 32.79, Std = 1.7800, ChiSquare = 4.6488e-01 1.K42 H = 7.7712(D), Expected = 8.19, Std = 0.6000, ChiSquare = 4.8518e-01 1.K42 N = 120.7186(D), Expected = 121.05, Std = 3.7700, ChiSquare = 9.2995e-01 1.R43 CA = 57.2344(D), Expected = 56.77, Std = 2.3100, ChiSquare = 8.4067e-01 1.R43 CB = 28.9758(D), Expected = 30.70, Std = 1.8300, ChiSquare = 3.4610e-01 1.R43 H = 8.9995(D), Expected = 8.24, Std = 0.6100, ChiSquare = 2.1310e-01 1.R43 N = 127.7293(D), Expected = 120.80, Std = 3.6800, ChiSquare = 5.9706e-02 1.T44 CA = 61.1906(D), Expected = 62.22, Std = 2.5900, ChiSquare = 6.9103e-01 1.T44 CB = 71.5450(D), Expected = 69.73, Std = 1.6300, ChiSquare = 2.6550e-01 1.T44 H = 9.1936(D), Expected = 8.24, Std = 0.6200, ChiSquare = 1.2403e-01 1.T44 N = 123.6127(D), Expected = 115.42, Std = 4.7500, ChiSquare = 8.4567e-02 1.A45 CA = 51.3323(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.6125e-01 1.A45 CB = 17.9682(D), Expected = 19.01, Std = 1.8300, ChiSquare = 5.6916e-01 1.A45 H = 8.5062(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.0982e-01 1.A45 N = 128.2312(D), Expected = 123.23, Std = 3.5400, ChiSquare = 1.5772e-01 1.V46 CA = 60.4764(D), Expected = 62.49, Std = 2.8600, ChiSquare = 4.8140e-01 1.V46 CB = 34.1526(D), Expected = 32.73, Std = 1.7900, ChiSquare = 4.2676e-01 1.V46 H = 9.0990(D), Expected = 8.29, Std = 0.6700, ChiSquare = 2.2725e-01 1.V46 N = 123.6562(D), Expected = 121.14, Std = 4.5400, ChiSquare = 5.7942e-01 1.S47 CA = 56.4169(D), Expected = 58.72, Std = 2.0700, ChiSquare = 2.6588e-01 1.S47 CB = 63.3051(D), Expected = 63.80, Std = 1.4800, ChiSquare = 7.3808e-01 1.S47 H = 8.5230(D), Expected = 8.28, Std = 0.5900, ChiSquare = 6.8044e-01 1.S47 N = 119.7945(D), Expected = 116.28, Std = 3.5200, ChiSquare = 3.1807e-01 1.E48 CA = 52.7678(D), Expected = 57.32, Std = 2.0900, ChiSquare = 2.9400e-02 1.E48 CB = 30.3295(D), Expected = 30.01, Std = 1.7200, ChiSquare = 8.5264e-01 1.E48 H = 9.2399(D), Expected = 8.33, Std = 0.5900, ChiSquare = 1.2302e-01 1.E48 N = 124.2049(D), Expected = 120.67, Std = 3.4800, ChiSquare = 3.0974e-01 1.P49 CA = 63.0100(D), Expected = 63.33, Std = 1.5200, ChiSquare = 8.3326e-01 1.P49 CB = 31.0665(D), Expected = 31.85, Std = 1.1800, ChiSquare = 5.0670e-01 1.L50 CA = 57.4164(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.9902e-01 1.L50 CB = 41.2706(D), Expected = 42.31, Std = 1.8800, ChiSquare = 5.8035e-01 1.L50 H = 8.6865(D), Expected = 8.23, Std = 0.6500, ChiSquare = 4.8249e-01 1.L50 N = 127.0182(D), Expected = 121.86, Std = 3.9000, ChiSquare = 1.8596e-01 1.F51 CA = 51.5843(D), Expected = 58.08, Std = 2.5700, ChiSquare = 1.1487e-02 1.F51 CB = 37.8106(D), Expected = 39.99, Std = 2.0900, ChiSquare = 2.9705e-01 1.F51 H = 8.9056(D), Expected = 8.36, Std = 0.7200, ChiSquare = 4.4858e-01 1.F51 N = 115.2229(D), Expected = 120.45, Std = 4.1800, ChiSquare = 2.1112e-01 1.P52 CA = 64.2407(D), Expected = 63.33, Std = 1.5200, ChiSquare = 5.4908e-01 1.P52 CB = 30.5772(D), Expected = 31.85, Std = 1.1800, ChiSquare = 2.8075e-01 1.N53 CA = 55.9261(D), Expected = 53.54, Std = 1.8800, ChiSquare = 2.0437e-01 1.N53 CB = 37.1085(D), Expected = 38.69, Std = 1.6900, ChiSquare = 3.4938e-01 1.N53 H = 9.1130(D), Expected = 8.34, Std = 0.6300, ChiSquare = 2.1983e-01 1.N53 N = 113.4118(D), Expected = 118.93, Std = 4.0300, ChiSquare = 1.7091e-01 1.Y54 CA = 58.1605(D), Expected = 58.13, Std = 2.5100, ChiSquare = 9.9030e-01 1.Y54 CB = 38.9500(D), Expected = 39.32, Std = 2.1600, ChiSquare = 8.6399e-01 1.Y54 H = 7.8420(D), Expected = 8.32, Std = 0.7300, ChiSquare = 5.1260e-01 1.Y54 N = 118.0031(D), Expected = 120.52, Std = 4.2000, ChiSquare = 5.4900e-01 1.L55 CA = 53.1465(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.4553e-01 1.L55 CB = 46.9127(D), Expected = 42.31, Std = 1.8800, ChiSquare = 1.4355e-02 1.L55 H = 9.1135(D), Expected = 8.23, Std = 0.6500, ChiSquare = 1.7407e-01 1.L55 N = 122.8989(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.8994e-01 1.F56 CA = 57.6928(D), Expected = 58.08, Std = 2.5700, ChiSquare = 8.8024e-01 1.F56 CB = 39.0221(D), Expected = 39.99, Std = 2.0900, ChiSquare = 6.4329e-01 1.F56 H = 8.7901(D), Expected = 8.36, Std = 0.7200, ChiSquare = 5.5027e-01 1.F56 N = 125.7675(D), Expected = 120.45, Std = 4.1800, ChiSquare = 2.0333e-01 1.V57 CA = 58.4132(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.5403e-01 1.V57 CB = 35.0857(D), Expected = 32.73, Std = 1.7900, ChiSquare = 1.8816e-01 1.V57 H = 9.2183(D), Expected = 8.29, Std = 0.6700, ChiSquare = 1.6589e-01 1.V57 N = 115.3653(D), Expected = 121.14, Std = 4.5400, ChiSquare = 2.0339e-01 1.E58 CA = 52.6875(D), Expected = 57.32, Std = 2.0900, ChiSquare = 2.6657e-02 1.E58 CB = 29.7182(D), Expected = 30.01, Std = 1.7200, ChiSquare = 8.6528e-01 1.E58 H = 8.8306(D), Expected = 8.33, Std = 0.5900, ChiSquare = 3.9617e-01 1.E58 N = 125.9613(D), Expected = 120.67, Std = 3.4800, ChiSquare = 1.2839e-01 1.F59 CA = 55.9991(D), Expected = 58.08, Std = 2.5700, ChiSquare = 4.1812e-01 1.F59 CB = 39.4876(D), Expected = 39.99, Std = 2.0900, ChiSquare = 8.1003e-01 1.F59 H = 8.6086(D), Expected = 8.36, Std = 0.7200, ChiSquare = 7.2989e-01 1.F59 N = 121.0343(D), Expected = 120.45, Std = 4.1800, ChiSquare = 8.8883e-01 1.D60 CA = 49.0696(D), Expected = 54.69, Std = 2.0300, ChiSquare = 5.6286e-03 1.D60 CB = 41.9081(D), Expected = 40.88, Std = 1.6200, ChiSquare = 5.2567e-01 1.D60 H = 8.8412(D), Expected = 8.31, Std = 0.5800, ChiSquare = 3.5974e-01 1.D60 N = 119.9810(D), Expected = 120.65, Std = 3.8600, ChiSquare = 8.6240e-01 1.P61 CA = 63.0943(D), Expected = 63.33, Std = 1.5200, ChiSquare = 8.7677e-01 1.P61 CB = 31.2664(D), Expected = 31.85, Std = 1.1800, ChiSquare = 6.2090e-01 1.E62 CA = 56.6343(D), Expected = 57.32, Std = 2.0900, ChiSquare = 7.4285e-01 1.E62 CB = 28.6869(D), Expected = 30.01, Std = 1.7200, ChiSquare = 4.4175e-01 1.E62 H = 8.4879(D), Expected = 8.33, Std = 0.5900, ChiSquare = 7.8899e-01 1.E62 N = 117.0218(D), Expected = 120.67, Std = 3.4800, ChiSquare = 2.9449e-01 1.V63 CA = 60.5739(D), Expected = 62.49, Std = 2.8600, ChiSquare = 5.0288e-01 1.V63 H = 8.1435(D), Expected = 8.29, Std = 0.6700, ChiSquare = 8.2692e-01 1.V63 N = 120.9721(D), Expected = 121.14, Std = 4.5400, ChiSquare = 9.7050e-01 1.I64 CA = 59.4164(D), Expected = 61.61, Std = 2.6800, ChiSquare = 4.1307e-01 1.I64 CB = 38.7763(D), Expected = 38.63, Std = 2.0200, ChiSquare = 9.4226e-01 1.I64 H = 8.2085(D), Expected = 8.28, Std = 0.6800, ChiSquare = 9.1626e-01 1.I64 N = 134.9833(D), Expected = 121.46, Std = 4.2800, ChiSquare = 1.5796e-03 1.H65 CA = 55.1726(D), Expected = 56.52, Std = 2.3100, ChiSquare = 5.5970e-01 1.H65 CB = 29.1549(D), Expected = 30.24, Std = 2.0700, ChiSquare = 6.0014e-01 1.H65 H = 8.1508(D), Expected = 8.24, Std = 0.6800, ChiSquare = 8.9564e-01 1.H65 N = 120.3798(D), Expected = 119.69, Std = 4.0000, ChiSquare = 8.6308e-01 1.T66 CA = 65.9977(D), Expected = 62.22, Std = 2.5900, ChiSquare = 1.4468e-01 1.T66 CB = 67.0398(D), Expected = 69.73, Std = 1.6300, ChiSquare = 9.8855e-02 1.T66 H = 9.0064(D), Expected = 8.24, Std = 0.6200, ChiSquare = 2.1641e-01 1.T66 N = 116.1009(D), Expected = 115.42, Std = 4.7500, ChiSquare = 8.8602e-01 1.T67 CA = 64.5327(D), Expected = 62.22, Std = 2.5900, ChiSquare = 3.7189e-01 1.T67 CB = 67.6806(D), Expected = 69.73, Std = 1.6300, ChiSquare = 2.0864e-01 1.T67 H = 8.2411(D), Expected = 8.24, Std = 0.6200, ChiSquare = 9.9858e-01 1.T67 N = 112.9264(D), Expected = 115.42, Std = 4.7500, ChiSquare = 5.9961e-01 1.T68 CA = 65.1368(D), Expected = 62.22, Std = 2.5900, ChiSquare = 2.6009e-01 1.T68 CB = 67.6895(D), Expected = 69.73, Std = 1.6300, ChiSquare = 2.1063e-01 1.T68 H = 7.2905(D), Expected = 8.24, Std = 0.6200, ChiSquare = 1.2566e-01 1.T68 N = 120.5884(D), Expected = 115.42, Std = 4.7500, ChiSquare = 2.7656e-01 1.I69 CA = 62.3432(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.8441e-01 1.I69 CB = 34.2967(D), Expected = 38.63, Std = 2.0200, ChiSquare = 3.1937e-02 1.I69 H = 7.2931(D), Expected = 8.28, Std = 0.6800, ChiSquare = 1.4669e-01 1.I69 N = 121.7335(D), Expected = 121.46, Std = 4.2800, ChiSquare = 9.4905e-01 1.N70 CA = 54.5977(D), Expected = 53.54, Std = 1.8800, ChiSquare = 5.7370e-01 1.N70 CB = 39.1861(D), Expected = 38.69, Std = 1.6900, ChiSquare = 7.6910e-01 1.N70 H = 8.3687(D), Expected = 8.34, Std = 0.6300, ChiSquare = 9.6366e-01 1.N70 N = 116.5561(D), Expected = 118.93, Std = 4.0300, ChiSquare = 5.5582e-01 1.A71 CA = 51.5692(D), Expected = 53.14, Std = 1.9800, ChiSquare = 4.2758e-01 1.A71 CB = 17.8360(D), Expected = 19.01, Std = 1.8300, ChiSquare = 5.2118e-01 1.A71 H = 7.1688(D), Expected = 8.20, Std = 0.6000, ChiSquare = 8.5675e-02 1.A71 N = 116.7929(D), Expected = 123.23, Std = 3.5400, ChiSquare = 6.9005e-02 1.T72 CA = 64.1113(D), Expected = 62.22, Std = 2.5900, ChiSquare = 4.6525e-01 1.T72 CB = 68.5493(D), Expected = 69.73, Std = 1.6300, ChiSquare = 4.6885e-01 1.T72 H = 7.3212(D), Expected = 8.24, Std = 0.6200, ChiSquare = 1.3836e-01 1.T72 N = 118.4879(D), Expected = 115.42, Std = 4.7500, ChiSquare = 5.1836e-01 1.R73 CA = 57.6779(D), Expected = 56.77, Std = 2.3100, ChiSquare = 6.9430e-01 1.R73 CB = 28.4352(D), Expected = 30.70, Std = 1.8300, ChiSquare = 2.1587e-01 1.R73 H = 8.6410(D), Expected = 8.24, Std = 0.6100, ChiSquare = 5.1094e-01 1.R73 N = 129.3125(D), Expected = 120.80, Std = 3.6800, ChiSquare = 2.0713e-02 1.G74 CA = 44.7008(D), Expected = 45.35, Std = 1.3400, ChiSquare = 6.2805e-01 1.G74 H = 8.4680(D), Expected = 8.33, Std = 0.6500, ChiSquare = 8.3187e-01 1.G74 N = 109.4151(D), Expected = 109.67, Std = 3.8700, ChiSquare = 9.4749e-01 1.V75 CA = 63.5563(D), Expected = 62.49, Std = 2.8600, ChiSquare = 7.0927e-01 1.V75 CB = 31.4930(D), Expected = 32.73, Std = 1.7900, ChiSquare = 4.8953e-01 1.V75 H = 7.7420(D), Expected = 8.29, Std = 0.6700, ChiSquare = 4.1341e-01 1.V75 N = 121.1565(D), Expected = 121.14, Std = 4.5400, ChiSquare = 9.9710e-01 1.S76 CA = 58.9112(D), Expected = 58.72, Std = 2.0700, ChiSquare = 9.2641e-01 1.S76 CB = 62.1459(D), Expected = 63.80, Std = 1.4800, ChiSquare = 2.6372e-01 1.S76 H = 8.9328(D), Expected = 8.28, Std = 0.5900, ChiSquare = 2.6854e-01 1.S76 N = 119.8262(D), Expected = 116.28, Std = 3.5200, ChiSquare = 3.1372e-01 1.H77 CA = 55.5834(D), Expected = 56.52, Std = 2.3100, ChiSquare = 6.8514e-01 1.H77 CB = 30.7963(D), Expected = 30.24, Std = 2.0700, ChiSquare = 7.8813e-01 1.H77 H = 7.7496(D), Expected = 8.24, Std = 0.6800, ChiSquare = 4.7080e-01 1.H77 N = 110.5564(D), Expected = 119.69, Std = 4.0000, ChiSquare = 2.2407e-02 1.F78 CA = 57.9687(D), Expected = 58.08, Std = 2.5700, ChiSquare = 9.6546e-01 1.F78 CB = 39.5443(D), Expected = 39.99, Std = 2.0900, ChiSquare = 8.3113e-01 1.F78 H = 8.9229(D), Expected = 8.36, Std = 0.7200, ChiSquare = 4.3433e-01 1.F78 N = 116.6547(D), Expected = 120.45, Std = 4.1800, ChiSquare = 3.6390e-01 1.V79 CA = 64.0178(D), Expected = 62.49, Std = 2.8600, ChiSquare = 5.9321e-01 1.V79 CB = 30.8485(D), Expected = 32.73, Std = 1.7900, ChiSquare = 2.9320e-01 1.V79 H = 9.2250(D), Expected = 8.29, Std = 0.6700, ChiSquare = 1.6286e-01 1.V79 N = 122.8793(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.0164e-01 1.R80 CA = 55.5497(D), Expected = 56.77, Std = 2.3100, ChiSquare = 5.9731e-01 1.R80 CB = 32.8580(D), Expected = 30.70, Std = 1.8300, ChiSquare = 2.3830e-01 1.R80 H = 8.7046(D), Expected = 8.24, Std = 0.6100, ChiSquare = 4.4628e-01 1.R80 N = 128.1996(D), Expected = 120.80, Std = 3.6800, ChiSquare = 4.4351e-02 1.F81 CA = 57.2636(D), Expected = 58.08, Std = 2.5700, ChiSquare = 7.5074e-01 1.F81 CB = 38.9844(D), Expected = 39.99, Std = 2.0900, ChiSquare = 6.3041e-01 1.F81 H = 8.7238(D), Expected = 8.36, Std = 0.7200, ChiSquare = 6.1336e-01 1.F81 N = 121.5458(D), Expected = 120.45, Std = 4.1800, ChiSquare = 7.9320e-01 1.G82 CA = 45.1568(D), Expected = 45.35, Std = 1.3400, ChiSquare = 8.8536e-01 1.G82 H = 8.4000(D), Expected = 8.33, Std = 0.6500, ChiSquare = 9.1424e-01 1.G82 N = 114.1821(D), Expected = 109.67, Std = 3.8700, ChiSquare = 2.4365e-01 1.A83 CA = 53.0891(D), Expected = 53.14, Std = 1.9800, ChiSquare = 9.7949e-01 1.A83 CB = 18.5508(D), Expected = 19.01, Std = 1.8300, ChiSquare = 8.0187e-01 1.A83 H = 8.7773(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.3597e-01 1.A83 N = 126.2488(D), Expected = 123.23, Std = 3.5400, ChiSquare = 3.9379e-01 1.S84 CA = 56.3847(D), Expected = 58.72, Std = 2.0700, ChiSquare = 2.5925e-01 1.S84 CB = 63.1997(D), Expected = 63.80, Std = 1.4800, ChiSquare = 6.8503e-01 1.S84 H = 7.7882(D), Expected = 8.28, Std = 0.5900, ChiSquare = 4.0453e-01 1.S84 N = 113.3357(D), Expected = 116.28, Std = 3.5200, ChiSquare = 4.0290e-01 1.P85 CA = 62.5919(D), Expected = 63.33, Std = 1.5200, ChiSquare = 6.2726e-01 1.P85 CB = 33.2756(D), Expected = 31.85, Std = 1.1800, ChiSquare = 2.2699e-01 1.A86 CA = 52.0224(D), Expected = 53.14, Std = 1.9800, ChiSquare = 5.7245e-01 1.A86 CB = 18.1302(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.3068e-01 1.A86 H = 8.5847(D), Expected = 8.20, Std = 0.6000, ChiSquare = 5.2141e-01 1.A86 N = 123.9832(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.3151e-01 1.I87 CA = 59.4797(D), Expected = 61.61, Std = 2.6800, ChiSquare = 4.2668e-01 1.I87 CB = 36.9822(D), Expected = 38.63, Std = 2.0200, ChiSquare = 4.1465e-01 1.I87 H = 8.0873(D), Expected = 8.28, Std = 0.6800, ChiSquare = 7.7688e-01 1.I87 N = 123.1867(D), Expected = 121.46, Std = 4.2800, ChiSquare = 6.8663e-01 1.V88 CA = 60.0534(D), Expected = 62.49, Std = 2.8600, ChiSquare = 3.9424e-01 1.V88 CB = 31.4585(D), Expected = 32.73, Std = 1.7900, ChiSquare = 4.7750e-01 1.V88 H = 8.9360(D), Expected = 8.29, Std = 0.6700, ChiSquare = 3.3496e-01 1.V88 N = 130.3954(D), Expected = 121.14, Std = 4.5400, ChiSquare = 4.1487e-02 1.S90 CA = 61.5946(D), Expected = 58.72, Std = 2.0700, ChiSquare = 1.6493e-01 1.A91 CA = 54.7156(D), Expected = 53.14, Std = 1.9800, ChiSquare = 4.2617e-01 1.A91 CB = 18.1090(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.2247e-01 1.A91 H = 8.9626(D), Expected = 8.20, Std = 0.6000, ChiSquare = 2.0373e-01 1.A91 N = 121.7554(D), Expected = 123.23, Std = 3.5400, ChiSquare = 6.7700e-01 1.V92 CA = 65.2956(D), Expected = 62.49, Std = 2.8600, ChiSquare = 3.2660e-01 1.V92 CB = 30.1929(D), Expected = 32.73, Std = 1.7900, ChiSquare = 1.5637e-01 1.V92 H = 7.2391(D), Expected = 8.29, Std = 0.6700, ChiSquare = 1.1676e-01 1.V92 N = 115.8254(D), Expected = 121.14, Std = 4.5400, ChiSquare = 2.4175e-01 1.I93 CA = 60.8206(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.6834e-01 1.I93 CB = 33.8955(D), Expected = 38.63, Std = 2.0200, ChiSquare = 1.9088e-02 1.I93 H = 6.6325(D), Expected = 8.28, Std = 0.6800, ChiSquare = 1.5402e-02 1.I93 N = 117.7523(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.8633e-01 1.H94 CA = 58.5353(D), Expected = 56.52, Std = 2.3100, ChiSquare = 3.8298e-01 1.H94 CB = 28.3627(D), Expected = 30.24, Std = 2.0700, ChiSquare = 3.6446e-01 1.H94 H = 8.3251(D), Expected = 8.24, Std = 0.6800, ChiSquare = 9.0041e-01 1.H94 N = 117.6098(D), Expected = 119.69, Std = 4.0000, ChiSquare = 6.0303e-01 1.Q95 CA = 56.4265(D), Expected = 56.57, Std = 2.1400, ChiSquare = 9.4654e-01 1.Q95 CB = 29.2079(D), Expected = 29.19, Std = 1.8200, ChiSquare = 9.9215e-01 1.Q95 H = 7.4164(D), Expected = 8.22, Std = 0.5900, ChiSquare = 1.7319e-01 1.Q95 N = 116.3898(D), Expected = 119.89, Std = 3.6000, ChiSquare = 3.3091e-01 1.L96 CA = 54.0332(D), Expected = 55.62, Std = 2.1300, ChiSquare = 4.5629e-01 1.L96 CB = 40.6867(D), Expected = 42.31, Std = 1.8800, ChiSquare = 3.8789e-01 1.L96 H = 8.3133(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.9803e-01 1.L96 N = 120.7927(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.8434e-01 1.S97 CA = 60.0382(D), Expected = 58.72, Std = 2.0700, ChiSquare = 5.2425e-01 1.S97 CB = 62.8262(D), Expected = 63.80, Std = 1.4800, ChiSquare = 5.1056e-01 1.S97 H = 7.6533(D), Expected = 8.28, Std = 0.5900, ChiSquare = 2.8814e-01 1.S97 N = 112.4958(D), Expected = 116.28, Std = 3.5200, ChiSquare = 2.8235e-01 1.V98 CA = 61.7276(D), Expected = 62.49, Std = 2.8600, ChiSquare = 7.8980e-01 1.V98 CB = 31.1484(D), Expected = 32.73, Std = 1.7900, ChiSquare = 3.7693e-01 1.V98 H = 7.1752(D), Expected = 8.29, Std = 0.6700, ChiSquare = 9.6136e-02 1.V98 N = 115.0022(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.7639e-01 1.Y99 CA = 58.5207(D), Expected = 58.13, Std = 2.5100, ChiSquare = 8.7630e-01 1.Y99 CB = 37.4064(D), Expected = 39.32, Std = 2.1600, ChiSquare = 3.7566e-01 1.Y99 H = 7.5199(D), Expected = 8.32, Std = 0.7300, ChiSquare = 2.7307e-01 1.Y99 N = 122.0869(D), Expected = 120.52, Std = 4.2000, ChiSquare = 7.0910e-01 1.K100 CA = 52.8611(D), Expected = 56.95, Std = 2.2000, ChiSquare = 6.3085e-02 1.K100 CB = 32.2244(D), Expected = 32.79, Std = 1.7800, ChiSquare = 7.5067e-01 1.K100 H = 7.4957(D), Expected = 8.19, Std = 0.6000, ChiSquare = 2.4720e-01 1.K100 N = 125.3257(D), Expected = 121.05, Std = 3.7700, ChiSquare = 2.5674e-01 1.P101 CA = 62.4561(D), Expected = 63.33, Std = 1.5200, ChiSquare = 5.6534e-01 1.K102 CA = 56.0036(D), Expected = 56.95, Std = 2.2000, ChiSquare = 6.6706e-01 1.K102 CB = 31.9497(D), Expected = 32.79, Std = 1.7800, ChiSquare = 6.3687e-01 1.K102 H = 8.2474(D), Expected = 8.19, Std = 0.6000, ChiSquare = 9.2379e-01 1.K102 N = 123.7900(D), Expected = 121.05, Std = 3.7700, ChiSquare = 4.6735e-01 1.D103 CA = 54.0875(D), Expected = 54.69, Std = 2.0300, ChiSquare = 7.6662e-01 1.D103 CB = 40.5919(D), Expected = 40.88, Std = 1.6200, ChiSquare = 8.5885e-01 1.D103 H = 8.2514(D), Expected = 8.31, Std = 0.5800, ChiSquare = 9.1952e-01 1.D103 N = 120.7116(D), Expected = 120.65, Std = 3.8600, ChiSquare = 9.8727e-01 1.I104 CA = 60.7311(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.4295e-01 1.I104 CB = 37.6768(D), Expected = 38.63, Std = 2.0200, ChiSquare = 6.3701e-01 1.I104 H = 7.9445(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.2174e-01 1.I104 N = 120.0657(D), Expected = 121.46, Std = 4.2800, ChiSquare = 7.4460e-01 1.V105 CA = 61.7000(D), Expected = 62.49, Std = 2.8600, ChiSquare = 7.8238e-01 1.V105 CB = 31.8089(D), Expected = 32.73, Std = 1.7900, ChiSquare = 6.0685e-01 1.V105 H = 8.1451(D), Expected = 8.29, Std = 0.6700, ChiSquare = 8.2878e-01 1.V105 N = 123.9316(D), Expected = 121.14, Std = 4.5400, ChiSquare = 5.3863e-01 1.D106 CA = 51.5290(D), Expected = 54.69, Std = 2.0300, ChiSquare = 1.1944e-01 1.D106 CB = 40.8232(D), Expected = 40.88, Std = 1.6200, ChiSquare = 9.7203e-01 1.D106 H = 8.3644(D), Expected = 8.31, Std = 0.5800, ChiSquare = 9.2527e-01 1.D106 N = 125.1722(D), Expected = 120.65, Std = 3.8600, ChiSquare = 2.4138e-01 1.P107 CA = 63.6907(D), Expected = 63.33, Std = 1.5200, ChiSquare = 8.1242e-01 1.P107 CB = 31.5813(D), Expected = 31.85, Std = 1.1800, ChiSquare = 8.1987e-01 1.A108 CA = 52.1134(D), Expected = 53.14, Std = 1.9800, ChiSquare = 6.0412e-01 1.A108 CB = 18.1508(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.3871e-01 1.A108 H = 9.0354(D), Expected = 8.20, Std = 0.6000, ChiSquare = 1.6382e-01 1.A108 N = 127.7792(D), Expected = 123.23, Std = 3.5400, ChiSquare = 1.9876e-01 1.T109 CA = 59.2919(D), Expected = 62.22, Std = 2.5900, ChiSquare = 2.5825e-01 1.T109 CB = 69.3366(D), Expected = 69.73, Std = 1.6300, ChiSquare = 8.0928e-01 1.T109 H = 7.8287(D), Expected = 8.24, Std = 0.6200, ChiSquare = 5.0708e-01 1.T109 N = 115.2501(D), Expected = 115.42, Std = 4.7500, ChiSquare = 9.7147e-01 1.P110 CA = 62.6995(D), Expected = 63.33, Std = 1.5200, ChiSquare = 6.7829e-01 1.P110 CB = 31.0220(D), Expected = 31.85, Std = 1.1800, ChiSquare = 4.8287e-01 1.Y111 CA = 55.2070(D), Expected = 58.13, Std = 2.5100, ChiSquare = 2.4420e-01 1.Y111 CB = 37.5265(D), Expected = 39.32, Std = 2.1600, ChiSquare = 4.0636e-01 1.Y111 H = 8.3073(D), Expected = 8.32, Std = 0.7300, ChiSquare = 9.8612e-01 1.Y111 N = 121.8578(D), Expected = 120.52, Std = 4.2000, ChiSquare = 7.5009e-01 1.P112 CA = 63.1364(D), Expected = 63.33, Std = 1.5200, ChiSquare = 8.9865e-01 1.G113 CA = 44.7871(D), Expected = 45.35, Std = 1.3400, ChiSquare = 6.7443e-01 1.G113 H = 7.8162(D), Expected = 8.33, Std = 0.6500, ChiSquare = 4.2926e-01 1.G113 N = 108.2331(D), Expected = 109.67, Std = 3.8700, ChiSquare = 7.1042e-01 1.D114 CA = 53.8783(D), Expected = 54.69, Std = 2.0300, ChiSquare = 6.8927e-01 1.D114 CB = 40.4568(D), Expected = 40.88, Std = 1.6200, ChiSquare = 7.9391e-01 1.D114 H = 8.1696(D), Expected = 8.31, Std = 0.5800, ChiSquare = 8.0873e-01 1.D114 N = 119.8062(D), Expected = 120.65, Std = 3.8600, ChiSquare = 8.2696e-01 1.K115 CA = 55.7530(D), Expected = 56.95, Std = 2.2000, ChiSquare = 5.8638e-01 1.K115 CB = 31.8792(D), Expected = 32.79, Std = 1.7800, ChiSquare = 6.0887e-01 1.K115 H = 8.1140(D), Expected = 8.19, Std = 0.6000, ChiSquare = 8.9920e-01 1.K115 N = 120.4288(D), Expected = 121.05, Std = 3.7700, ChiSquare = 8.6912e-01 1.V116 CA = 62.0759(D), Expected = 62.49, Std = 2.8600, ChiSquare = 8.8488e-01 1.V116 CB = 31.6514(D), Expected = 32.73, Std = 1.7900, ChiSquare = 5.4679e-01 1.V116 H = 8.0697(D), Expected = 8.29, Std = 0.6700, ChiSquare = 7.4230e-01 1.V116 N = 121.8930(D), Expected = 121.14, Std = 4.5400, ChiSquare = 8.6827e-01 1.I117 CA = 60.3505(D), Expected = 61.61, Std = 2.6800, ChiSquare = 6.3838e-01 1.I117 CB = 37.4789(D), Expected = 38.63, Std = 2.0200, ChiSquare = 5.6878e-01 1.I117 H = 8.2278(D), Expected = 8.28, Std = 0.6800, ChiSquare = 9.3881e-01 1.I117 N = 125.5438(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.4000e-01 1.I118 CA = 60.2780(D), Expected = 61.61, Std = 2.6800, ChiSquare = 6.1918e-01 1.I118 CB = 37.3279(D), Expected = 38.63, Std = 2.0200, ChiSquare = 5.1918e-01 1.I118 H = 8.3123(D), Expected = 8.28, Std = 0.6800, ChiSquare = 9.6211e-01 1.I118 N = 125.8475(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.0531e-01 1.T119 CA = 61.2579(D), Expected = 62.22, Std = 2.5900, ChiSquare = 7.1029e-01 1.T119 CB = 69.3448(D), Expected = 69.73, Std = 1.6300, ChiSquare = 8.1319e-01 1.T119 H = 8.2086(D), Expected = 8.24, Std = 0.6200, ChiSquare = 9.5961e-01 1.T119 N = 117.9747(D), Expected = 115.42, Std = 4.7500, ChiSquare = 5.9069e-01 1.E120 CA = 56.6231(D), Expected = 57.32, Std = 2.0900, ChiSquare = 7.3880e-01 1.E120 CB = 29.3245(D), Expected = 30.01, Std = 1.7200, ChiSquare = 6.9023e-01 1.E120 H = 8.3832(D), Expected = 8.33, Std = 0.5900, ChiSquare = 9.2815e-01 1.E120 N = 122.9175(D), Expected = 120.67, Std = 3.4800, ChiSquare = 5.1839e-01 1.G121 CA = 45.2594(D), Expected = 45.35, Std = 1.3400, ChiSquare = 9.4609e-01 1.G121 H = 8.6011(D), Expected = 8.33, Std = 0.6500, ChiSquare = 6.7662e-01 1.G121 N = 110.3217(D), Expected = 109.67, Std = 3.8700, ChiSquare = 8.6627e-01 1.A122 CA = 52.7819(D), Expected = 53.14, Std = 1.9800, ChiSquare = 8.5648e-01 1.A122 CB = 18.0678(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.0665e-01 1.A122 H = 8.2447(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.4061e-01 1.A122 N = 123.6765(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.9963e-01 1.F123 CA = 58.2478(D), Expected = 58.08, Std = 2.5700, ChiSquare = 9.4794e-01 1.F123 CB = 38.3526(D), Expected = 39.99, Std = 2.0900, ChiSquare = 4.3337e-01 1.F123 H = 8.2972(D), Expected = 8.36, Std = 0.7200, ChiSquare = 9.3050e-01 1.F123 N = 118.3329(D), Expected = 120.45, Std = 4.1800, ChiSquare = 6.1252e-01 1.E124 CA = 58.0361(D), Expected = 57.32, Std = 2.0900, ChiSquare = 7.3188e-01 1.E124 CB = 28.7402(D), Expected = 30.01, Std = 1.7200, ChiSquare = 4.6036e-01 1.E124 H = 8.4988(D), Expected = 8.33, Std = 0.5900, ChiSquare = 7.7480e-01 1.E124 N = 122.5164(D), Expected = 120.67, Std = 3.4800, ChiSquare = 5.9571e-01 1.G125 CA = 45.5579(D), Expected = 45.35, Std = 1.3400, ChiSquare = 8.7670e-01 1.G125 H = 8.4366(D), Expected = 8.33, Std = 0.6500, ChiSquare = 8.6973e-01 1.G125 N = 109.2290(D), Expected = 109.67, Std = 3.8700, ChiSquare = 9.0927e-01 1.F126 CA = 60.8063(D), Expected = 58.08, Std = 2.5700, ChiSquare = 2.8877e-01 1.F126 CB = 37.8114(D), Expected = 39.99, Std = 2.0900, ChiSquare = 2.9723e-01 1.F126 H = 8.2552(D), Expected = 8.36, Std = 0.7200, ChiSquare = 8.8427e-01 1.F126 N = 120.1014(D), Expected = 120.45, Std = 4.1800, ChiSquare = 9.3354e-01 1.Q127 CA = 58.8926(D), Expected = 56.57, Std = 2.1400, ChiSquare = 2.7778e-01 1.Q127 CB = 26.8985(D), Expected = 29.19, Std = 1.8200, ChiSquare = 2.0801e-01 1.Q127 H = 8.4210(D), Expected = 8.22, Std = 0.5900, ChiSquare = 7.3335e-01 1.Q127 N = 118.4032(D), Expected = 119.89, Std = 3.6000, ChiSquare = 6.7961e-01 1.A128 CA = 53.7425(D), Expected = 53.14, Std = 1.9800, ChiSquare = 7.6090e-01 1.A128 CB = 17.5481(D), Expected = 19.01, Std = 1.8300, ChiSquare = 4.2438e-01 1.A128 H = 7.5951(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.1337e-01 1.A128 N = 119.6675(D), Expected = 123.23, Std = 3.5400, ChiSquare = 3.1424e-01 1.I129 CA = 65.5459(D), Expected = 61.61, Std = 2.6800, ChiSquare = 1.4194e-01 1.I129 CB = 37.0472(D), Expected = 38.63, Std = 2.0200, ChiSquare = 4.3330e-01 1.I129 H = 7.3931(D), Expected = 8.28, Std = 0.6800, ChiSquare = 1.9214e-01 1.I129 N = 117.4198(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.4518e-01 1.F130 CA = 59.0073(D), Expected = 58.08, Std = 2.5700, ChiSquare = 7.1824e-01 1.F130 CB = 37.7562(D), Expected = 39.99, Std = 2.0900, ChiSquare = 2.8516e-01 1.F130 H = 7.5432(D), Expected = 8.36, Std = 0.7200, ChiSquare = 2.5661e-01 1.F130 N = 111.4574(D), Expected = 120.45, Std = 4.1800, ChiSquare = 3.1449e-02 1.T131 CA = 60.8138(D), Expected = 62.22, Std = 2.5900, ChiSquare = 5.8717e-01 1.T131 CB = 69.2075(D), Expected = 69.73, Std = 1.6300, ChiSquare = 7.4855e-01 1.T131 H = 7.2731(D), Expected = 8.24, Std = 0.6200, ChiSquare = 1.1887e-01 1.T131 N = 106.1368(D), Expected = 115.42, Std = 4.7500, ChiSquare = 5.0659e-02 1.E132 CA = 51.9339(D), Expected = 57.32, Std = 2.0900, ChiSquare = 9.9639e-03 1.E132 CB = 29.7084(D), Expected = 30.01, Std = 1.7200, ChiSquare = 8.6081e-01 1.E132 H = 7.1915(D), Expected = 8.33, Std = 0.5900, ChiSquare = 5.3649e-02 1.E132 N = 127.6562(D), Expected = 120.67, Std = 3.4800, ChiSquare = 4.4693e-02 1.P133 CA = 64.0203(D), Expected = 63.33, Std = 1.5200, ChiSquare = 6.4972e-01 1.P133 CB = 31.6750(D), Expected = 31.85, Std = 1.1800, ChiSquare = 8.8210e-01 1.D134 CA = 53.5062(D), Expected = 54.69, Std = 2.0300, ChiSquare = 5.5979e-01 1.D134 CB = 42.0486(D), Expected = 40.88, Std = 1.6200, ChiSquare = 4.7069e-01 1.D134 H = 9.6264(D), Expected = 8.31, Std = 0.5800, ChiSquare = 2.3229e-02 1.D134 N = 122.5344(D), Expected = 120.65, Std = 3.8600, ChiSquare = 6.2542e-01 1.G135 CA = 47.5143(D), Expected = 45.35, Std = 1.3400, ChiSquare = 1.0628e-01 1.G135 H = 9.4618(D), Expected = 8.33, Std = 0.6500, ChiSquare = 8.1643e-02 1.G135 N = 116.4038(D), Expected = 109.67, Std = 3.8700, ChiSquare = 8.1859e-02 1.E136 CA = 58.9992(D), Expected = 57.32, Std = 2.0900, ChiSquare = 4.2172e-01 1.E136 CB = 27.5859(D), Expected = 30.01, Std = 1.7200, ChiSquare = 1.5873e-01 1.E136 H = 8.2462(D), Expected = 8.33, Std = 0.5900, ChiSquare = 8.8705e-01 1.E136 N = 121.1479(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.9077e-01 1.A137 CA = 54.5596(D), Expected = 53.14, Std = 1.9800, ChiSquare = 4.7339e-01 1.A137 CB = 16.9996(D), Expected = 19.01, Std = 1.8300, ChiSquare = 2.7195e-01 1.A137 H = 7.9684(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.9950e-01 1.A137 N = 123.4317(D), Expected = 123.23, Std = 3.5400, ChiSquare = 9.5456e-01 1.R138 CA = 61.8973(D), Expected = 56.77, Std = 2.3100, ChiSquare = 2.6445e-02 1.R138 CB = 30.1134(D), Expected = 30.70, Std = 1.8300, ChiSquare = 7.4855e-01 1.R138 H = 8.5560(D), Expected = 8.24, Std = 0.6100, ChiSquare = 6.0444e-01 1.R138 N = 119.4613(D), Expected = 120.80, Std = 3.6800, ChiSquare = 7.1602e-01 1.S139 CA = 61.7836(D), Expected = 58.72, Std = 2.0700, ChiSquare = 1.3887e-01 1.M140 CA = 58.0578(D), Expected = 56.11, Std = 2.2300, ChiSquare = 3.8242e-01 1.M140 CB = 30.9680(D), Expected = 32.99, Std = 2.2400, ChiSquare = 3.6670e-01 1.L141 CA = 57.6199(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.4777e-01 1.L141 CB = 41.2950(D), Expected = 42.31, Std = 1.8800, ChiSquare = 5.8927e-01 1.L141 H = 7.9260(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.4000e-01 1.L141 N = 119.8101(D), Expected = 121.86, Std = 3.9000, ChiSquare = 5.9916e-01 1.L142 CA = 57.5644(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.6131e-01 1.L142 CB = 38.9622(D), Expected = 42.31, Std = 1.8800, ChiSquare = 7.4954e-02 1.L142 H = 8.0771(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.1403e-01 1.L142 N = 121.4530(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.1688e-01 1.L143 CA = 57.9924(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.6536e-01 1.L143 CB = 39.4880(D), Expected = 42.31, Std = 1.8800, ChiSquare = 1.3334e-01 1.L143 H = 8.1139(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.5824e-01 1.L143 N = 118.1462(D), Expected = 121.86, Std = 3.9000, ChiSquare = 3.4097e-01 1.N144 CA = 55.6295(D), Expected = 53.54, Std = 1.8800, ChiSquare = 2.6638e-01 1.N144 CB = 37.7722(D), Expected = 38.69, Std = 1.6900, ChiSquare = 5.8708e-01 1.N144 H = 7.7093(D), Expected = 8.34, Std = 0.6300, ChiSquare = 3.1677e-01 1.N144 N = 116.4224(D), Expected = 118.93, Std = 4.0300, ChiSquare = 5.3379e-01 1.L145 CA = 57.9749(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.6891e-01 1.L145 CB = 41.0129(D), Expected = 42.31, Std = 1.8800, ChiSquare = 4.9023e-01 1.L145 H = 7.9235(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.3726e-01 1.L145 N = 122.2474(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.2087e-01 1.I146 CA = 65.1018(D), Expected = 61.61, Std = 2.6800, ChiSquare = 1.9261e-01 1.I146 CB = 36.9383(D), Expected = 38.63, Std = 2.0200, ChiSquare = 4.0233e-01 1.I146 H = 8.4852(D), Expected = 8.28, Std = 0.6800, ChiSquare = 7.6283e-01 1.I146 N = 116.9118(D), Expected = 121.46, Std = 4.2800, ChiSquare = 2.8793e-01 1.N147 CA = 55.6689(D), Expected = 53.54, Std = 1.8800, ChiSquare = 2.5747e-01 1.N147 CB = 38.1173(D), Expected = 38.69, Std = 1.6900, ChiSquare = 7.3470e-01 1.N147 H = 7.7303(D), Expected = 8.34, Std = 0.6300, ChiSquare = 3.3316e-01 1.N147 N = 117.2984(D), Expected = 118.93, Std = 4.0300, ChiSquare = 6.8558e-01 1.K148 CA = 58.4863(D), Expected = 56.95, Std = 2.2000, ChiSquare = 4.8498e-01 1.K148 CB = 31.5980(D), Expected = 32.79, Std = 1.7800, ChiSquare = 5.0307e-01 1.K148 H = 7.8638(D), Expected = 8.19, Std = 0.6000, ChiSquare = 5.8667e-01 1.K148 N = 118.6341(D), Expected = 121.05, Std = 3.7700, ChiSquare = 5.2164e-01 1.E149 CA = 57.4766(D), Expected = 57.32, Std = 2.0900, ChiSquare = 9.4027e-01 1.E149 CB = 28.7584(D), Expected = 30.01, Std = 1.7200, ChiSquare = 4.6681e-01 1.E149 H = 8.2301(D), Expected = 8.33, Std = 0.5900, ChiSquare = 8.6554e-01 1.E149 N = 118.7551(D), Expected = 120.67, Std = 3.4800, ChiSquare = 5.8214e-01 1.I150 CA = 63.9123(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.9030e-01 1.I150 CB = 37.1172(D), Expected = 38.63, Std = 2.0200, ChiSquare = 4.5391e-01 1.I150 H = 8.2770(D), Expected = 8.28, Std = 0.6800, ChiSquare = 9.9648e-01 1.I150 N = 121.2309(D), Expected = 121.46, Std = 4.2800, ChiSquare = 9.5731e-01 1.K151 CA = 57.8684(D), Expected = 56.95, Std = 2.2000, ChiSquare = 6.7635e-01 1.K151 CB = 31.5069(D), Expected = 32.79, Std = 1.7800, ChiSquare = 4.7101e-01 1.K151 H = 8.0260(D), Expected = 8.19, Std = 0.6000, ChiSquare = 7.8460e-01 1.K151 N = 120.9175(D), Expected = 121.05, Std = 3.7700, ChiSquare = 9.7196e-01 1.H152 CA = 56.2052(D), Expected = 56.52, Std = 2.3100, ChiSquare = 8.9160e-01 1.H152 CB = 28.7385(D), Expected = 30.24, Std = 2.0700, ChiSquare = 4.6823e-01 1.H152 H = 8.0617(D), Expected = 8.24, Std = 0.6800, ChiSquare = 7.9316e-01 1.H152 N = 117.2096(D), Expected = 119.69, Std = 4.0000, ChiSquare = 5.3519e-01 1.S153 CA = 58.9038(D), Expected = 58.72, Std = 2.0700, ChiSquare = 9.2925e-01 1.S153 CB = 63.2361(D), Expected = 63.80, Std = 1.4800, ChiSquare = 7.0319e-01 1.S153 H = 8.0857(D), Expected = 8.28, Std = 0.5900, ChiSquare = 7.4191e-01 1.S153 N = 115.7257(D), Expected = 116.28, Std = 3.5200, ChiSquare = 8.7487e-01 1.E158 CB = 29.2734(D), Expected = 30.01, Std = 1.7200, ChiSquare = 6.6846e-01 1.F159 CA = 57.4567(D), Expected = 58.08, Std = 2.5700, ChiSquare = 8.0837e-01 1.F159 CB = 38.5492(D), Expected = 39.99, Std = 2.0900, ChiSquare = 4.9059e-01 1.F159 H = 8.2241(D), Expected = 8.36, Std = 0.7200, ChiSquare = 8.5029e-01 1.F159 N = 121.3754(D), Expected = 120.45, Std = 4.1800, ChiSquare = 8.2479e-01 1.R160 CA = 55.3290(D), Expected = 56.77, Std = 2.3100, ChiSquare = 5.3275e-01 1.R160 CB = 30.0815(D), Expected = 30.70, Std = 1.8300, ChiSquare = 7.3538e-01 1.R160 H = 8.0817(D), Expected = 8.24, Std = 0.6100, ChiSquare = 7.9524e-01 1.R160 N = 123.2037(D), Expected = 120.80, Std = 3.6800, ChiSquare = 5.1364e-01 1.K161 CA = 55.8123(D), Expected = 56.95, Std = 2.2000, ChiSquare = 6.0506e-01 1.K161 CB = 31.9196(D), Expected = 32.79, Std = 1.7800, ChiSquare = 6.2485e-01 1.K161 H = 8.2892(D), Expected = 8.19, Std = 0.6000, ChiSquare = 8.6868e-01 1.K161 N = 123.7365(D), Expected = 121.05, Std = 3.7700, ChiSquare = 4.7609e-01 1.L162 CA = 56.25(D), Expected = 55.62, Std = 2.1300, ChiSquare = 7.6740e-01 1.L162 H = 7.9515(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.6831e-01 1.L162 N = 130.0535(D), Expected = 121.86, Std = 3.9000, ChiSquare = 3.5650e-02